USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 933 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 5 MET CE :methyl -147:sc= -2.04 (180deg=-4.01!) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.136 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.088) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -131:sc= 1.01 USER MOD Single : A 46 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0174) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 145:sc= -2! (180deg=-5.19!) USER MOD Single : A 66 LYS NZ :NH3+ 178:sc= 0.378 (180deg=0.377) USER MOD Single : A 71 ASN : amide:sc= -1.28 K(o=-1.3,f=-7.9!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 50:sc= 1.16 USER MOD Single : A 84 GLN : amide:sc= -2.12 K(o=-2.1,f=-6.9!) USER MOD Single : A 86 TYR OH : rot 130:sc= -0.377 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= -0.361 (180deg=-0.361) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 17 N GLU A 2 -15.108 1.309 8.457 1.00 0.00 N ATOM 18 CA GLU A 2 -14.893 0.395 7.349 1.00 0.00 C ATOM 19 C GLU A 2 -14.713 1.175 6.045 1.00 0.00 C ATOM 20 O GLU A 2 -15.480 2.092 5.755 1.00 0.00 O ATOM 21 CB GLU A 2 -16.043 -0.608 7.234 1.00 0.00 C ATOM 22 CG GLU A 2 -15.585 -1.889 6.535 1.00 0.00 C ATOM 23 CD GLU A 2 -16.767 -2.611 5.884 1.00 0.00 C ATOM 24 OE1 GLU A 2 -17.787 -2.776 6.587 1.00 0.00 O ATOM 25 OE2 GLU A 2 -16.623 -2.981 4.699 1.00 0.00 O ATOM 0 HA GLU A 2 -13.980 -0.169 7.541 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -16.422 -0.847 8.227 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -16.867 -0.160 6.678 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -14.840 -1.647 5.777 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -15.104 -2.549 7.257 1.00 0.00 H new ATOM 32 N TRP A 3 -13.696 0.781 5.292 1.00 0.00 N ATOM 33 CA TRP A 3 -13.406 1.432 4.026 1.00 0.00 C ATOM 34 C TRP A 3 -13.730 0.445 2.902 1.00 0.00 C ATOM 35 O TRP A 3 -13.780 -0.763 3.128 1.00 0.00 O ATOM 36 CB TRP A 3 -11.961 1.932 3.984 1.00 0.00 C ATOM 37 CG TRP A 3 -11.505 2.624 5.270 1.00 0.00 C ATOM 38 CD1 TRP A 3 -10.797 2.103 6.281 1.00 0.00 C ATOM 39 CD2 TRP A 3 -11.755 3.996 5.643 1.00 0.00 C ATOM 40 NE1 TRP A 3 -10.573 3.034 7.275 1.00 0.00 N ATOM 41 CE2 TRP A 3 -11.174 4.221 6.875 1.00 0.00 C ATOM 42 CE3 TRP A 3 -12.448 5.012 4.963 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -11.229 5.456 7.533 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -12.493 6.240 5.634 1.00 0.00 C ATOM 45 CH2 TRP A 3 -11.914 6.483 6.874 1.00 0.00 C ATOM 0 H TRP A 3 -13.063 0.019 5.535 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.025 2.320 3.899 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.301 1.088 3.784 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.852 2.627 3.151 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -10.446 1.082 6.314 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -10.061 2.879 8.143 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -12.909 4.858 3.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -10.767 5.608 8.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -13.014 7.055 5.155 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -11.992 7.460 7.327 1.00 0.00 H new ATOM 56 N GLU A 4 -13.942 0.997 1.716 1.00 0.00 N ATOM 57 CA GLU A 4 -14.260 0.180 0.557 1.00 0.00 C ATOM 58 C GLU A 4 -13.382 0.579 -0.630 1.00 0.00 C ATOM 59 O GLU A 4 -12.931 1.721 -0.717 1.00 0.00 O ATOM 60 CB GLU A 4 -15.744 0.287 0.202 1.00 0.00 C ATOM 61 CG GLU A 4 -16.103 1.710 -0.232 1.00 0.00 C ATOM 62 CD GLU A 4 -16.598 2.537 0.957 1.00 0.00 C ATOM 63 OE1 GLU A 4 -17.668 2.175 1.493 1.00 0.00 O ATOM 64 OE2 GLU A 4 -15.896 3.511 1.302 1.00 0.00 O ATOM 0 H GLU A 4 -13.900 2.000 1.533 1.00 0.00 H new ATOM 0 HA GLU A 4 -14.053 -0.862 0.803 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.981 -0.412 -0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.349 0.002 1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.231 2.190 -0.675 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.874 1.676 -1.002 1.00 0.00 H new ATOM 71 N MET A 5 -13.164 -0.383 -1.514 1.00 0.00 N ATOM 72 CA MET A 5 -12.348 -0.146 -2.693 1.00 0.00 C ATOM 73 C MET A 5 -12.645 -1.178 -3.782 1.00 0.00 C ATOM 74 O MET A 5 -13.162 -2.257 -3.496 1.00 0.00 O ATOM 75 CB MET A 5 -10.868 -0.219 -2.311 1.00 0.00 C ATOM 76 CG MET A 5 -10.396 1.099 -1.694 1.00 0.00 C ATOM 77 SD MET A 5 -8.636 1.288 -1.927 1.00 0.00 S ATOM 78 CE MET A 5 -8.104 1.365 -0.225 1.00 0.00 C ATOM 0 H MET A 5 -13.538 -1.329 -1.438 1.00 0.00 H new ATOM 0 HA MET A 5 -12.584 0.844 -3.083 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.711 -1.033 -1.603 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.271 -0.445 -3.195 1.00 0.00 H new ATOM 0 HG2 MET A 5 -10.924 1.935 -2.154 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.634 1.118 -0.631 1.00 0.00 H new ATOM 0 HE1 MET A 5 -7.239 2.023 -0.144 1.00 0.00 H new ATOM 0 HE2 MET A 5 -8.914 1.753 0.392 1.00 0.00 H new ATOM 0 HE3 MET A 5 -7.833 0.366 0.117 1.00 0.00 H new ATOM 88 N GLY A 6 -12.306 -0.811 -5.009 1.00 0.00 N ATOM 89 CA GLY A 6 -12.531 -1.691 -6.143 1.00 0.00 C ATOM 90 C GLY A 6 -11.319 -1.702 -7.077 1.00 0.00 C ATOM 91 O GLY A 6 -11.448 -1.428 -8.270 1.00 0.00 O ATOM 0 H GLY A 6 -11.877 0.084 -5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.731 -2.702 -5.789 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.415 -1.365 -6.692 1.00 0.00 H new ATOM 95 N LEU A 7 -10.170 -2.021 -6.500 1.00 0.00 N ATOM 96 CA LEU A 7 -8.936 -2.070 -7.266 1.00 0.00 C ATOM 97 C LEU A 7 -8.920 -3.342 -8.117 1.00 0.00 C ATOM 98 O LEU A 7 -9.779 -4.208 -7.961 1.00 0.00 O ATOM 99 CB LEU A 7 -7.725 -1.934 -6.341 1.00 0.00 C ATOM 100 CG LEU A 7 -7.427 -3.138 -5.445 1.00 0.00 C ATOM 101 CD1 LEU A 7 -5.963 -3.143 -5.002 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.386 -3.185 -4.253 1.00 0.00 C ATOM 0 H LEU A 7 -10.067 -2.248 -5.511 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.880 -1.225 -7.952 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.845 -1.735 -6.953 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.874 -1.061 -5.705 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.591 -4.045 -6.027 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.778 -4.009 -4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.318 -3.192 -5.879 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.748 -2.231 -4.444 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.153 -4.050 -3.632 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.278 -2.275 -3.663 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.412 -3.263 -4.614 1.00 0.00 H new ATOM 114 N GLN A 8 -7.934 -3.413 -8.999 1.00 0.00 N ATOM 115 CA GLN A 8 -7.795 -4.564 -9.875 1.00 0.00 C ATOM 116 C GLN A 8 -7.650 -5.844 -9.050 1.00 0.00 C ATOM 117 O GLN A 8 -7.122 -5.815 -7.939 1.00 0.00 O ATOM 118 CB GLN A 8 -6.610 -4.388 -10.827 1.00 0.00 C ATOM 119 CG GLN A 8 -7.077 -3.899 -12.199 1.00 0.00 C ATOM 120 CD GLN A 8 -5.911 -3.844 -13.188 1.00 0.00 C ATOM 121 OE1 GLN A 8 -4.850 -4.404 -12.968 1.00 0.00 O ATOM 122 NE2 GLN A 8 -6.166 -3.140 -14.287 1.00 0.00 N ATOM 0 H GLN A 8 -7.224 -2.692 -9.126 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.697 -4.646 -10.481 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.902 -3.675 -10.404 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.082 -5.335 -10.935 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.852 -4.564 -12.581 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -7.524 -2.910 -12.103 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.076 -2.696 -14.409 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -5.451 -3.044 -15.008 1.00 0.00 H new ATOM 131 N GLU A 9 -8.129 -6.938 -9.625 1.00 0.00 N ATOM 132 CA GLU A 9 -8.059 -8.226 -8.957 1.00 0.00 C ATOM 133 C GLU A 9 -6.602 -8.663 -8.796 1.00 0.00 C ATOM 134 O GLU A 9 -6.218 -9.182 -7.749 1.00 0.00 O ATOM 135 CB GLU A 9 -8.867 -9.281 -9.715 1.00 0.00 C ATOM 136 CG GLU A 9 -9.336 -10.393 -8.774 1.00 0.00 C ATOM 137 CD GLU A 9 -9.773 -11.630 -9.562 1.00 0.00 C ATOM 138 OE1 GLU A 9 -10.289 -11.436 -10.683 1.00 0.00 O ATOM 139 OE2 GLU A 9 -9.580 -12.742 -9.025 1.00 0.00 O ATOM 0 H GLU A 9 -8.567 -6.958 -10.546 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.498 -8.123 -7.965 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.730 -8.812 -10.189 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.258 -9.707 -10.512 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.530 -10.659 -8.090 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -10.166 -10.033 -8.165 1.00 0.00 H new ATOM 146 N GLU A 10 -5.830 -8.436 -9.848 1.00 0.00 N ATOM 147 CA GLU A 10 -4.423 -8.800 -9.837 1.00 0.00 C ATOM 148 C GLU A 10 -3.734 -8.216 -8.601 1.00 0.00 C ATOM 149 O GLU A 10 -2.848 -8.846 -8.026 1.00 0.00 O ATOM 150 CB GLU A 10 -3.728 -8.341 -11.120 1.00 0.00 C ATOM 151 CG GLU A 10 -2.759 -9.409 -11.631 1.00 0.00 C ATOM 152 CD GLU A 10 -1.822 -8.835 -12.696 1.00 0.00 C ATOM 153 OE1 GLU A 10 -1.177 -7.809 -12.391 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.772 -9.436 -13.791 1.00 0.00 O ATOM 0 H GLU A 10 -6.152 -8.004 -10.714 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.349 -9.887 -9.792 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.474 -8.126 -11.885 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.187 -7.414 -10.933 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.173 -9.801 -10.800 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.321 -10.245 -12.048 1.00 0.00 H new ATOM 161 N PHE A 11 -4.168 -7.021 -8.230 1.00 0.00 N ATOM 162 CA PHE A 11 -3.604 -6.346 -7.073 1.00 0.00 C ATOM 163 C PHE A 11 -4.035 -7.031 -5.775 1.00 0.00 C ATOM 164 O PHE A 11 -3.233 -7.190 -4.857 1.00 0.00 O ATOM 165 CB PHE A 11 -4.144 -4.914 -7.084 1.00 0.00 C ATOM 166 CG PHE A 11 -3.138 -3.874 -7.582 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.260 -3.307 -6.712 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.121 -3.518 -8.894 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.326 -2.341 -7.174 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.188 -2.553 -9.356 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.310 -1.985 -8.486 1.00 0.00 C ATOM 0 H PHE A 11 -4.904 -6.502 -8.710 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.515 -6.371 -7.121 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -5.032 -4.876 -7.714 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.458 -4.647 -6.075 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.273 -3.591 -5.670 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.818 -3.970 -9.585 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.629 -1.890 -6.483 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -2.175 -2.270 -10.398 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.600 -1.251 -8.838 1.00 0.00 H new ATOM 181 N LEU A 12 -5.302 -7.418 -5.740 1.00 0.00 N ATOM 182 CA LEU A 12 -5.849 -8.083 -4.569 1.00 0.00 C ATOM 183 C LEU A 12 -4.935 -9.243 -4.172 1.00 0.00 C ATOM 184 O LEU A 12 -4.703 -9.478 -2.987 1.00 0.00 O ATOM 185 CB LEU A 12 -7.300 -8.501 -4.819 1.00 0.00 C ATOM 186 CG LEU A 12 -8.360 -7.425 -4.574 1.00 0.00 C ATOM 187 CD1 LEU A 12 -8.248 -6.300 -5.605 1.00 0.00 C ATOM 188 CD2 LEU A 12 -9.763 -8.035 -4.542 1.00 0.00 C ATOM 0 H LEU A 12 -5.965 -7.284 -6.503 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.880 -7.398 -3.722 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.387 -8.840 -5.851 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.526 -9.357 -4.183 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.178 -6.983 -3.594 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.013 -5.549 -5.408 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.262 -5.841 -5.537 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.390 -6.708 -6.606 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.498 -7.249 -4.366 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.971 -8.519 -5.496 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.821 -8.772 -3.741 1.00 0.00 H new ATOM 200 N GLU A 13 -4.439 -9.938 -5.186 1.00 0.00 N ATOM 201 CA GLU A 13 -3.555 -11.068 -4.957 1.00 0.00 C ATOM 202 C GLU A 13 -2.195 -10.583 -4.450 1.00 0.00 C ATOM 203 O GLU A 13 -1.475 -11.327 -3.785 1.00 0.00 O ATOM 204 CB GLU A 13 -3.400 -11.908 -6.227 1.00 0.00 C ATOM 205 CG GLU A 13 -2.977 -13.339 -5.889 1.00 0.00 C ATOM 206 CD GLU A 13 -4.161 -14.301 -6.004 1.00 0.00 C ATOM 207 OE1 GLU A 13 -5.271 -13.886 -5.605 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.930 -15.431 -6.488 1.00 0.00 O ATOM 0 H GLU A 13 -4.633 -9.740 -6.168 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.000 -11.704 -4.192 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.342 -11.923 -6.775 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.658 -11.451 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.180 -13.655 -6.562 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.573 -13.373 -4.877 1.00 0.00 H new ATOM 215 N LEU A 14 -1.883 -9.340 -4.784 1.00 0.00 N ATOM 216 CA LEU A 14 -0.623 -8.747 -4.371 1.00 0.00 C ATOM 217 C LEU A 14 -0.691 -8.398 -2.883 1.00 0.00 C ATOM 218 O LEU A 14 0.264 -8.627 -2.143 1.00 0.00 O ATOM 219 CB LEU A 14 -0.271 -7.558 -5.267 1.00 0.00 C ATOM 220 CG LEU A 14 0.237 -7.901 -6.669 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.880 -6.681 -7.333 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.188 -9.099 -6.630 1.00 0.00 C ATOM 0 H LEU A 14 -2.482 -8.726 -5.337 1.00 0.00 H new ATOM 0 HA LEU A 14 0.192 -9.461 -4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.156 -6.929 -5.367 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.489 -6.961 -4.763 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.618 -8.188 -7.281 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.233 -6.952 -8.328 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.144 -5.881 -7.414 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.722 -6.340 -6.730 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.534 -9.322 -7.639 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.043 -8.864 -5.996 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.665 -9.966 -6.226 1.00 0.00 H new ATOM 234 N ILE A 15 -1.831 -7.849 -2.489 1.00 0.00 N ATOM 235 CA ILE A 15 -2.037 -7.466 -1.103 1.00 0.00 C ATOM 236 C ILE A 15 -1.820 -8.684 -0.204 1.00 0.00 C ATOM 237 O ILE A 15 -1.300 -8.558 0.904 1.00 0.00 O ATOM 238 CB ILE A 15 -3.407 -6.808 -0.927 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.280 -5.284 -0.869 1.00 0.00 C ATOM 240 CG2 ILE A 15 -4.131 -7.369 0.299 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.419 -4.670 -2.264 1.00 0.00 C ATOM 0 H ILE A 15 -2.621 -7.660 -3.106 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.307 -6.714 -0.803 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.016 -7.048 -1.799 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.046 -4.876 -0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.315 -5.012 -0.442 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.102 -6.885 0.401 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.272 -8.443 0.178 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.535 -7.179 1.192 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.325 -3.586 -2.196 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.636 -5.062 -2.914 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.395 -4.924 -2.678 1.00 0.00 H new ATOM 253 N LYS A 16 -2.228 -9.837 -0.714 1.00 0.00 N ATOM 254 CA LYS A 16 -2.085 -11.077 0.029 1.00 0.00 C ATOM 255 C LYS A 16 -0.598 -11.386 0.216 1.00 0.00 C ATOM 256 O LYS A 16 -0.210 -12.023 1.194 1.00 0.00 O ATOM 257 CB LYS A 16 -2.866 -12.203 -0.652 1.00 0.00 C ATOM 258 CG LYS A 16 -3.757 -12.936 0.352 1.00 0.00 C ATOM 259 CD LYS A 16 -4.438 -14.143 -0.298 1.00 0.00 C ATOM 260 CE LYS A 16 -5.813 -13.764 -0.851 1.00 0.00 C ATOM 261 NZ LYS A 16 -6.789 -14.848 -0.600 1.00 0.00 N ATOM 0 H LYS A 16 -2.658 -9.938 -1.633 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.518 -10.977 1.024 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.478 -11.792 -1.455 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.171 -12.907 -1.109 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.159 -13.265 1.202 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.513 -12.253 0.740 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.812 -14.529 -1.103 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.544 -14.943 0.434 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.157 -12.841 -0.384 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.741 -13.572 -1.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.717 -14.575 -0.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.466 -15.720 -1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.870 -15.012 0.424 1.00 0.00 H new ATOM 275 N LEU A 17 0.195 -10.919 -0.738 1.00 0.00 N ATOM 276 CA LEU A 17 1.631 -11.137 -0.690 1.00 0.00 C ATOM 277 C LEU A 17 2.280 -10.046 0.163 1.00 0.00 C ATOM 278 O LEU A 17 3.362 -10.246 0.715 1.00 0.00 O ATOM 279 CB LEU A 17 2.205 -11.234 -2.105 1.00 0.00 C ATOM 280 CG LEU A 17 2.020 -12.577 -2.814 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.183 -12.416 -4.085 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.370 -13.238 -3.097 1.00 0.00 C ATOM 0 H LEU A 17 -0.130 -10.391 -1.548 1.00 0.00 H new ATOM 0 HA LEU A 17 1.856 -12.091 -0.213 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.746 -10.457 -2.716 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.272 -11.014 -2.059 1.00 0.00 H new ATOM 0 HG LEU A 17 1.469 -13.241 -2.148 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.067 -13.386 -4.569 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.201 -12.020 -3.826 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.684 -11.728 -4.766 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.210 -14.191 -3.601 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.968 -12.586 -3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.896 -13.409 -2.157 1.00 0.00 H new ATOM 294 N ARG A 18 1.593 -8.917 0.246 1.00 0.00 N ATOM 295 CA ARG A 18 2.089 -7.794 1.024 1.00 0.00 C ATOM 296 C ARG A 18 1.871 -8.045 2.517 1.00 0.00 C ATOM 297 O ARG A 18 2.201 -7.199 3.347 1.00 0.00 O ATOM 298 CB ARG A 18 1.388 -6.494 0.624 1.00 0.00 C ATOM 299 CG ARG A 18 1.631 -6.171 -0.851 1.00 0.00 C ATOM 300 CD ARG A 18 0.529 -5.265 -1.403 1.00 0.00 C ATOM 301 NE ARG A 18 1.127 -4.070 -2.039 1.00 0.00 N ATOM 302 CZ ARG A 18 0.492 -2.899 -2.185 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.765 -2.759 -1.740 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.113 -1.869 -2.775 1.00 0.00 N ATOM 0 H ARG A 18 0.696 -8.755 -0.213 1.00 0.00 H new ATOM 0 HA ARG A 18 3.155 -7.695 0.821 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.317 -6.582 0.809 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.752 -5.675 1.244 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.599 -5.683 -0.965 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.670 -7.095 -1.428 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.072 -5.811 -2.130 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.141 -4.962 -0.598 1.00 0.00 H new ATOM 0 HE ARG A 18 2.083 -4.142 -2.388 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.237 -3.544 -1.291 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.249 -1.868 -1.851 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.069 -1.976 -3.113 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.629 -0.978 -2.886 1.00 0.00 H new ATOM 318 N LYS A 19 1.317 -9.211 2.814 1.00 0.00 N ATOM 319 CA LYS A 19 1.051 -9.584 4.193 1.00 0.00 C ATOM 320 C LYS A 19 2.375 -9.876 4.902 1.00 0.00 C ATOM 321 O LYS A 19 2.414 -9.998 6.126 1.00 0.00 O ATOM 322 CB LYS A 19 0.054 -10.742 4.252 1.00 0.00 C ATOM 323 CG LYS A 19 -0.469 -10.944 5.676 1.00 0.00 C ATOM 324 CD LYS A 19 -1.327 -12.207 5.771 1.00 0.00 C ATOM 325 CE LYS A 19 -0.464 -13.465 5.657 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.928 -14.500 6.609 1.00 0.00 N ATOM 0 H LYS A 19 1.045 -9.910 2.123 1.00 0.00 H new ATOM 0 HA LYS A 19 0.578 -8.759 4.726 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.780 -10.543 3.579 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.533 -11.657 3.904 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.370 -11.017 6.368 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.057 -10.077 5.978 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.865 -12.215 6.719 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.076 -12.203 4.979 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.508 -13.853 4.639 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.578 -13.218 5.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -0.332 -15.347 6.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.863 -14.133 7.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.916 -14.748 6.398 1.00 0.00 H new ATOM 340 N LYS A 20 3.427 -9.980 4.104 1.00 0.00 N ATOM 341 CA LYS A 20 4.749 -10.255 4.640 1.00 0.00 C ATOM 342 C LYS A 20 5.696 -9.115 4.261 1.00 0.00 C ATOM 343 O LYS A 20 6.859 -9.108 4.663 1.00 0.00 O ATOM 344 CB LYS A 20 5.235 -11.634 4.187 1.00 0.00 C ATOM 345 CG LYS A 20 6.460 -12.075 4.990 1.00 0.00 C ATOM 346 CD LYS A 20 6.289 -13.502 5.512 1.00 0.00 C ATOM 347 CE LYS A 20 6.075 -13.510 7.027 1.00 0.00 C ATOM 348 NZ LYS A 20 7.315 -13.918 7.724 1.00 0.00 N ATOM 0 H LYS A 20 3.391 -9.879 3.090 1.00 0.00 H new ATOM 0 HA LYS A 20 4.717 -10.295 5.729 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.434 -12.364 4.308 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.482 -11.606 3.126 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.350 -12.018 4.363 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.615 -11.394 5.827 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.439 -13.974 5.019 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.171 -14.092 5.263 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.772 -12.518 7.363 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.266 -14.194 7.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.152 -13.918 8.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.588 -14.873 7.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.078 -13.250 7.495 1.00 0.00 H new ATOM 362 N LYS A 21 5.164 -8.177 3.491 1.00 0.00 N ATOM 363 CA LYS A 21 5.947 -7.034 3.053 1.00 0.00 C ATOM 364 C LYS A 21 5.329 -5.752 3.615 1.00 0.00 C ATOM 365 O LYS A 21 5.355 -5.525 4.824 1.00 0.00 O ATOM 366 CB LYS A 21 6.087 -7.032 1.530 1.00 0.00 C ATOM 367 CG LYS A 21 6.831 -8.279 1.046 1.00 0.00 C ATOM 368 CD LYS A 21 5.860 -9.435 0.798 1.00 0.00 C ATOM 369 CE LYS A 21 6.616 -10.736 0.523 1.00 0.00 C ATOM 370 NZ LYS A 21 6.981 -10.831 -0.908 1.00 0.00 N ATOM 0 H LYS A 21 4.200 -8.185 3.159 1.00 0.00 H new ATOM 0 HA LYS A 21 6.963 -7.097 3.443 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.099 -6.992 1.071 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.623 -6.138 1.212 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.372 -8.051 0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.573 -8.575 1.788 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.212 -9.563 1.665 1.00 0.00 H new ATOM 0 HD3 LYS A 21 5.216 -9.198 -0.049 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.515 -10.778 1.137 1.00 0.00 H new ATOM 0 HE3 LYS A 21 5.998 -11.589 0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.493 -11.720 -1.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.118 -10.813 -1.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.588 -10.027 -1.165 1.00 0.00 H new ATOM 384 N ILE A 22 4.788 -4.948 2.712 1.00 0.00 N ATOM 385 CA ILE A 22 4.165 -3.695 3.103 1.00 0.00 C ATOM 386 C ILE A 22 3.360 -3.142 1.925 1.00 0.00 C ATOM 387 O ILE A 22 3.120 -3.848 0.946 1.00 0.00 O ATOM 388 CB ILE A 22 5.213 -2.721 3.643 1.00 0.00 C ATOM 389 CG1 ILE A 22 4.719 -2.036 4.919 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.625 -1.709 2.572 1.00 0.00 C ATOM 391 CD1 ILE A 22 5.263 -2.737 6.164 1.00 0.00 C ATOM 0 H ILE A 22 4.768 -5.140 1.710 1.00 0.00 H new ATOM 0 HA ILE A 22 3.463 -3.857 3.921 1.00 0.00 H new ATOM 0 HB ILE A 22 6.104 -3.290 3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.032 -0.992 4.920 1.00 0.00 H new ATOM 0 HG13 ILE A 22 3.629 -2.042 4.941 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.371 -1.028 2.982 1.00 0.00 H new ATOM 0 HG22 ILE A 22 6.047 -2.236 1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.751 -1.140 2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.896 -2.230 7.056 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.928 -3.774 6.173 1.00 0.00 H new ATOM 0 HD13 ILE A 22 6.353 -2.707 6.151 1.00 0.00 H new ATOM 403 N GLU A 23 2.965 -1.885 2.058 1.00 0.00 N ATOM 404 CA GLU A 23 2.192 -1.229 1.017 1.00 0.00 C ATOM 405 C GLU A 23 2.502 0.269 0.990 1.00 0.00 C ATOM 406 O GLU A 23 2.416 0.943 2.015 1.00 0.00 O ATOM 407 CB GLU A 23 0.694 -1.475 1.208 1.00 0.00 C ATOM 408 CG GLU A 23 -0.134 -0.460 0.418 1.00 0.00 C ATOM 409 CD GLU A 23 -1.631 -0.734 0.573 1.00 0.00 C ATOM 410 OE1 GLU A 23 -2.044 -1.855 0.206 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.329 0.184 1.056 1.00 0.00 O ATOM 0 H GLU A 23 3.166 -1.303 2.871 1.00 0.00 H new ATOM 0 HA GLU A 23 2.477 -1.657 0.056 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.444 -2.485 0.884 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.443 -1.409 2.267 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.093 0.548 0.765 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.140 -0.504 -0.636 1.00 0.00 H new ATOM 418 N GLY A 24 2.856 0.747 -0.194 1.00 0.00 N ATOM 419 CA GLY A 24 3.179 2.152 -0.368 1.00 0.00 C ATOM 420 C GLY A 24 1.969 2.934 -0.883 1.00 0.00 C ATOM 421 O GLY A 24 1.194 2.424 -1.691 1.00 0.00 O ATOM 0 H GLY A 24 2.926 0.185 -1.042 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.511 2.573 0.581 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.007 2.254 -1.069 1.00 0.00 H new ATOM 425 N ARG A 25 1.844 4.159 -0.394 1.00 0.00 N ATOM 426 CA ARG A 25 0.741 5.015 -0.794 1.00 0.00 C ATOM 427 C ARG A 25 0.801 6.345 -0.040 1.00 0.00 C ATOM 428 O ARG A 25 0.489 6.403 1.149 1.00 0.00 O ATOM 429 CB ARG A 25 -0.606 4.343 -0.521 1.00 0.00 C ATOM 430 CG ARG A 25 -1.765 5.233 -0.974 1.00 0.00 C ATOM 431 CD ARG A 25 -2.385 4.709 -2.272 1.00 0.00 C ATOM 432 NE ARG A 25 -3.274 3.562 -1.981 1.00 0.00 N ATOM 433 CZ ARG A 25 -4.004 2.924 -2.906 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.955 3.317 -4.186 1.00 0.00 N ATOM 435 NH2 ARG A 25 -4.783 1.893 -2.551 1.00 0.00 N ATOM 0 H ARG A 25 2.489 4.579 0.276 1.00 0.00 H new ATOM 0 HA ARG A 25 0.834 5.195 -1.865 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.652 3.387 -1.043 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.701 4.130 0.544 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.525 5.272 -0.194 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.409 6.252 -1.123 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.950 5.503 -2.761 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -1.599 4.404 -2.963 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.335 3.237 -1.016 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.362 4.102 -4.456 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.511 2.831 -4.890 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.820 1.594 -1.577 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.339 1.407 -3.255 1.00 0.00 H new ATOM 449 N LEU A 26 1.203 7.381 -0.762 1.00 0.00 N ATOM 450 CA LEU A 26 1.307 8.706 -0.176 1.00 0.00 C ATOM 451 C LEU A 26 0.132 8.932 0.777 1.00 0.00 C ATOM 452 O LEU A 26 -0.932 8.340 0.607 1.00 0.00 O ATOM 453 CB LEU A 26 1.424 9.768 -1.271 1.00 0.00 C ATOM 454 CG LEU A 26 0.354 10.862 -1.261 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.671 11.931 -0.214 1.00 0.00 C ATOM 456 CD2 LEU A 26 0.171 11.463 -2.656 1.00 0.00 C ATOM 0 H LEU A 26 1.461 7.329 -1.748 1.00 0.00 H new ATOM 0 HA LEU A 26 2.218 8.790 0.416 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.402 10.243 -1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.395 9.268 -2.239 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.596 10.407 -0.979 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.105 12.696 -0.228 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.710 11.472 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.635 12.388 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.595 12.238 -2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 26 1.112 11.898 -2.991 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.135 10.682 -3.352 1.00 0.00 H new ATOM 468 N TYR A 27 0.365 9.790 1.760 1.00 0.00 N ATOM 469 CA TYR A 27 -0.661 10.101 2.740 1.00 0.00 C ATOM 470 C TYR A 27 -1.724 11.028 2.147 1.00 0.00 C ATOM 471 O TYR A 27 -1.572 12.248 2.171 1.00 0.00 O ATOM 472 CB TYR A 27 0.053 10.828 3.881 1.00 0.00 C ATOM 473 CG TYR A 27 -0.640 10.688 5.239 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.188 9.478 5.612 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.716 11.772 6.090 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.839 9.346 6.889 1.00 0.00 C ATOM 477 CE2 TYR A 27 -1.368 11.640 7.367 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.898 10.433 7.703 1.00 0.00 C ATOM 479 OH TYR A 27 -2.513 10.309 8.910 1.00 0.00 O ATOM 0 H TYR A 27 1.249 10.279 1.898 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.163 9.192 3.072 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.070 10.444 3.962 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.131 11.886 3.632 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.129 8.630 4.946 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -0.287 12.719 5.798 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.271 8.404 7.194 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.435 12.480 8.043 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.478 11.166 9.384 1.00 0.00 H new ATOM 489 N ASP A 28 -2.776 10.413 1.627 1.00 0.00 N ATOM 490 CA ASP A 28 -3.863 11.167 1.028 1.00 0.00 C ATOM 491 C ASP A 28 -4.859 11.571 2.117 1.00 0.00 C ATOM 492 O ASP A 28 -4.678 11.231 3.285 1.00 0.00 O ATOM 493 CB ASP A 28 -4.612 10.326 -0.009 1.00 0.00 C ATOM 494 CG ASP A 28 -3.763 9.848 -1.188 1.00 0.00 C ATOM 495 OD1 ASP A 28 -3.077 8.818 -1.013 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.819 10.523 -2.239 1.00 0.00 O ATOM 0 H ASP A 28 -2.898 9.401 1.608 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.436 12.044 0.541 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.037 9.455 0.490 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.447 10.911 -0.395 1.00 0.00 H new ATOM 501 N GLU A 29 -5.889 12.291 1.696 1.00 0.00 N ATOM 502 CA GLU A 29 -6.913 12.745 2.621 1.00 0.00 C ATOM 503 C GLU A 29 -7.608 11.547 3.272 1.00 0.00 C ATOM 504 O GLU A 29 -7.885 11.563 4.471 1.00 0.00 O ATOM 505 CB GLU A 29 -7.926 13.650 1.917 1.00 0.00 C ATOM 506 CG GLU A 29 -7.298 14.996 1.553 1.00 0.00 C ATOM 507 CD GLU A 29 -7.046 15.840 2.804 1.00 0.00 C ATOM 508 OE1 GLU A 29 -7.862 15.719 3.744 1.00 0.00 O ATOM 509 OE2 GLU A 29 -6.045 16.588 2.792 1.00 0.00 O ATOM 0 H GLU A 29 -6.036 12.571 0.726 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.433 13.332 3.404 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.292 13.160 1.015 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.788 13.810 2.565 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.358 14.832 1.025 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.956 15.536 0.872 1.00 0.00 H new ATOM 516 N LYS A 30 -7.868 10.538 2.455 1.00 0.00 N ATOM 517 CA LYS A 30 -8.525 9.335 2.937 1.00 0.00 C ATOM 518 C LYS A 30 -7.611 8.626 3.939 1.00 0.00 C ATOM 519 O LYS A 30 -8.053 8.233 5.017 1.00 0.00 O ATOM 520 CB LYS A 30 -8.953 8.451 1.763 1.00 0.00 C ATOM 521 CG LYS A 30 -10.316 8.884 1.219 1.00 0.00 C ATOM 522 CD LYS A 30 -10.307 8.929 -0.310 1.00 0.00 C ATOM 523 CE LYS A 30 -10.641 10.333 -0.819 1.00 0.00 C ATOM 524 NZ LYS A 30 -9.835 10.655 -2.018 1.00 0.00 N ATOM 0 H LYS A 30 -7.636 10.528 1.462 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.443 9.589 3.467 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.207 8.506 0.970 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.000 7.411 2.085 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.085 8.191 1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.574 9.867 1.614 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.327 8.627 -0.681 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.030 8.214 -0.703 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.702 10.396 -1.059 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -10.447 11.066 -0.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.074 11.611 -2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -8.824 10.615 -1.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -10.040 9.966 -2.769 1.00 0.00 H new ATOM 538 N ARG A 31 -6.353 8.485 3.547 1.00 0.00 N ATOM 539 CA ARG A 31 -5.373 7.831 4.397 1.00 0.00 C ATOM 540 C ARG A 31 -5.290 8.537 5.751 1.00 0.00 C ATOM 541 O ARG A 31 -5.168 7.887 6.788 1.00 0.00 O ATOM 542 CB ARG A 31 -3.990 7.831 3.743 1.00 0.00 C ATOM 543 CG ARG A 31 -3.946 6.872 2.552 1.00 0.00 C ATOM 544 CD ARG A 31 -3.831 5.420 3.021 1.00 0.00 C ATOM 545 NE ARG A 31 -4.188 4.502 1.917 1.00 0.00 N ATOM 546 CZ ARG A 31 -4.543 3.221 2.090 1.00 0.00 C ATOM 547 NH1 ARG A 31 -4.590 2.700 3.324 1.00 0.00 N ATOM 548 NH2 ARG A 31 -4.850 2.462 1.030 1.00 0.00 N ATOM 0 H ARG A 31 -5.990 8.813 2.652 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.694 6.799 4.541 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.741 8.839 3.412 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.237 7.541 4.476 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.846 6.993 1.950 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.099 7.119 1.912 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.815 5.218 3.359 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.490 5.251 3.873 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.162 4.867 0.965 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.356 3.278 4.131 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -4.860 1.725 3.456 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.814 2.859 0.091 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.120 1.487 1.162 1.00 0.00 H new ATOM 562 N ARG A 32 -5.360 9.859 5.699 1.00 0.00 N ATOM 563 CA ARG A 32 -5.294 10.661 6.909 1.00 0.00 C ATOM 564 C ARG A 32 -6.356 10.200 7.909 1.00 0.00 C ATOM 565 O ARG A 32 -6.067 10.029 9.092 1.00 0.00 O ATOM 566 CB ARG A 32 -5.504 12.144 6.599 1.00 0.00 C ATOM 567 CG ARG A 32 -4.396 12.997 7.220 1.00 0.00 C ATOM 568 CD ARG A 32 -4.582 14.475 6.873 1.00 0.00 C ATOM 569 NE ARG A 32 -3.670 15.306 7.691 1.00 0.00 N ATOM 570 CZ ARG A 32 -3.731 16.643 7.760 1.00 0.00 C ATOM 571 NH1 ARG A 32 -4.659 17.309 7.060 1.00 0.00 N ATOM 572 NH2 ARG A 32 -2.862 17.314 8.529 1.00 0.00 N ATOM 0 H ARG A 32 -5.462 10.395 4.837 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.302 10.529 7.341 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -5.522 12.294 5.520 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.473 12.465 6.982 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -4.399 12.871 8.303 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.425 12.655 6.862 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.382 14.636 5.814 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.616 14.772 7.051 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.950 14.831 8.236 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.320 16.798 6.474 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -4.705 18.327 7.113 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.155 16.807 9.061 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -2.908 18.332 8.582 1.00 0.00 H new ATOM 586 N GLN A 33 -7.563 10.013 7.397 1.00 0.00 N ATOM 587 CA GLN A 33 -8.670 9.575 8.231 1.00 0.00 C ATOM 588 C GLN A 33 -8.516 8.094 8.583 1.00 0.00 C ATOM 589 O GLN A 33 -9.089 7.623 9.565 1.00 0.00 O ATOM 590 CB GLN A 33 -10.012 9.839 7.544 1.00 0.00 C ATOM 591 CG GLN A 33 -10.807 10.913 8.289 1.00 0.00 C ATOM 592 CD GLN A 33 -12.078 10.326 8.906 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.354 10.476 10.084 1.00 0.00 O ATOM 594 NE2 GLN A 33 -12.834 9.650 8.045 1.00 0.00 N ATOM 0 H GLN A 33 -7.799 10.157 6.415 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.653 10.152 9.156 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.842 10.156 6.515 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.591 8.916 7.502 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.188 11.351 9.072 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -11.070 11.718 7.602 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.544 9.563 7.071 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.704 9.219 8.359 1.00 0.00 H new ATOM 603 N ILE A 34 -7.741 7.401 7.762 1.00 0.00 N ATOM 604 CA ILE A 34 -7.504 5.983 7.975 1.00 0.00 C ATOM 605 C ILE A 34 -6.618 5.797 9.208 1.00 0.00 C ATOM 606 O ILE A 34 -5.792 6.655 9.518 1.00 0.00 O ATOM 607 CB ILE A 34 -6.938 5.339 6.708 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.032 5.148 5.654 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.222 4.027 7.033 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.467 4.499 4.389 1.00 0.00 C ATOM 0 H ILE A 34 -7.269 7.795 6.948 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.442 5.466 8.176 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.196 6.015 6.284 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.829 4.526 6.061 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.475 6.112 5.406 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.829 3.590 6.115 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.401 4.222 7.723 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.925 3.333 7.493 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.265 4.375 3.657 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.687 5.135 3.971 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.047 3.524 4.637 1.00 0.00 H new ATOM 622 N LYS A 35 -6.819 4.672 9.878 1.00 0.00 N ATOM 623 CA LYS A 35 -6.048 4.363 11.070 1.00 0.00 C ATOM 624 C LYS A 35 -5.832 2.851 11.154 1.00 0.00 C ATOM 625 O LYS A 35 -6.548 2.081 10.515 1.00 0.00 O ATOM 626 CB LYS A 35 -6.718 4.959 12.310 1.00 0.00 C ATOM 627 CG LYS A 35 -7.881 4.082 12.780 1.00 0.00 C ATOM 628 CD LYS A 35 -7.377 2.902 13.613 1.00 0.00 C ATOM 629 CE LYS A 35 -8.348 2.579 14.750 1.00 0.00 C ATOM 630 NZ LYS A 35 -7.653 2.628 16.055 1.00 0.00 N ATOM 0 H LYS A 35 -7.505 3.963 9.618 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.062 4.824 11.017 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.986 5.058 13.111 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.082 5.962 12.085 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.575 4.679 13.372 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.434 3.712 11.917 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -7.255 2.027 12.974 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.395 3.136 14.024 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.174 3.291 14.744 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.779 1.589 14.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -8.327 2.406 16.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.880 1.932 16.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.263 3.580 16.205 1.00 0.00 H new ATOM 644 N PRO A 36 -4.816 2.460 11.969 1.00 0.00 N ATOM 645 CA PRO A 36 -4.496 1.054 12.146 1.00 0.00 C ATOM 646 C PRO A 36 -5.527 0.365 13.043 1.00 0.00 C ATOM 647 O PRO A 36 -5.528 0.563 14.257 1.00 0.00 O ATOM 648 CB PRO A 36 -3.094 1.039 12.732 1.00 0.00 C ATOM 649 CG PRO A 36 -2.863 2.433 13.294 1.00 0.00 C ATOM 650 CD PRO A 36 -3.947 3.343 12.742 1.00 0.00 C ATOM 0 HA PRO A 36 -4.528 0.495 11.211 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.005 0.283 13.512 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.354 0.798 11.969 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.897 2.416 14.383 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.876 2.800 13.012 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.496 3.836 13.544 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.523 4.129 12.116 1.00 0.00 H new ATOM 658 N GLY A 37 -6.378 -0.429 12.411 1.00 0.00 N ATOM 659 CA GLY A 37 -7.411 -1.147 13.137 1.00 0.00 C ATOM 660 C GLY A 37 -8.658 -1.340 12.271 1.00 0.00 C ATOM 661 O GLY A 37 -9.399 -2.305 12.449 1.00 0.00 O ATOM 0 H GLY A 37 -6.373 -0.591 11.404 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.030 -2.118 13.453 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.673 -0.598 14.041 1.00 0.00 H new ATOM 665 N ASP A 38 -8.850 -0.406 11.351 1.00 0.00 N ATOM 666 CA ASP A 38 -9.993 -0.460 10.456 1.00 0.00 C ATOM 667 C ASP A 38 -9.755 -1.537 9.396 1.00 0.00 C ATOM 668 O ASP A 38 -8.732 -2.219 9.418 1.00 0.00 O ATOM 669 CB ASP A 38 -10.194 0.875 9.736 1.00 0.00 C ATOM 670 CG ASP A 38 -10.110 2.112 10.633 1.00 0.00 C ATOM 671 OD1 ASP A 38 -10.421 1.964 11.835 1.00 0.00 O ATOM 672 OD2 ASP A 38 -9.736 3.177 10.097 1.00 0.00 O ATOM 0 H ASP A 38 -8.233 0.393 11.206 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.877 -0.684 11.053 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.444 0.963 8.950 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.168 0.864 9.248 1.00 0.00 H new ATOM 677 N VAL A 39 -10.718 -1.657 8.493 1.00 0.00 N ATOM 678 CA VAL A 39 -10.625 -2.640 7.427 1.00 0.00 C ATOM 679 C VAL A 39 -11.119 -2.016 6.120 1.00 0.00 C ATOM 680 O VAL A 39 -11.958 -1.116 6.136 1.00 0.00 O ATOM 681 CB VAL A 39 -11.394 -3.905 7.813 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.195 -5.007 6.771 1.00 0.00 C ATOM 683 CG2 VAL A 39 -10.988 -4.389 9.207 1.00 0.00 C ATOM 0 H VAL A 39 -11.566 -1.090 8.478 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.588 -2.940 7.273 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.455 -3.657 7.840 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.752 -5.895 7.070 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.555 -4.661 5.802 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.135 -5.251 6.698 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.549 -5.289 9.457 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.921 -4.611 9.218 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.204 -3.611 9.939 1.00 0.00 H new ATOM 693 N ILE A 40 -10.578 -2.518 5.020 1.00 0.00 N ATOM 694 CA ILE A 40 -10.953 -2.021 3.707 1.00 0.00 C ATOM 695 C ILE A 40 -11.426 -3.190 2.840 1.00 0.00 C ATOM 696 O ILE A 40 -10.728 -4.194 2.712 1.00 0.00 O ATOM 697 CB ILE A 40 -9.805 -1.222 3.088 1.00 0.00 C ATOM 698 CG1 ILE A 40 -9.155 -0.303 4.125 1.00 0.00 C ATOM 699 CG2 ILE A 40 -10.276 -0.450 1.854 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.698 -0.700 4.372 1.00 0.00 C ATOM 0 H ILE A 40 -9.883 -3.264 5.011 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.788 -1.325 3.788 1.00 0.00 H new ATOM 0 HB ILE A 40 -9.041 -1.925 2.756 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.201 0.730 3.780 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.713 -0.352 5.060 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.440 0.109 1.434 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.655 -1.150 1.110 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -11.069 0.242 2.138 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.259 -0.031 5.113 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.658 -1.725 4.740 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.138 -0.626 3.440 1.00 0.00 H new ATOM 712 N SER A 41 -12.609 -3.020 2.268 1.00 0.00 N ATOM 713 CA SER A 41 -13.183 -4.048 1.417 1.00 0.00 C ATOM 714 C SER A 41 -12.818 -3.782 -0.045 1.00 0.00 C ATOM 715 O SER A 41 -13.097 -2.706 -0.572 1.00 0.00 O ATOM 716 CB SER A 41 -14.703 -4.113 1.581 1.00 0.00 C ATOM 717 OG SER A 41 -15.202 -5.437 1.411 1.00 0.00 O ATOM 0 H SER A 41 -13.186 -2.186 2.377 1.00 0.00 H new ATOM 0 HA SER A 41 -12.770 -5.011 1.718 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.977 -3.747 2.570 1.00 0.00 H new ATOM 0 HB3 SER A 41 -15.175 -3.452 0.854 1.00 0.00 H new ATOM 0 HG SER A 41 -15.960 -5.424 0.790 1.00 0.00 H new ATOM 723 N PHE A 42 -12.200 -4.780 -0.658 1.00 0.00 N ATOM 724 CA PHE A 42 -11.794 -4.667 -2.049 1.00 0.00 C ATOM 725 C PHE A 42 -12.688 -5.519 -2.952 1.00 0.00 C ATOM 726 O PHE A 42 -13.051 -6.639 -2.595 1.00 0.00 O ATOM 727 CB PHE A 42 -10.357 -5.186 -2.139 1.00 0.00 C ATOM 728 CG PHE A 42 -9.338 -4.329 -1.385 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.219 -3.004 -1.671 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.551 -4.891 -0.429 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.274 -2.209 -0.972 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.606 -4.095 0.270 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.487 -2.771 -0.016 1.00 0.00 C ATOM 0 H PHE A 42 -11.970 -5.671 -0.218 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.874 -3.631 -2.377 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.323 -6.202 -1.746 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.066 -5.240 -3.188 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.844 -2.557 -2.430 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.645 -5.943 -0.202 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.180 -1.157 -1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.981 -4.541 1.029 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.768 -2.166 0.516 1.00 0.00 H new ATOM 743 N GLU A 43 -13.018 -4.956 -4.105 1.00 0.00 N ATOM 744 CA GLU A 43 -13.863 -5.650 -5.063 1.00 0.00 C ATOM 745 C GLU A 43 -15.087 -6.240 -4.360 1.00 0.00 C ATOM 746 O GLU A 43 -15.471 -7.378 -4.626 1.00 0.00 O ATOM 747 CB GLU A 43 -13.078 -6.736 -5.801 1.00 0.00 C ATOM 748 CG GLU A 43 -12.075 -6.119 -6.778 1.00 0.00 C ATOM 749 CD GLU A 43 -12.575 -6.232 -8.220 1.00 0.00 C ATOM 750 OE1 GLU A 43 -13.441 -5.408 -8.586 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.080 -7.139 -8.923 1.00 0.00 O ATOM 0 H GLU A 43 -12.716 -4.027 -4.398 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.206 -4.929 -5.805 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.551 -7.362 -5.081 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.767 -7.384 -6.343 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.914 -5.071 -6.526 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.112 -6.621 -6.682 1.00 0.00 H new ATOM 758 N GLY A 44 -15.666 -5.439 -3.477 1.00 0.00 N ATOM 759 CA GLY A 44 -16.839 -5.868 -2.734 1.00 0.00 C ATOM 760 C GLY A 44 -16.439 -6.547 -1.422 1.00 0.00 C ATOM 761 O GLY A 44 -16.751 -6.050 -0.341 1.00 0.00 O ATOM 0 H GLY A 44 -15.345 -4.496 -3.260 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.475 -5.008 -2.523 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.426 -6.558 -3.340 1.00 0.00 H new ATOM 765 N GLY A 45 -15.754 -7.673 -1.561 1.00 0.00 N ATOM 766 CA GLY A 45 -15.309 -8.426 -0.401 1.00 0.00 C ATOM 767 C GLY A 45 -14.379 -9.569 -0.813 1.00 0.00 C ATOM 768 O GLY A 45 -14.307 -10.591 -0.132 1.00 0.00 O ATOM 0 H GLY A 45 -15.496 -8.082 -2.459 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.791 -7.762 0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.172 -8.828 0.129 1.00 0.00 H new ATOM 772 N LYS A 46 -13.691 -9.358 -1.925 1.00 0.00 N ATOM 773 CA LYS A 46 -12.768 -10.358 -2.435 1.00 0.00 C ATOM 774 C LYS A 46 -11.481 -10.327 -1.609 1.00 0.00 C ATOM 775 O LYS A 46 -10.881 -11.369 -1.349 1.00 0.00 O ATOM 776 CB LYS A 46 -12.542 -10.161 -3.935 1.00 0.00 C ATOM 777 CG LYS A 46 -12.215 -11.490 -4.619 1.00 0.00 C ATOM 778 CD LYS A 46 -10.779 -11.496 -5.149 1.00 0.00 C ATOM 779 CE LYS A 46 -10.667 -12.343 -6.418 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.917 -13.769 -6.113 1.00 0.00 N ATOM 0 H LYS A 46 -13.754 -8.509 -2.487 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.191 -11.357 -2.328 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.433 -9.725 -4.387 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.726 -9.456 -4.094 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.349 -12.309 -3.913 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.910 -11.661 -5.441 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.461 -10.475 -5.360 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.107 -11.888 -4.385 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.384 -11.993 -7.161 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.675 -12.227 -6.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.771 -14.338 -6.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.260 -14.086 -5.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.896 -13.887 -5.782 1.00 0.00 H new ATOM 794 N LEU A 47 -11.094 -9.121 -1.221 1.00 0.00 N ATOM 795 CA LEU A 47 -9.888 -8.940 -0.430 1.00 0.00 C ATOM 796 C LEU A 47 -10.142 -7.882 0.645 1.00 0.00 C ATOM 797 O LEU A 47 -10.574 -6.771 0.338 1.00 0.00 O ATOM 798 CB LEU A 47 -8.696 -8.624 -1.335 1.00 0.00 C ATOM 799 CG LEU A 47 -7.405 -9.389 -1.035 1.00 0.00 C ATOM 800 CD1 LEU A 47 -7.021 -9.260 0.440 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.521 -10.851 -1.472 1.00 0.00 C ATOM 0 H LEU A 47 -11.594 -8.259 -1.439 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.629 -9.864 0.087 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.984 -8.827 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.487 -7.556 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.599 -8.942 -1.617 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.100 -9.813 0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.869 -8.209 0.686 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.820 -9.666 1.061 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.591 -11.373 -1.248 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.342 -11.327 -0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.713 -10.896 -2.544 1.00 0.00 H new ATOM 813 N LYS A 48 -9.864 -8.262 1.883 1.00 0.00 N ATOM 814 CA LYS A 48 -10.057 -7.359 3.005 1.00 0.00 C ATOM 815 C LYS A 48 -8.752 -7.250 3.796 1.00 0.00 C ATOM 816 O LYS A 48 -8.143 -8.262 4.140 1.00 0.00 O ATOM 817 CB LYS A 48 -11.253 -7.803 3.850 1.00 0.00 C ATOM 818 CG LYS A 48 -12.557 -7.685 3.059 1.00 0.00 C ATOM 819 CD LYS A 48 -13.028 -9.056 2.572 1.00 0.00 C ATOM 820 CE LYS A 48 -14.505 -9.279 2.906 1.00 0.00 C ATOM 821 NZ LYS A 48 -14.778 -10.719 3.112 1.00 0.00 N ATOM 0 H LYS A 48 -9.506 -9.184 2.134 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.300 -6.357 2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.112 -8.834 4.173 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.313 -7.192 4.751 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -13.327 -7.233 3.685 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.410 -7.023 2.206 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.879 -9.134 1.495 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.425 -9.837 3.035 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.769 -8.721 3.804 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.128 -8.897 2.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.784 -10.853 3.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.545 -11.244 2.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.197 -11.074 3.898 1.00 0.00 H new ATOM 835 N VAL A 49 -8.361 -6.012 4.062 1.00 0.00 N ATOM 836 CA VAL A 49 -7.139 -5.757 4.806 1.00 0.00 C ATOM 837 C VAL A 49 -7.434 -4.774 5.941 1.00 0.00 C ATOM 838 O VAL A 49 -8.331 -3.940 5.827 1.00 0.00 O ATOM 839 CB VAL A 49 -6.042 -5.265 3.859 1.00 0.00 C ATOM 840 CG1 VAL A 49 -5.866 -6.224 2.680 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.335 -3.844 3.372 1.00 0.00 C ATOM 0 H VAL A 49 -8.869 -5.175 3.776 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.769 -6.677 5.260 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.105 -5.242 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.081 -5.852 2.022 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.590 -7.211 3.052 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.802 -6.294 2.125 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.540 -3.518 2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.287 -3.830 2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.387 -3.170 4.227 1.00 0.00 H new ATOM 851 N ARG A 50 -6.662 -4.905 7.010 1.00 0.00 N ATOM 852 CA ARG A 50 -6.829 -4.038 8.164 1.00 0.00 C ATOM 853 C ARG A 50 -5.518 -3.316 8.481 1.00 0.00 C ATOM 854 O ARG A 50 -4.513 -3.954 8.789 1.00 0.00 O ATOM 855 CB ARG A 50 -7.273 -4.836 9.392 1.00 0.00 C ATOM 856 CG ARG A 50 -7.260 -3.963 10.648 1.00 0.00 C ATOM 857 CD ARG A 50 -6.524 -4.661 11.794 1.00 0.00 C ATOM 858 NE ARG A 50 -7.489 -5.072 12.838 1.00 0.00 N ATOM 859 CZ ARG A 50 -7.139 -5.475 14.067 1.00 0.00 C ATOM 860 NH1 ARG A 50 -5.846 -5.524 14.413 1.00 0.00 N ATOM 861 NH2 ARG A 50 -8.083 -5.829 14.950 1.00 0.00 N ATOM 0 H ARG A 50 -5.919 -5.598 7.101 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.600 -3.307 7.920 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.276 -5.231 9.230 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.612 -5.691 9.533 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.778 -3.011 10.428 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.283 -3.740 10.951 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.990 -5.533 11.417 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.778 -3.990 12.220 1.00 0.00 H new ATOM 0 HE ARG A 50 -8.482 -5.047 12.608 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.128 -5.254 13.741 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.580 -5.831 15.349 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -9.068 -5.792 14.686 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.817 -6.136 15.886 1.00 0.00 H new ATOM 875 N VAL A 51 -5.571 -1.995 8.393 1.00 0.00 N ATOM 876 CA VAL A 51 -4.400 -1.179 8.666 1.00 0.00 C ATOM 877 C VAL A 51 -3.714 -1.688 9.935 1.00 0.00 C ATOM 878 O VAL A 51 -4.310 -1.686 11.011 1.00 0.00 O ATOM 879 CB VAL A 51 -4.799 0.296 8.752 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.592 1.170 9.098 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.460 0.762 7.453 1.00 0.00 C ATOM 0 H VAL A 51 -6.407 -1.469 8.136 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.679 -1.260 7.852 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.529 0.400 9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.902 2.213 9.153 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.183 0.862 10.060 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.829 1.058 8.327 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.734 1.813 7.541 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.763 0.637 6.625 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.355 0.168 7.267 1.00 0.00 H new ATOM 891 N LYS A 52 -2.470 -2.112 9.767 1.00 0.00 N ATOM 892 CA LYS A 52 -1.696 -2.623 10.886 1.00 0.00 C ATOM 893 C LYS A 52 -1.043 -1.454 11.625 1.00 0.00 C ATOM 894 O LYS A 52 -1.147 -1.350 12.846 1.00 0.00 O ATOM 895 CB LYS A 52 -0.701 -3.683 10.409 1.00 0.00 C ATOM 896 CG LYS A 52 -0.765 -4.931 11.292 1.00 0.00 C ATOM 897 CD LYS A 52 0.636 -5.366 11.729 1.00 0.00 C ATOM 898 CE LYS A 52 0.652 -5.753 13.209 1.00 0.00 C ATOM 899 NZ LYS A 52 0.985 -7.187 13.366 1.00 0.00 N ATOM 0 H LYS A 52 -1.979 -2.112 8.873 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.346 -3.128 11.600 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.919 -3.953 9.376 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.309 -3.273 10.425 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.377 -4.728 12.171 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.248 -5.742 10.747 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.963 -6.212 11.124 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.344 -4.556 11.553 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.381 -5.144 13.743 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.321 -5.549 13.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.992 -7.433 14.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.274 -7.764 12.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.924 -7.372 12.958 1.00 0.00 H new ATOM 913 N ALA A 53 -0.384 -0.602 10.853 1.00 0.00 N ATOM 914 CA ALA A 53 0.286 0.557 11.419 1.00 0.00 C ATOM 915 C ALA A 53 0.571 1.569 10.308 1.00 0.00 C ATOM 916 O ALA A 53 0.714 1.196 9.145 1.00 0.00 O ATOM 917 CB ALA A 53 1.559 0.109 12.139 1.00 0.00 C ATOM 0 H ALA A 53 -0.300 -0.691 9.840 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.351 1.047 12.156 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.062 0.978 12.564 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.300 -0.586 12.937 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.224 -0.384 11.430 1.00 0.00 H new ATOM 923 N ILE A 54 0.644 2.831 10.705 1.00 0.00 N ATOM 924 CA ILE A 54 0.909 3.900 9.758 1.00 0.00 C ATOM 925 C ILE A 54 2.319 4.445 9.991 1.00 0.00 C ATOM 926 O ILE A 54 2.776 4.528 11.131 1.00 0.00 O ATOM 927 CB ILE A 54 -0.184 4.968 9.836 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.293 5.738 8.518 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.045 5.900 11.027 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.637 5.473 7.838 1.00 0.00 C ATOM 0 H ILE A 54 0.524 3.137 11.671 1.00 0.00 H new ATOM 0 HA ILE A 54 0.879 3.520 8.737 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.139 4.468 9.997 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.181 6.806 8.706 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.519 5.445 7.853 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.746 6.650 11.060 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.034 5.320 11.950 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.010 6.395 10.921 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.689 6.032 6.904 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.735 4.408 7.629 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.446 5.790 8.496 1.00 0.00 H new ATOM 942 N ARG A 55 2.971 4.802 8.894 1.00 0.00 N ATOM 943 CA ARG A 55 4.320 5.337 8.966 1.00 0.00 C ATOM 944 C ARG A 55 4.490 6.482 7.965 1.00 0.00 C ATOM 945 O ARG A 55 3.801 6.530 6.948 1.00 0.00 O ATOM 946 CB ARG A 55 5.358 4.253 8.671 1.00 0.00 C ATOM 947 CG ARG A 55 5.274 3.120 9.695 1.00 0.00 C ATOM 948 CD ARG A 55 6.404 3.223 10.721 1.00 0.00 C ATOM 949 NE ARG A 55 7.422 2.181 10.459 1.00 0.00 N ATOM 950 CZ ARG A 55 8.485 1.955 11.244 1.00 0.00 C ATOM 951 NH1 ARG A 55 8.675 2.696 12.344 1.00 0.00 N ATOM 952 NH2 ARG A 55 9.357 0.989 10.928 1.00 0.00 N ATOM 0 H ARG A 55 2.590 4.731 7.950 1.00 0.00 H new ATOM 0 HA ARG A 55 4.477 5.708 9.979 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.198 3.855 7.669 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.357 4.688 8.686 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.311 3.156 10.204 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.328 2.159 9.184 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.862 4.211 10.672 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.004 3.107 11.728 1.00 0.00 H new ATOM 0 HE ARG A 55 7.308 1.599 9.629 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.011 3.432 12.584 1.00 0.00 H new ATOM 0 HH12 ARG A 55 9.484 2.524 12.941 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.212 0.425 10.090 1.00 0.00 H new ATOM 0 HH22 ARG A 55 10.166 0.817 11.525 1.00 0.00 H new ATOM 966 N VAL A 56 5.412 7.377 8.290 1.00 0.00 N ATOM 967 CA VAL A 56 5.682 8.519 7.433 1.00 0.00 C ATOM 968 C VAL A 56 7.179 8.574 7.120 1.00 0.00 C ATOM 969 O VAL A 56 8.008 8.306 7.988 1.00 0.00 O ATOM 970 CB VAL A 56 5.161 9.799 8.088 1.00 0.00 C ATOM 971 CG1 VAL A 56 5.209 10.975 7.109 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.746 9.599 8.636 1.00 0.00 C ATOM 0 H VAL A 56 5.981 7.334 9.135 1.00 0.00 H new ATOM 0 HA VAL A 56 5.155 8.418 6.484 1.00 0.00 H new ATOM 0 HB VAL A 56 5.815 10.035 8.928 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.833 11.873 7.600 1.00 0.00 H new ATOM 0 HG12 VAL A 56 6.238 11.140 6.789 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.590 10.751 6.240 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.400 10.524 9.096 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.075 9.326 7.821 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.754 8.804 9.381 1.00 0.00 H new ATOM 982 N TYR A 57 7.478 8.923 5.877 1.00 0.00 N ATOM 983 CA TYR A 57 8.860 9.016 5.439 1.00 0.00 C ATOM 984 C TYR A 57 9.106 10.318 4.672 1.00 0.00 C ATOM 985 O TYR A 57 8.168 11.062 4.390 1.00 0.00 O ATOM 986 CB TYR A 57 9.084 7.833 4.496 1.00 0.00 C ATOM 987 CG TYR A 57 9.163 6.479 5.204 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.025 5.916 5.746 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.372 5.820 5.301 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.100 4.642 6.412 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.446 4.546 5.967 1.00 0.00 C ATOM 992 CZ TYR A 57 9.306 4.020 6.490 1.00 0.00 C ATOM 993 OH TYR A 57 9.376 2.816 7.120 1.00 0.00 O ATOM 0 H TYR A 57 6.787 9.145 5.160 1.00 0.00 H new ATOM 0 HA TYR A 57 9.535 9.003 6.295 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.274 7.804 3.768 1.00 0.00 H new ATOM 0 HB3 TYR A 57 10.007 7.995 3.940 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.079 6.431 5.670 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.262 6.260 4.877 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.217 4.190 6.840 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.385 4.020 6.050 1.00 0.00 H new ATOM 0 HH TYR A 57 10.300 2.489 7.099 1.00 0.00 H new ATOM 1003 N ASN A 58 10.371 10.552 4.357 1.00 0.00 N ATOM 1004 CA ASN A 58 10.751 11.750 3.629 1.00 0.00 C ATOM 1005 C ASN A 58 10.355 11.596 2.159 1.00 0.00 C ATOM 1006 O ASN A 58 9.828 12.528 1.554 1.00 0.00 O ATOM 1007 CB ASN A 58 12.264 11.975 3.690 1.00 0.00 C ATOM 1008 CG ASN A 58 12.625 13.396 3.253 1.00 0.00 C ATOM 1009 OD1 ASN A 58 13.162 13.626 2.182 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.300 14.333 4.139 1.00 0.00 N ATOM 0 H ASN A 58 11.146 9.932 4.593 1.00 0.00 H new ATOM 0 HA ASN A 58 10.241 12.598 4.086 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.620 11.801 4.705 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.769 11.254 3.047 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.499 15.314 3.940 1.00 0.00 H new ATOM 0 HD22 ASN A 58 11.852 14.071 5.017 1.00 0.00 H new ATOM 1017 N SER A 59 10.623 10.412 1.628 1.00 0.00 N ATOM 1018 CA SER A 59 10.301 10.124 0.241 1.00 0.00 C ATOM 1019 C SER A 59 10.103 8.619 0.052 1.00 0.00 C ATOM 1020 O SER A 59 10.288 7.842 0.987 1.00 0.00 O ATOM 1021 CB SER A 59 11.396 10.637 -0.697 1.00 0.00 C ATOM 1022 OG SER A 59 10.928 11.687 -1.539 1.00 0.00 O ATOM 0 H SER A 59 11.060 9.641 2.134 1.00 0.00 H new ATOM 0 HA SER A 59 9.374 10.641 -0.009 1.00 0.00 H new ATOM 0 HB2 SER A 59 12.241 10.994 -0.108 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.761 9.815 -1.312 1.00 0.00 H new ATOM 0 HG SER A 59 11.656 11.988 -2.121 1.00 0.00 H new ATOM 1028 N PHE A 60 9.730 8.252 -1.165 1.00 0.00 N ATOM 1029 CA PHE A 60 9.505 6.853 -1.490 1.00 0.00 C ATOM 1030 C PHE A 60 10.805 6.052 -1.393 1.00 0.00 C ATOM 1031 O PHE A 60 10.797 4.899 -0.966 1.00 0.00 O ATOM 1032 CB PHE A 60 8.995 6.805 -2.931 1.00 0.00 C ATOM 1033 CG PHE A 60 7.472 6.726 -3.051 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.798 5.692 -2.480 1.00 0.00 C ATOM 1035 CD2 PHE A 60 6.792 7.690 -3.727 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.384 5.618 -2.591 1.00 0.00 C ATOM 1037 CE2 PHE A 60 5.378 7.617 -3.838 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.704 6.583 -3.267 1.00 0.00 C ATOM 0 H PHE A 60 9.578 8.899 -1.939 1.00 0.00 H new ATOM 0 HA PHE A 60 8.790 6.419 -0.791 1.00 0.00 H new ATOM 0 HB2 PHE A 60 9.345 7.692 -3.459 1.00 0.00 H new ATOM 0 HB3 PHE A 60 9.434 5.942 -3.432 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.338 4.927 -1.942 1.00 0.00 H new ATOM 0 HD2 PHE A 60 7.327 8.512 -4.180 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.849 4.796 -2.139 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.838 8.382 -4.376 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.629 6.528 -3.350 1.00 0.00 H new ATOM 1048 N ARG A 61 11.890 6.695 -1.798 1.00 0.00 N ATOM 1049 CA ARG A 61 13.195 6.057 -1.763 1.00 0.00 C ATOM 1050 C ARG A 61 13.513 5.577 -0.345 1.00 0.00 C ATOM 1051 O ARG A 61 13.973 4.452 -0.156 1.00 0.00 O ATOM 1052 CB ARG A 61 14.291 7.019 -2.226 1.00 0.00 C ATOM 1053 CG ARG A 61 15.481 6.254 -2.808 1.00 0.00 C ATOM 1054 CD ARG A 61 15.335 6.081 -4.322 1.00 0.00 C ATOM 1055 NE ARG A 61 15.616 7.363 -5.007 1.00 0.00 N ATOM 1056 CZ ARG A 61 16.825 7.936 -5.061 1.00 0.00 C ATOM 1057 NH1 ARG A 61 17.874 7.346 -4.472 1.00 0.00 N ATOM 1058 NH2 ARG A 61 16.987 9.100 -5.705 1.00 0.00 N ATOM 0 H ARG A 61 11.892 7.652 -2.152 1.00 0.00 H new ATOM 0 HA ARG A 61 13.166 5.204 -2.441 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.889 7.700 -2.977 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.622 7.630 -1.386 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.405 6.789 -2.587 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.557 5.276 -2.332 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.021 5.312 -4.676 1.00 0.00 H new ATOM 0 HD3 ARG A 61 14.327 5.744 -4.562 1.00 0.00 H new ATOM 0 HE ARG A 61 14.840 7.840 -5.467 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.752 6.460 -3.982 1.00 0.00 H new ATOM 0 HH12 ARG A 61 18.795 7.783 -4.514 1.00 0.00 H new ATOM 0 HH21 ARG A 61 16.189 9.550 -6.154 1.00 0.00 H new ATOM 0 HH22 ARG A 61 17.908 9.536 -5.746 1.00 0.00 H new ATOM 1072 N GLU A 62 13.255 6.454 0.614 1.00 0.00 N ATOM 1073 CA GLU A 62 13.508 6.134 2.008 1.00 0.00 C ATOM 1074 C GLU A 62 12.638 4.955 2.449 1.00 0.00 C ATOM 1075 O GLU A 62 13.036 4.172 3.309 1.00 0.00 O ATOM 1076 CB GLU A 62 13.273 7.353 2.902 1.00 0.00 C ATOM 1077 CG GLU A 62 14.595 8.038 3.254 1.00 0.00 C ATOM 1078 CD GLU A 62 14.355 9.457 3.775 1.00 0.00 C ATOM 1079 OE1 GLU A 62 13.537 9.587 4.711 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.996 10.379 3.225 1.00 0.00 O ATOM 0 H GLU A 62 12.873 7.386 0.453 1.00 0.00 H new ATOM 0 HA GLU A 62 14.554 5.846 2.110 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.617 8.060 2.394 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.764 7.046 3.816 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.122 7.454 4.009 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.236 8.074 2.373 1.00 0.00 H new ATOM 1087 N MET A 63 11.465 4.866 1.838 1.00 0.00 N ATOM 1088 CA MET A 63 10.535 3.796 2.156 1.00 0.00 C ATOM 1089 C MET A 63 10.988 2.473 1.535 1.00 0.00 C ATOM 1090 O MET A 63 11.040 1.449 2.215 1.00 0.00 O ATOM 1091 CB MET A 63 9.144 4.156 1.632 1.00 0.00 C ATOM 1092 CG MET A 63 8.169 4.397 2.787 1.00 0.00 C ATOM 1093 SD MET A 63 6.490 4.382 2.181 1.00 0.00 S ATOM 1094 CE MET A 63 6.481 2.812 1.332 1.00 0.00 C ATOM 0 H MET A 63 11.138 5.517 1.125 1.00 0.00 H new ATOM 0 HA MET A 63 10.505 3.676 3.239 1.00 0.00 H new ATOM 0 HB2 MET A 63 9.205 5.049 1.011 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.771 3.352 0.998 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.297 3.627 3.548 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.384 5.354 3.262 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.500 2.349 1.434 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.700 2.968 0.276 1.00 0.00 H new ATOM 0 HE3 MET A 63 7.238 2.159 1.767 1.00 0.00 H new ATOM 1104 N LEU A 64 11.305 2.537 0.250 1.00 0.00 N ATOM 1105 CA LEU A 64 11.751 1.357 -0.471 1.00 0.00 C ATOM 1106 C LEU A 64 13.166 0.992 -0.016 1.00 0.00 C ATOM 1107 O LEU A 64 13.541 -0.179 -0.024 1.00 0.00 O ATOM 1108 CB LEU A 64 11.627 1.573 -1.981 1.00 0.00 C ATOM 1109 CG LEU A 64 10.319 2.203 -2.463 1.00 0.00 C ATOM 1110 CD1 LEU A 64 10.492 2.834 -3.846 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.177 1.185 -2.436 1.00 0.00 C ATOM 0 H LEU A 64 11.262 3.388 -0.311 1.00 0.00 H new ATOM 0 HA LEU A 64 11.111 0.505 -0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.453 2.205 -2.307 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.748 0.610 -2.477 1.00 0.00 H new ATOM 0 HG LEU A 64 10.052 3.004 -1.774 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.548 3.275 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.257 3.609 -3.799 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.795 2.068 -4.560 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.259 1.659 -2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.422 0.346 -3.088 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.036 0.824 -1.417 1.00 0.00 H new ATOM 1123 N GLU A 65 13.912 2.017 0.370 1.00 0.00 N ATOM 1124 CA GLU A 65 15.277 1.818 0.827 1.00 0.00 C ATOM 1125 C GLU A 65 15.283 1.231 2.240 1.00 0.00 C ATOM 1126 O GLU A 65 16.035 0.300 2.526 1.00 0.00 O ATOM 1127 CB GLU A 65 16.068 3.126 0.774 1.00 0.00 C ATOM 1128 CG GLU A 65 16.352 3.538 -0.672 1.00 0.00 C ATOM 1129 CD GLU A 65 17.562 2.786 -1.229 1.00 0.00 C ATOM 1130 OE1 GLU A 65 17.404 1.576 -1.499 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.619 3.438 -1.371 1.00 0.00 O ATOM 0 H GLU A 65 13.597 2.987 0.376 1.00 0.00 H new ATOM 0 HA GLU A 65 15.764 1.109 0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.508 3.914 1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 65 17.008 3.009 1.314 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.477 3.335 -1.290 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.534 4.612 -0.719 1.00 0.00 H new ATOM 1138 N LYS A 66 14.436 1.798 3.086 1.00 0.00 N ATOM 1139 CA LYS A 66 14.334 1.342 4.462 1.00 0.00 C ATOM 1140 C LYS A 66 13.402 0.131 4.526 1.00 0.00 C ATOM 1141 O LYS A 66 13.831 -0.970 4.867 1.00 0.00 O ATOM 1142 CB LYS A 66 13.912 2.492 5.378 1.00 0.00 C ATOM 1143 CG LYS A 66 14.449 2.290 6.796 1.00 0.00 C ATOM 1144 CD LYS A 66 13.634 3.094 7.811 1.00 0.00 C ATOM 1145 CE LYS A 66 13.990 4.581 7.746 1.00 0.00 C ATOM 1146 NZ LYS A 66 12.872 5.404 8.260 1.00 0.00 N ATOM 0 H LYS A 66 13.814 2.569 2.845 1.00 0.00 H new ATOM 0 HA LYS A 66 15.307 1.015 4.828 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.282 3.436 4.977 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.824 2.561 5.404 1.00 0.00 H new ATOM 0 HG2 LYS A 66 14.415 1.232 7.054 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.494 2.596 6.840 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.570 2.962 7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.822 2.715 8.816 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.889 4.772 8.332 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.214 4.863 6.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.143 6.408 8.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.032 5.260 7.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.655 5.123 9.237 1.00 0.00 H new ATOM 1160 N GLU A 67 12.143 0.375 4.191 1.00 0.00 N ATOM 1161 CA GLU A 67 11.147 -0.683 4.206 1.00 0.00 C ATOM 1162 C GLU A 67 11.538 -1.795 3.231 1.00 0.00 C ATOM 1163 O GLU A 67 11.603 -2.963 3.610 1.00 0.00 O ATOM 1164 CB GLU A 67 9.758 -0.131 3.880 1.00 0.00 C ATOM 1165 CG GLU A 67 8.711 -0.667 4.859 1.00 0.00 C ATOM 1166 CD GLU A 67 8.826 -2.186 5.007 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.781 -2.864 3.958 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.958 -2.634 6.167 1.00 0.00 O ATOM 0 H GLU A 67 11.790 1.289 3.908 1.00 0.00 H new ATOM 0 HA GLU A 67 11.108 -1.105 5.210 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.777 0.958 3.922 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.483 -0.406 2.862 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.841 -0.192 5.832 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.712 -0.407 4.508 1.00 0.00 H new ATOM 1175 N GLY A 68 11.789 -1.392 1.994 1.00 0.00 N ATOM 1176 CA GLY A 68 12.172 -2.340 0.962 1.00 0.00 C ATOM 1177 C GLY A 68 11.284 -2.193 -0.275 1.00 0.00 C ATOM 1178 O GLY A 68 10.058 -2.210 -0.169 1.00 0.00 O ATOM 0 H GLY A 68 11.735 -0.422 1.683 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.215 -2.181 0.686 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.096 -3.356 1.350 1.00 0.00 H new ATOM 1182 N LEU A 69 11.936 -2.052 -1.420 1.00 0.00 N ATOM 1183 CA LEU A 69 11.221 -1.902 -2.675 1.00 0.00 C ATOM 1184 C LEU A 69 10.316 -3.118 -2.890 1.00 0.00 C ATOM 1185 O LEU A 69 9.100 -2.977 -3.011 1.00 0.00 O ATOM 1186 CB LEU A 69 12.201 -1.654 -3.824 1.00 0.00 C ATOM 1187 CG LEU A 69 11.673 -1.944 -5.230 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.651 -0.889 -5.660 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.822 -2.069 -6.233 1.00 0.00 C ATOM 0 H LEU A 69 12.952 -2.039 -1.504 1.00 0.00 H new ATOM 0 HA LEU A 69 10.575 -1.025 -2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.520 -0.612 -3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.088 -2.265 -3.657 1.00 0.00 H new ATOM 0 HG LEU A 69 11.157 -2.904 -5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.291 -1.118 -6.663 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.812 -0.891 -4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.121 0.094 -5.659 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.419 -2.275 -7.224 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.387 -1.137 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.480 -2.884 -5.932 1.00 0.00 H new ATOM 1201 N GLU A 70 10.945 -4.283 -2.932 1.00 0.00 N ATOM 1202 CA GLU A 70 10.212 -5.522 -3.131 1.00 0.00 C ATOM 1203 C GLU A 70 9.309 -5.803 -1.928 1.00 0.00 C ATOM 1204 O GLU A 70 8.472 -6.703 -1.973 1.00 0.00 O ATOM 1205 CB GLU A 70 11.168 -6.690 -3.383 1.00 0.00 C ATOM 1206 CG GLU A 70 11.280 -6.993 -4.879 1.00 0.00 C ATOM 1207 CD GLU A 70 12.193 -8.195 -5.128 1.00 0.00 C ATOM 1208 OE1 GLU A 70 13.394 -8.072 -4.803 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.670 -9.210 -5.636 1.00 0.00 O ATOM 0 H GLU A 70 11.954 -4.395 -2.832 1.00 0.00 H new ATOM 0 HA GLU A 70 9.584 -5.412 -4.015 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.153 -6.452 -2.982 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.814 -7.575 -2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.290 -7.193 -5.288 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.671 -6.120 -5.402 1.00 0.00 H new ATOM 1216 N ASN A 71 9.509 -5.015 -0.882 1.00 0.00 N ATOM 1217 CA ASN A 71 8.723 -5.168 0.331 1.00 0.00 C ATOM 1218 C ASN A 71 7.550 -4.186 0.300 1.00 0.00 C ATOM 1219 O ASN A 71 6.858 -4.009 1.301 1.00 0.00 O ATOM 1220 CB ASN A 71 9.562 -4.864 1.573 1.00 0.00 C ATOM 1221 CG ASN A 71 9.937 -6.151 2.310 1.00 0.00 C ATOM 1222 OD1 ASN A 71 9.251 -7.157 2.245 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.063 -6.063 3.014 1.00 0.00 N ATOM 0 H ASN A 71 10.204 -4.269 -0.849 1.00 0.00 H new ATOM 0 HA ASN A 71 8.371 -6.199 0.378 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.467 -4.330 1.283 1.00 0.00 H new ATOM 0 HB3 ASN A 71 9.005 -4.207 2.241 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.399 -6.869 3.542 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.590 -5.190 3.026 1.00 0.00 H new ATOM 1230 N VAL A 72 7.363 -3.574 -0.860 1.00 0.00 N ATOM 1231 CA VAL A 72 6.286 -2.614 -1.034 1.00 0.00 C ATOM 1232 C VAL A 72 5.613 -2.849 -2.388 1.00 0.00 C ATOM 1233 O VAL A 72 4.390 -2.954 -2.468 1.00 0.00 O ATOM 1234 CB VAL A 72 6.822 -1.190 -0.872 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.693 -0.164 -0.985 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.574 -1.035 0.451 1.00 0.00 C ATOM 0 H VAL A 72 7.939 -3.724 -1.688 1.00 0.00 H new ATOM 0 HA VAL A 72 5.526 -2.750 -0.265 1.00 0.00 H new ATOM 0 HB VAL A 72 7.527 -1.003 -1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.101 0.840 -0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.220 -0.250 -1.963 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.953 -0.350 -0.206 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.945 -0.014 0.541 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.900 -1.251 1.280 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.414 -1.729 0.476 1.00 0.00 H new ATOM 1246 N LEU A 73 6.442 -2.925 -3.419 1.00 0.00 N ATOM 1247 CA LEU A 73 5.943 -3.146 -4.766 1.00 0.00 C ATOM 1248 C LEU A 73 6.537 -4.443 -5.319 1.00 0.00 C ATOM 1249 O LEU A 73 7.663 -4.453 -5.813 1.00 0.00 O ATOM 1250 CB LEU A 73 6.212 -1.922 -5.644 1.00 0.00 C ATOM 1251 CG LEU A 73 5.281 -1.741 -6.845 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.124 -0.800 -6.505 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.059 -1.272 -8.076 1.00 0.00 C ATOM 0 H LEU A 73 7.456 -2.837 -3.349 1.00 0.00 H new ATOM 0 HA LEU A 73 4.860 -3.270 -4.756 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.146 -1.030 -5.020 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.237 -1.980 -6.010 1.00 0.00 H new ATOM 0 HG LEU A 73 4.846 -2.710 -7.089 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.478 -0.689 -7.376 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.549 -1.215 -5.677 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.520 0.175 -6.220 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.374 -1.151 -8.915 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.541 -0.318 -7.860 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.818 -2.012 -8.331 1.00 0.00 H new ATOM 1265 N PRO A 74 5.732 -5.534 -5.216 1.00 0.00 N ATOM 1266 CA PRO A 74 6.166 -6.833 -5.700 1.00 0.00 C ATOM 1267 C PRO A 74 6.112 -6.895 -7.228 1.00 0.00 C ATOM 1268 O PRO A 74 5.035 -6.822 -7.818 1.00 0.00 O ATOM 1269 CB PRO A 74 5.236 -7.833 -5.032 1.00 0.00 C ATOM 1270 CG PRO A 74 4.029 -7.034 -4.568 1.00 0.00 C ATOM 1271 CD PRO A 74 4.391 -5.559 -4.638 1.00 0.00 C ATOM 0 HA PRO A 74 7.205 -7.048 -5.452 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.941 -8.618 -5.729 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.727 -8.322 -4.191 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.166 -7.245 -5.199 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.756 -7.312 -3.550 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.683 -5.006 -5.256 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.377 -5.100 -3.649 1.00 0.00 H new ATOM 1279 N GLY A 75 7.287 -7.029 -7.825 1.00 0.00 N ATOM 1280 CA GLY A 75 7.387 -7.101 -9.272 1.00 0.00 C ATOM 1281 C GLY A 75 8.088 -5.864 -9.836 1.00 0.00 C ATOM 1282 O GLY A 75 8.547 -5.871 -10.978 1.00 0.00 O ATOM 0 H GLY A 75 8.178 -7.090 -7.332 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.938 -7.997 -9.558 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.390 -7.188 -9.705 1.00 0.00 H new ATOM 1286 N VAL A 76 8.149 -4.830 -9.010 1.00 0.00 N ATOM 1287 CA VAL A 76 8.786 -3.587 -9.412 1.00 0.00 C ATOM 1288 C VAL A 76 10.042 -3.903 -10.227 1.00 0.00 C ATOM 1289 O VAL A 76 10.657 -4.952 -10.043 1.00 0.00 O ATOM 1290 CB VAL A 76 9.073 -2.724 -8.181 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.885 -3.502 -7.144 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.784 -1.428 -8.575 1.00 0.00 C ATOM 0 H VAL A 76 7.768 -4.827 -8.064 1.00 0.00 H new ATOM 0 HA VAL A 76 8.121 -3.006 -10.051 1.00 0.00 H new ATOM 0 HB VAL A 76 8.118 -2.458 -7.727 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.075 -2.866 -6.279 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.325 -4.383 -6.830 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.834 -3.812 -7.582 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.976 -0.833 -7.682 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.729 -1.665 -9.064 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.154 -0.861 -9.260 1.00 0.00 H new ATOM 1302 N LYS A 77 10.384 -2.976 -11.110 1.00 0.00 N ATOM 1303 CA LYS A 77 11.555 -3.143 -11.954 1.00 0.00 C ATOM 1304 C LYS A 77 12.793 -2.647 -11.204 1.00 0.00 C ATOM 1305 O LYS A 77 13.887 -3.179 -11.384 1.00 0.00 O ATOM 1306 CB LYS A 77 11.342 -2.462 -13.307 1.00 0.00 C ATOM 1307 CG LYS A 77 10.427 -3.299 -14.204 1.00 0.00 C ATOM 1308 CD LYS A 77 10.853 -3.196 -15.670 1.00 0.00 C ATOM 1309 CE LYS A 77 11.788 -4.345 -16.051 1.00 0.00 C ATOM 1310 NZ LYS A 77 12.315 -4.152 -17.421 1.00 0.00 N ATOM 0 H LYS A 77 9.871 -2.107 -11.259 1.00 0.00 H new ATOM 0 HA LYS A 77 11.717 -4.198 -12.176 1.00 0.00 H new ATOM 0 HB2 LYS A 77 10.906 -1.475 -13.157 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.303 -2.314 -13.799 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.454 -4.341 -13.886 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.397 -2.960 -14.096 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.971 -3.212 -16.311 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.354 -2.243 -15.841 1.00 0.00 H new ATOM 0 HE2 LYS A 77 12.614 -4.400 -15.342 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.253 -5.293 -15.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.948 -4.941 -17.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.524 -4.122 -18.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.843 -3.257 -17.467 1.00 0.00 H new ATOM 1324 N SER A 78 12.579 -1.633 -10.379 1.00 0.00 N ATOM 1325 CA SER A 78 13.664 -1.059 -9.601 1.00 0.00 C ATOM 1326 C SER A 78 13.121 0.023 -8.665 1.00 0.00 C ATOM 1327 O SER A 78 11.972 0.443 -8.796 1.00 0.00 O ATOM 1328 CB SER A 78 14.747 -0.478 -10.512 1.00 0.00 C ATOM 1329 OG SER A 78 15.663 -1.475 -10.956 1.00 0.00 O ATOM 0 H SER A 78 11.670 -1.194 -10.232 1.00 0.00 H new ATOM 0 HA SER A 78 14.115 -1.853 -9.006 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.279 -0.005 -11.376 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.290 0.301 -9.978 1.00 0.00 H new ATOM 0 HG SER A 78 15.166 -2.240 -11.313 1.00 0.00 H new ATOM 1335 N ILE A 79 13.973 0.443 -7.741 1.00 0.00 N ATOM 1336 CA ILE A 79 13.593 1.468 -6.784 1.00 0.00 C ATOM 1337 C ILE A 79 13.129 2.716 -7.536 1.00 0.00 C ATOM 1338 O ILE A 79 12.116 3.318 -7.182 1.00 0.00 O ATOM 1339 CB ILE A 79 14.736 1.732 -5.800 1.00 0.00 C ATOM 1340 CG1 ILE A 79 15.100 0.461 -5.030 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.395 2.892 -4.863 1.00 0.00 C ATOM 1342 CD1 ILE A 79 16.052 0.775 -3.874 1.00 0.00 C ATOM 0 H ILE A 79 14.925 0.092 -7.635 1.00 0.00 H new ATOM 0 HA ILE A 79 12.752 1.130 -6.178 1.00 0.00 H new ATOM 0 HB ILE A 79 15.617 2.027 -6.370 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.194 -0.006 -4.643 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.566 -0.257 -5.705 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.223 3.059 -4.174 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.223 3.795 -5.449 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.495 2.650 -4.297 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.295 -0.145 -3.343 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.966 1.220 -4.266 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.573 1.474 -3.188 1.00 0.00 H new ATOM 1354 N GLU A 80 13.892 3.069 -8.561 1.00 0.00 N ATOM 1355 CA GLU A 80 13.572 4.235 -9.366 1.00 0.00 C ATOM 1356 C GLU A 80 12.254 4.018 -10.113 1.00 0.00 C ATOM 1357 O GLU A 80 11.423 4.921 -10.188 1.00 0.00 O ATOM 1358 CB GLU A 80 14.707 4.557 -10.340 1.00 0.00 C ATOM 1359 CG GLU A 80 15.499 5.780 -9.873 1.00 0.00 C ATOM 1360 CD GLU A 80 15.604 6.824 -10.987 1.00 0.00 C ATOM 1361 OE1 GLU A 80 16.189 6.477 -12.035 1.00 0.00 O ATOM 1362 OE2 GLU A 80 15.096 7.944 -10.764 1.00 0.00 O ATOM 0 H GLU A 80 14.731 2.567 -8.852 1.00 0.00 H new ATOM 0 HA GLU A 80 13.454 5.091 -8.701 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.373 3.698 -10.425 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.297 4.742 -11.333 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.014 6.220 -9.002 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.498 5.474 -9.562 1.00 0.00 H new ATOM 1369 N GLU A 81 12.104 2.814 -10.647 1.00 0.00 N ATOM 1370 CA GLU A 81 10.902 2.468 -11.386 1.00 0.00 C ATOM 1371 C GLU A 81 9.674 2.572 -10.479 1.00 0.00 C ATOM 1372 O GLU A 81 8.610 3.008 -10.917 1.00 0.00 O ATOM 1373 CB GLU A 81 11.017 1.069 -11.995 1.00 0.00 C ATOM 1374 CG GLU A 81 11.759 1.112 -13.332 1.00 0.00 C ATOM 1375 CD GLU A 81 10.820 1.529 -14.466 1.00 0.00 C ATOM 1376 OE1 GLU A 81 10.214 2.614 -14.331 1.00 0.00 O ATOM 1377 OE2 GLU A 81 10.729 0.753 -15.442 1.00 0.00 O ATOM 0 H GLU A 81 12.795 2.067 -10.582 1.00 0.00 H new ATOM 0 HA GLU A 81 10.785 3.177 -12.206 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.543 0.410 -11.304 1.00 0.00 H new ATOM 0 HB3 GLU A 81 10.022 0.649 -12.141 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.591 1.813 -13.268 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.184 0.132 -13.548 1.00 0.00 H new ATOM 1384 N GLY A 82 9.862 2.164 -9.233 1.00 0.00 N ATOM 1385 CA GLY A 82 8.783 2.206 -8.261 1.00 0.00 C ATOM 1386 C GLY A 82 8.196 3.615 -8.153 1.00 0.00 C ATOM 1387 O GLY A 82 6.979 3.789 -8.185 1.00 0.00 O ATOM 0 H GLY A 82 10.746 1.803 -8.874 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.001 1.504 -8.550 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.154 1.887 -7.287 1.00 0.00 H new ATOM 1391 N ILE A 83 9.090 4.585 -8.027 1.00 0.00 N ATOM 1392 CA ILE A 83 8.676 5.974 -7.915 1.00 0.00 C ATOM 1393 C ILE A 83 7.838 6.352 -9.137 1.00 0.00 C ATOM 1394 O ILE A 83 6.812 7.020 -9.008 1.00 0.00 O ATOM 1395 CB ILE A 83 9.891 6.878 -7.698 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.313 6.887 -6.228 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.624 8.290 -8.226 1.00 0.00 C ATOM 1398 CD1 ILE A 83 11.830 6.734 -6.092 1.00 0.00 C ATOM 0 H ILE A 83 10.099 4.437 -8.000 1.00 0.00 H new ATOM 0 HA ILE A 83 8.043 6.114 -7.039 1.00 0.00 H new ATOM 0 HB ILE A 83 10.725 6.472 -8.270 1.00 0.00 H new ATOM 0 HG12 ILE A 83 9.994 7.819 -5.760 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.813 6.077 -5.697 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.503 8.913 -8.060 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.408 8.245 -9.293 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.771 8.719 -7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.104 6.744 -5.037 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.142 5.790 -6.539 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.326 7.559 -6.603 1.00 0.00 H new ATOM 1410 N GLN A 84 8.304 5.910 -10.295 1.00 0.00 N ATOM 1411 CA GLN A 84 7.610 6.194 -11.540 1.00 0.00 C ATOM 1412 C GLN A 84 6.154 5.729 -11.453 1.00 0.00 C ATOM 1413 O GLN A 84 5.254 6.400 -11.955 1.00 0.00 O ATOM 1414 CB GLN A 84 8.323 5.543 -12.727 1.00 0.00 C ATOM 1415 CG GLN A 84 9.143 6.574 -13.505 1.00 0.00 C ATOM 1416 CD GLN A 84 10.211 7.211 -12.614 1.00 0.00 C ATOM 1417 OE1 GLN A 84 10.538 6.722 -11.545 1.00 0.00 O ATOM 1418 NE2 GLN A 84 10.736 8.328 -13.112 1.00 0.00 N ATOM 0 H GLN A 84 9.155 5.357 -10.398 1.00 0.00 H new ATOM 0 HA GLN A 84 7.619 7.272 -11.701 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.976 4.746 -12.371 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.589 5.082 -13.388 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.617 6.095 -14.362 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.483 7.348 -13.897 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.417 8.684 -14.013 1.00 0.00 H new ATOM 0 HE22 GLN A 84 11.457 8.828 -12.592 1.00 0.00 H new ATOM 1427 N VAL A 85 5.969 4.584 -10.813 1.00 0.00 N ATOM 1428 CA VAL A 85 4.639 4.022 -10.654 1.00 0.00 C ATOM 1429 C VAL A 85 3.798 4.952 -9.776 1.00 0.00 C ATOM 1430 O VAL A 85 2.714 5.374 -10.174 1.00 0.00 O ATOM 1431 CB VAL A 85 4.734 2.600 -10.099 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.476 2.234 -9.308 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.990 1.590 -11.220 1.00 0.00 C ATOM 0 H VAL A 85 6.718 4.030 -10.398 1.00 0.00 H new ATOM 0 HA VAL A 85 4.139 3.946 -11.620 1.00 0.00 H new ATOM 0 HB VAL A 85 5.582 2.564 -9.415 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.570 1.218 -8.925 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.356 2.926 -8.475 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.605 2.297 -9.960 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.053 0.587 -10.798 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.172 1.630 -11.940 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.927 1.833 -11.721 1.00 0.00 H new ATOM 1443 N TYR A 86 4.331 5.242 -8.599 1.00 0.00 N ATOM 1444 CA TYR A 86 3.644 6.114 -7.661 1.00 0.00 C ATOM 1445 C TYR A 86 3.431 7.505 -8.260 1.00 0.00 C ATOM 1446 O TYR A 86 2.537 8.237 -7.838 1.00 0.00 O ATOM 1447 CB TYR A 86 4.563 6.232 -6.443 1.00 0.00 C ATOM 1448 CG TYR A 86 5.106 4.892 -5.942 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.373 3.738 -6.126 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.329 4.838 -5.305 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.884 2.477 -5.654 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.840 3.578 -4.833 1.00 0.00 C ATOM 1453 CZ TYR A 86 6.092 2.459 -5.031 1.00 0.00 C ATOM 1454 OH TYR A 86 6.575 1.268 -4.585 1.00 0.00 O ATOM 0 H TYR A 86 5.231 4.889 -8.273 1.00 0.00 H new ATOM 0 HA TYR A 86 2.664 5.708 -7.408 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.402 6.881 -6.695 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.017 6.717 -5.634 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.416 3.780 -6.624 1.00 0.00 H new ATOM 0 HD2 TYR A 86 6.903 5.741 -5.161 1.00 0.00 H new ATOM 0 HE1 TYR A 86 4.320 1.566 -5.792 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.796 3.522 -4.333 1.00 0.00 H new ATOM 0 HH TYR A 86 7.496 1.151 -4.897 1.00 0.00 H new ATOM 1464 N ARG A 87 4.267 7.828 -9.236 1.00 0.00 N ATOM 1465 CA ARG A 87 4.182 9.119 -9.898 1.00 0.00 C ATOM 1466 C ARG A 87 2.982 9.150 -10.848 1.00 0.00 C ATOM 1467 O ARG A 87 2.192 10.092 -10.825 1.00 0.00 O ATOM 1468 CB ARG A 87 5.457 9.418 -10.688 1.00 0.00 C ATOM 1469 CG ARG A 87 6.422 10.277 -9.867 1.00 0.00 C ATOM 1470 CD ARG A 87 6.507 11.697 -10.430 1.00 0.00 C ATOM 1471 NE ARG A 87 7.787 12.323 -10.031 1.00 0.00 N ATOM 1472 CZ ARG A 87 8.936 12.182 -10.705 1.00 0.00 C ATOM 1473 NH1 ARG A 87 8.972 11.435 -11.817 1.00 0.00 N ATOM 1474 NH2 ARG A 87 10.048 12.788 -10.268 1.00 0.00 N ATOM 0 H ARG A 87 5.007 7.218 -9.584 1.00 0.00 H new ATOM 0 HA ARG A 87 4.060 9.880 -9.127 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.944 8.484 -10.967 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.203 9.934 -11.614 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.090 10.313 -8.829 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.412 9.821 -9.869 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.428 11.672 -11.517 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.671 12.293 -10.064 1.00 0.00 H new ATOM 0 HE ARG A 87 7.795 12.899 -9.189 1.00 0.00 H new ATOM 0 HH11 ARG A 87 8.125 10.974 -12.150 1.00 0.00 H new ATOM 0 HH12 ARG A 87 9.846 11.327 -12.331 1.00 0.00 H new ATOM 0 HH21 ARG A 87 10.020 13.357 -9.422 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.923 12.680 -10.781 1.00 0.00 H new ATOM 1488 N ARG A 88 2.885 8.108 -11.661 1.00 0.00 N ATOM 1489 CA ARG A 88 1.796 8.004 -12.617 1.00 0.00 C ATOM 1490 C ARG A 88 0.478 7.722 -11.891 1.00 0.00 C ATOM 1491 O ARG A 88 -0.597 8.009 -12.416 1.00 0.00 O ATOM 1492 CB ARG A 88 2.059 6.890 -13.632 1.00 0.00 C ATOM 1493 CG ARG A 88 2.238 5.541 -12.933 1.00 0.00 C ATOM 1494 CD ARG A 88 2.299 4.400 -13.951 1.00 0.00 C ATOM 1495 NE ARG A 88 0.930 3.973 -14.315 1.00 0.00 N ATOM 1496 CZ ARG A 88 0.641 3.187 -15.360 1.00 0.00 C ATOM 1497 NH1 ARG A 88 1.625 2.737 -16.152 1.00 0.00 N ATOM 1498 NH2 ARG A 88 -0.630 2.850 -15.615 1.00 0.00 N ATOM 0 H ARG A 88 3.543 7.329 -11.677 1.00 0.00 H new ATOM 0 HA ARG A 88 1.728 8.954 -13.147 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.229 6.831 -14.336 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.952 7.125 -14.211 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.152 5.553 -12.340 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.412 5.373 -12.242 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.836 4.725 -14.842 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.852 3.559 -13.534 1.00 0.00 H new ATOM 0 HE ARG A 88 0.158 4.298 -13.733 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.593 2.993 -15.958 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.405 2.138 -16.948 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.379 3.192 -15.013 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.849 2.251 -16.411 1.00 0.00 H new ATOM 1512 N PHE A 89 0.605 7.164 -10.696 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.562 6.841 -9.894 1.00 0.00 C ATOM 1514 C PHE A 89 -0.969 8.025 -9.014 1.00 0.00 C ATOM 1515 O PHE A 89 -2.110 8.479 -9.067 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.176 5.663 -8.996 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.667 4.306 -9.504 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -1.984 3.980 -9.406 1.00 0.00 C ATOM 1519 CD2 PHE A 89 0.213 3.427 -10.054 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.440 2.720 -9.878 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.243 2.167 -10.525 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.560 1.841 -10.427 1.00 0.00 C ATOM 0 H PHE A 89 1.498 6.928 -10.264 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.403 6.600 -10.543 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.909 5.633 -8.901 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.579 5.833 -7.998 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.683 4.679 -8.970 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.258 3.687 -10.133 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.485 2.460 -9.801 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.456 1.468 -10.961 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.907 0.883 -10.786 1.00 0.00 H new ATOM 1532 N TYR A 90 -0.011 8.491 -8.226 1.00 0.00 N ATOM 1533 CA TYR A 90 -0.255 9.614 -7.337 1.00 0.00 C ATOM 1534 C TYR A 90 0.365 10.898 -7.892 1.00 0.00 C ATOM 1535 O TYR A 90 1.330 10.848 -8.653 1.00 0.00 O ATOM 1536 CB TYR A 90 0.431 9.262 -6.015 1.00 0.00 C ATOM 1537 CG TYR A 90 0.455 7.763 -5.707 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.662 6.990 -5.951 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.595 7.184 -5.186 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.639 5.580 -5.661 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.618 5.774 -4.896 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.500 5.041 -5.148 1.00 0.00 C ATOM 1543 OH TYR A 90 0.522 3.709 -4.874 1.00 0.00 O ATOM 0 H TYR A 90 0.935 8.112 -8.185 1.00 0.00 H new ATOM 0 HA TYR A 90 -1.325 9.786 -7.221 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.455 9.634 -6.038 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -0.079 9.781 -5.203 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.553 7.443 -6.359 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.469 7.789 -4.996 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.506 4.964 -5.847 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.503 5.309 -4.488 1.00 0.00 H new ATOM 0 HH TYR A 90 1.400 3.464 -4.514 1.00 0.00 H new ATOM 1553 N ASP A 91 -0.216 12.019 -7.490 1.00 0.00 N ATOM 1554 CA ASP A 91 0.267 13.314 -7.938 1.00 0.00 C ATOM 1555 C ASP A 91 1.604 13.618 -7.259 1.00 0.00 C ATOM 1556 O ASP A 91 1.814 13.254 -6.103 1.00 0.00 O ATOM 1557 CB ASP A 91 -0.716 14.427 -7.567 1.00 0.00 C ATOM 1558 CG ASP A 91 -2.181 13.996 -7.488 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -2.538 13.382 -6.459 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -2.913 14.290 -8.458 1.00 0.00 O ATOM 0 H ASP A 91 -1.017 12.057 -6.859 1.00 0.00 H new ATOM 0 HA ASP A 91 0.377 13.276 -9.022 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -0.423 14.843 -6.603 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.628 15.228 -8.301 1.00 0.00 H new ATOM 1565 N GLU A 92 2.473 14.283 -8.007 1.00 0.00 N ATOM 1566 CA GLU A 92 3.784 14.639 -7.491 1.00 0.00 C ATOM 1567 C GLU A 92 3.661 15.765 -6.462 1.00 0.00 C ATOM 1568 O GLU A 92 4.286 15.714 -5.404 1.00 0.00 O ATOM 1569 CB GLU A 92 4.730 15.035 -8.627 1.00 0.00 C ATOM 1570 CG GLU A 92 6.148 15.270 -8.102 1.00 0.00 C ATOM 1571 CD GLU A 92 6.591 16.714 -8.348 1.00 0.00 C ATOM 1572 OE1 GLU A 92 6.861 17.032 -9.526 1.00 0.00 O ATOM 1573 OE2 GLU A 92 6.651 17.467 -7.352 1.00 0.00 O ATOM 0 H GLU A 92 2.295 14.584 -8.965 1.00 0.00 H new ATOM 0 HA GLU A 92 4.209 13.766 -6.996 1.00 0.00 H new ATOM 0 HB2 GLU A 92 4.744 14.251 -9.384 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.363 15.940 -9.112 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.186 15.051 -7.035 1.00 0.00 H new ATOM 0 HG3 GLU A 92 6.840 14.585 -8.593 1.00 0.00 H new ATOM 1580 N GLU A 93 2.852 16.755 -6.809 1.00 0.00 N ATOM 1581 CA GLU A 93 2.640 17.891 -5.929 1.00 0.00 C ATOM 1582 C GLU A 93 2.175 17.415 -4.551 1.00 0.00 C ATOM 1583 O GLU A 93 2.698 17.856 -3.529 1.00 0.00 O ATOM 1584 CB GLU A 93 1.638 18.876 -6.536 1.00 0.00 C ATOM 1585 CG GLU A 93 2.241 20.278 -6.637 1.00 0.00 C ATOM 1586 CD GLU A 93 2.476 20.670 -8.097 1.00 0.00 C ATOM 1587 OE1 GLU A 93 1.486 20.634 -8.861 1.00 0.00 O ATOM 1588 OE2 GLU A 93 3.639 20.997 -8.417 1.00 0.00 O ATOM 0 H GLU A 93 2.335 16.794 -7.688 1.00 0.00 H new ATOM 0 HA GLU A 93 3.588 18.416 -5.810 1.00 0.00 H new ATOM 0 HB2 GLU A 93 1.339 18.532 -7.526 1.00 0.00 H new ATOM 0 HB3 GLU A 93 0.737 18.907 -5.924 1.00 0.00 H new ATOM 0 HG2 GLU A 93 1.574 21.000 -6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.184 20.312 -6.091 1.00 0.00 H new ATOM 1595 N LYS A 94 1.196 16.522 -4.568 1.00 0.00 N ATOM 1596 CA LYS A 94 0.655 15.982 -3.333 1.00 0.00 C ATOM 1597 C LYS A 94 1.728 15.144 -2.634 1.00 0.00 C ATOM 1598 O LYS A 94 1.808 15.129 -1.407 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.642 15.217 -3.605 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.841 15.929 -2.976 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.402 15.124 -1.802 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.847 14.697 -2.071 1.00 0.00 C ATOM 1603 NZ LYS A 94 -4.644 14.750 -0.825 1.00 0.00 N ATOM 0 H LYS A 94 0.764 16.159 -5.418 1.00 0.00 H new ATOM 0 HA LYS A 94 0.385 16.788 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.794 15.122 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.563 14.206 -3.204 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.541 16.919 -2.633 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.618 16.073 -3.727 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.784 14.242 -1.633 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.359 15.723 -0.892 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -4.292 15.350 -2.822 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.864 13.686 -2.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.622 14.457 -1.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.228 14.109 -0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.643 15.721 -0.453 1.00 0.00 H new ATOM 1617 N GLU A 95 2.525 14.466 -3.446 1.00 0.00 N ATOM 1618 CA GLU A 95 3.590 13.627 -2.921 1.00 0.00 C ATOM 1619 C GLU A 95 4.630 14.482 -2.196 1.00 0.00 C ATOM 1620 O GLU A 95 4.955 14.221 -1.038 1.00 0.00 O ATOM 1621 CB GLU A 95 4.238 12.803 -4.036 1.00 0.00 C ATOM 1622 CG GLU A 95 4.461 11.357 -3.589 1.00 0.00 C ATOM 1623 CD GLU A 95 3.543 10.399 -4.351 1.00 0.00 C ATOM 1624 OE1 GLU A 95 3.394 10.610 -5.574 1.00 0.00 O ATOM 1625 OE2 GLU A 95 3.012 9.479 -3.694 1.00 0.00 O ATOM 0 H GLU A 95 2.455 14.480 -4.464 1.00 0.00 H new ATOM 0 HA GLU A 95 3.157 12.930 -2.203 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.603 12.820 -4.922 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.191 13.251 -4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.502 11.078 -3.755 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.274 11.271 -2.519 1.00 0.00 H new ATOM 1632 N LYS A 96 5.124 15.486 -2.906 1.00 0.00 N ATOM 1633 CA LYS A 96 6.121 16.382 -2.344 1.00 0.00 C ATOM 1634 C LYS A 96 5.498 17.172 -1.191 1.00 0.00 C ATOM 1635 O LYS A 96 6.211 17.683 -0.328 1.00 0.00 O ATOM 1636 CB LYS A 96 6.726 17.264 -3.437 1.00 0.00 C ATOM 1637 CG LYS A 96 5.745 18.357 -3.865 1.00 0.00 C ATOM 1638 CD LYS A 96 6.379 19.744 -3.733 1.00 0.00 C ATOM 1639 CE LYS A 96 6.319 20.503 -5.061 1.00 0.00 C ATOM 1640 NZ LYS A 96 7.214 21.680 -5.026 1.00 0.00 N ATOM 0 H LYS A 96 4.852 15.699 -3.866 1.00 0.00 H new ATOM 0 HA LYS A 96 6.953 15.813 -1.929 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.647 17.719 -3.073 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.992 16.651 -4.298 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.437 18.191 -4.897 1.00 0.00 H new ATOM 0 HG3 LYS A 96 4.846 18.304 -3.252 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.861 20.313 -2.961 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.416 19.645 -3.413 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.609 19.842 -5.878 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.296 20.823 -5.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.161 22.183 -5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.919 22.318 -4.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.192 21.368 -4.860 1.00 0.00 H new ATOM 1654 N LYS A 97 4.176 17.247 -1.213 1.00 0.00 N ATOM 1655 CA LYS A 97 3.449 17.966 -0.180 1.00 0.00 C ATOM 1656 C LYS A 97 3.661 17.269 1.165 1.00 0.00 C ATOM 1657 O LYS A 97 4.174 17.872 2.107 1.00 0.00 O ATOM 1658 CB LYS A 97 1.977 18.119 -0.568 1.00 0.00 C ATOM 1659 CG LYS A 97 1.580 19.595 -0.641 1.00 0.00 C ATOM 1660 CD LYS A 97 0.060 19.751 -0.718 1.00 0.00 C ATOM 1661 CE LYS A 97 -0.365 20.318 -2.074 1.00 0.00 C ATOM 1662 NZ LYS A 97 -1.384 21.377 -1.896 1.00 0.00 N ATOM 0 H LYS A 97 3.589 16.822 -1.930 1.00 0.00 H new ATOM 0 HA LYS A 97 3.835 18.980 -0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 97 1.800 17.643 -1.532 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.350 17.606 0.161 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.959 20.121 0.235 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.041 20.057 -1.514 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.417 18.784 -0.559 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.282 20.411 0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.503 20.724 -2.593 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.766 19.520 -2.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.662 21.751 -2.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.218 20.979 -1.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -0.989 22.145 -1.317 1.00 0.00 H new ATOM 1676 N TYR A 98 3.255 16.009 1.214 1.00 0.00 N ATOM 1677 CA TYR A 98 3.394 15.224 2.428 1.00 0.00 C ATOM 1678 C TYR A 98 4.625 14.318 2.358 1.00 0.00 C ATOM 1679 O TYR A 98 5.490 14.369 3.231 1.00 0.00 O ATOM 1680 CB TYR A 98 2.139 14.353 2.514 1.00 0.00 C ATOM 1681 CG TYR A 98 0.879 15.117 2.925 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.740 15.572 4.220 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.119 15.351 2.000 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.446 16.291 4.608 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.305 16.070 2.387 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.410 16.505 3.672 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.530 17.184 4.037 1.00 0.00 O ATOM 0 H TYR A 98 2.829 15.512 0.432 1.00 0.00 H new ATOM 0 HA TYR A 98 3.511 15.875 3.294 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.967 13.884 1.545 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.315 13.550 3.230 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.521 15.389 4.943 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.010 14.995 0.986 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.567 16.652 5.619 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.093 16.260 1.674 1.00 0.00 H new ATOM 0 HH TYR A 98 -3.130 17.263 3.266 1.00 0.00 H new ATOM 1697 N GLY A 99 4.665 13.508 1.309 1.00 0.00 N ATOM 1698 CA GLY A 99 5.776 12.592 1.113 1.00 0.00 C ATOM 1699 C GLY A 99 5.274 11.173 0.841 1.00 0.00 C ATOM 1700 O GLY A 99 4.522 10.947 -0.107 1.00 0.00 O ATOM 0 H GLY A 99 3.946 13.467 0.587 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.389 12.931 0.278 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.413 12.593 1.997 1.00 0.00 H new ATOM 1704 N VAL A 100 5.709 10.252 1.688 1.00 0.00 N ATOM 1705 CA VAL A 100 5.313 8.861 1.551 1.00 0.00 C ATOM 1706 C VAL A 100 5.053 8.270 2.938 1.00 0.00 C ATOM 1707 O VAL A 100 5.736 8.613 3.901 1.00 0.00 O ATOM 1708 CB VAL A 100 6.375 8.091 0.763 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.810 6.774 0.225 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.945 8.946 -0.370 1.00 0.00 C ATOM 0 H VAL A 100 6.333 10.442 2.473 1.00 0.00 H new ATOM 0 HA VAL A 100 4.385 8.782 0.985 1.00 0.00 H new ATOM 0 HB VAL A 100 7.191 7.853 1.445 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.585 6.246 -0.331 1.00 0.00 H new ATOM 0 HG12 VAL A 100 5.475 6.155 1.057 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.968 6.982 -0.435 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.697 8.375 -0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 100 6.142 9.230 -1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.402 9.844 0.046 1.00 0.00 H new ATOM 1720 N VAL A 101 4.062 7.392 2.995 1.00 0.00 N ATOM 1721 CA VAL A 101 3.702 6.750 4.248 1.00 0.00 C ATOM 1722 C VAL A 101 3.487 5.255 4.007 1.00 0.00 C ATOM 1723 O VAL A 101 2.486 4.856 3.412 1.00 0.00 O ATOM 1724 CB VAL A 101 2.480 7.440 4.857 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.862 8.784 5.480 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.372 7.612 3.816 1.00 0.00 C ATOM 0 H VAL A 101 3.497 7.110 2.194 1.00 0.00 H new ATOM 0 HA VAL A 101 4.509 6.849 4.974 1.00 0.00 H new ATOM 0 HB VAL A 101 2.096 6.801 5.652 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.975 9.253 5.905 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.600 8.624 6.266 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.284 9.434 4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.515 8.105 4.275 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.740 8.220 2.989 1.00 0.00 H new ATOM 0 HG23 VAL A 101 1.070 6.634 3.441 1.00 0.00 H new ATOM 1736 N ALA A 102 4.441 4.468 4.480 1.00 0.00 N ATOM 1737 CA ALA A 102 4.369 3.025 4.323 1.00 0.00 C ATOM 1738 C ALA A 102 3.358 2.458 5.323 1.00 0.00 C ATOM 1739 O ALA A 102 3.688 2.238 6.487 1.00 0.00 O ATOM 1740 CB ALA A 102 5.763 2.421 4.498 1.00 0.00 C ATOM 0 H ALA A 102 5.269 4.802 4.973 1.00 0.00 H new ATOM 0 HA ALA A 102 4.025 2.765 3.322 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.708 1.339 4.380 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.436 2.834 3.746 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.140 2.659 5.493 1.00 0.00 H new ATOM 1746 N ILE A 103 2.148 2.237 4.831 1.00 0.00 N ATOM 1747 CA ILE A 103 1.087 1.700 5.666 1.00 0.00 C ATOM 1748 C ILE A 103 1.127 0.172 5.614 1.00 0.00 C ATOM 1749 O ILE A 103 1.058 -0.418 4.537 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.264 2.294 5.264 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.391 3.742 5.743 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -1.417 1.422 5.765 1.00 0.00 C ATOM 1753 CD1 ILE A 103 0.083 4.719 4.666 1.00 0.00 C ATOM 0 H ILE A 103 1.879 2.420 3.864 1.00 0.00 H new ATOM 0 HA ILE A 103 1.238 1.988 6.706 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.320 2.309 4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -1.429 3.954 6.000 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.197 3.882 6.650 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -2.366 1.867 5.466 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.332 0.424 5.335 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -1.375 1.353 6.852 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.018 5.741 5.032 1.00 0.00 H new ATOM 0 HD12 ILE A 103 1.128 4.520 4.429 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -0.523 4.593 3.769 1.00 0.00 H new ATOM 1765 N GLU A 104 1.239 -0.426 6.791 1.00 0.00 N ATOM 1766 CA GLU A 104 1.290 -1.875 6.893 1.00 0.00 C ATOM 1767 C GLU A 104 -0.110 -2.468 6.718 1.00 0.00 C ATOM 1768 O GLU A 104 -0.945 -2.371 7.616 1.00 0.00 O ATOM 1769 CB GLU A 104 1.908 -2.310 8.223 1.00 0.00 C ATOM 1770 CG GLU A 104 2.164 -3.818 8.241 1.00 0.00 C ATOM 1771 CD GLU A 104 3.431 -4.150 9.033 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.475 -3.540 8.715 1.00 0.00 O ATOM 1773 OE2 GLU A 104 3.327 -5.006 9.938 1.00 0.00 O ATOM 0 H GLU A 104 1.296 0.066 7.682 1.00 0.00 H new ATOM 0 HA GLU A 104 1.927 -2.254 6.094 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.845 -1.777 8.385 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.242 -2.041 9.043 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.310 -4.330 8.683 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.262 -4.186 7.220 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.323 -3.069 5.556 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.607 -3.678 5.253 1.00 0.00 C ATOM 1782 C ILE A 105 -1.494 -5.196 5.400 1.00 0.00 C ATOM 1783 O ILE A 105 -0.533 -5.800 4.925 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.101 -3.228 3.877 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -1.137 -3.674 2.775 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.345 -1.718 3.848 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -1.266 -5.175 2.508 1.00 0.00 C ATOM 0 H ILE A 105 0.372 -3.147 4.814 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.364 -3.345 5.963 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.058 -3.712 3.683 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.344 -3.119 1.860 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.113 -3.439 3.066 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.695 -1.425 2.858 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.098 -1.457 4.592 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.416 -1.195 4.073 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.570 -5.466 1.721 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.035 -5.728 3.419 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.285 -5.402 2.194 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.489 -5.771 6.059 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.513 -7.208 6.274 1.00 0.00 C ATOM 1801 C GLU A 106 -3.921 -7.757 6.032 1.00 0.00 C ATOM 1802 O GLU A 106 -4.840 -7.481 6.802 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.022 -7.560 7.680 1.00 0.00 C ATOM 1804 CG GLU A 106 -2.457 -8.972 8.075 1.00 0.00 C ATOM 1805 CD GLU A 106 -1.311 -9.731 8.748 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -0.153 -9.476 8.354 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -1.620 -10.548 9.642 1.00 0.00 O ATOM 0 H GLU A 106 -3.285 -5.268 6.451 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.834 -7.674 5.560 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -0.935 -7.486 7.719 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -2.416 -6.840 8.397 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.309 -8.918 8.752 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -2.788 -9.515 7.190 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.049 -8.544 4.931 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.328 -9.135 4.577 1.00 0.00 C ATOM 1816 C PRO A 107 -5.664 -10.309 5.499 1.00 0.00 C ATOM 1817 O PRO A 107 -4.957 -11.316 5.509 1.00 0.00 O ATOM 1818 CB PRO A 107 -5.184 -9.545 3.121 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.689 -9.595 2.848 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.982 -8.892 3.996 1.00 0.00 C ATOM 0 HA PRO A 107 -6.160 -8.441 4.700 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.647 -10.515 2.941 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.677 -8.830 2.463 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.350 -10.628 2.766 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.457 -9.107 1.901 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.242 -9.542 4.463 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.453 -8.004 3.651 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.742 -10.142 6.250 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.179 -11.175 7.172 1.00 0.00 C ATOM 1830 C LEU A 108 -8.125 -12.134 6.446 1.00 0.00 C ATOM 1831 O LEU A 108 -9.322 -12.164 6.730 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.785 -10.550 8.431 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.719 -9.359 8.205 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.948 -9.447 9.111 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.971 -8.035 8.379 1.00 0.00 C ATOM 0 H LEU A 108 -7.326 -9.306 6.239 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.328 -11.764 7.514 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.337 -11.322 8.967 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.971 -10.230 9.082 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.075 -9.394 7.175 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -10.595 -8.589 8.931 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.494 -10.365 8.895 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.632 -9.450 10.154 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.657 -7.205 8.213 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.567 -7.975 9.390 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.155 -7.981 7.658 1.00 0.00 H new