USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1075 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 33 MET CE :methyl -99:sc= -1.16 (180deg=0) USER MOD Set 1.2: A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.3: A 73 HIS : no HD1:sc= -0.0419 X(o=-1.2,f=-1.5) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -1.96 K(o=-2,f=-4!) USER MOD Single : A 28 ASN : amide:sc= -0.547 X(o=-0.55,f=-0.46) USER MOD Single : A 38 THR OG1 : rot -120:sc= -0.204 USER MOD Single : A 40 THR OG1 : rot 170:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 38:sc= 0.57 USER MOD Single : A 55 SER OG : rot -100:sc= -0.301 USER MOD Single : A 60 SER OG : rot -25:sc= 0.0686 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -33:sc= -0.0449 USER MOD Single : A 81 SER OG : rot 25:sc= -1.83! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -136:sc= -0.228 (180deg=-0.976) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS :FLIP no HE2:sc= -4.09! F(o=-4.8,f=-4.1!) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.851 USER MOD Single : A 99 THR OG1 : rot -150:sc= -0.626 USER MOD Single : A 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc= -0.634 K(o=-0.63,f=-1.7) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 HIS : no HE2:sc= -1.95! C(o=-2!,f=-3.9!) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl -148:sc= -1.81 (180deg=-4.99!) USER MOD Single : A 133 LYS NZ :NH3+ -126:sc= 0.439 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 42 N GLY A 3 -4.437 3.517 13.252 1.00 0.00 N ATOM 43 CA GLY A 3 -5.414 4.411 12.659 1.00 0.00 C ATOM 44 C GLY A 3 -6.177 3.775 11.511 1.00 0.00 C ATOM 45 O GLY A 3 -6.930 4.453 10.815 1.00 0.00 O ATOM 0 HA2 GLY A 3 -6.120 4.729 13.426 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -4.908 5.307 12.300 1.00 0.00 H new ATOM 49 N PHE A 4 -5.985 2.471 11.310 1.00 0.00 N ATOM 50 CA PHE A 4 -6.662 1.758 10.234 1.00 0.00 C ATOM 51 C PHE A 4 -7.889 1.008 10.762 1.00 0.00 C ATOM 52 O PHE A 4 -7.853 0.429 11.847 1.00 0.00 O ATOM 53 CB PHE A 4 -5.675 0.803 9.544 1.00 0.00 C ATOM 54 CG PHE A 4 -6.007 -0.660 9.680 1.00 0.00 C ATOM 55 CD1 PHE A 4 -5.960 -1.284 10.916 1.00 0.00 C ATOM 56 CD2 PHE A 4 -6.362 -1.409 8.569 1.00 0.00 C ATOM 57 CE1 PHE A 4 -6.262 -2.626 11.043 1.00 0.00 C ATOM 58 CE2 PHE A 4 -6.665 -2.751 8.689 1.00 0.00 C ATOM 59 CZ PHE A 4 -6.616 -3.361 9.928 1.00 0.00 C ATOM 0 H PHE A 4 -5.367 1.891 11.878 1.00 0.00 H new ATOM 0 HA PHE A 4 -7.017 2.480 9.498 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -5.631 1.053 8.484 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -4.680 0.974 9.954 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -5.684 -0.714 11.791 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -6.402 -0.938 7.598 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -6.221 -3.100 12.013 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -6.940 -3.323 7.815 1.00 0.00 H new ATOM 0 HZ PHE A 4 -6.854 -4.410 10.025 1.00 0.00 H new ATOM 69 N GLU A 5 -8.972 1.031 9.988 1.00 0.00 N ATOM 70 CA GLU A 5 -10.209 0.360 10.377 1.00 0.00 C ATOM 71 C GLU A 5 -10.954 -0.172 9.155 1.00 0.00 C ATOM 72 O GLU A 5 -10.809 0.352 8.053 1.00 0.00 O ATOM 73 CB GLU A 5 -11.111 1.318 11.157 1.00 0.00 C ATOM 74 CG GLU A 5 -11.559 2.525 10.349 1.00 0.00 C ATOM 75 CD GLU A 5 -13.054 2.763 10.433 1.00 0.00 C ATOM 76 OE1 GLU A 5 -13.512 3.303 11.461 1.00 0.00 O ATOM 77 OE2 GLU A 5 -13.767 2.409 9.469 1.00 0.00 O ATOM 0 H GLU A 5 -9.017 1.508 9.087 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.945 -0.484 11.014 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -11.991 0.775 11.502 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -10.580 1.662 12.045 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -11.034 3.411 10.705 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -11.276 2.384 9.306 1.00 0.00 H new ATOM 84 N PHE A 6 -11.750 -1.216 9.356 1.00 0.00 N ATOM 85 CA PHE A 6 -12.515 -1.817 8.267 1.00 0.00 C ATOM 86 C PHE A 6 -14.016 -1.644 8.481 1.00 0.00 C ATOM 87 O PHE A 6 -14.495 -1.647 9.615 1.00 0.00 O ATOM 88 CB PHE A 6 -12.178 -3.304 8.144 1.00 0.00 C ATOM 89 CG PHE A 6 -12.316 -4.058 9.437 1.00 0.00 C ATOM 90 CD1 PHE A 6 -13.547 -4.555 9.837 1.00 0.00 C ATOM 91 CD2 PHE A 6 -11.216 -4.270 10.251 1.00 0.00 C ATOM 92 CE1 PHE A 6 -13.677 -5.249 11.024 1.00 0.00 C ATOM 93 CE2 PHE A 6 -11.340 -4.963 11.441 1.00 0.00 C ATOM 94 CZ PHE A 6 -12.572 -5.453 11.828 1.00 0.00 C ATOM 0 H PHE A 6 -11.883 -1.665 10.262 1.00 0.00 H new ATOM 0 HA PHE A 6 -12.241 -1.305 7.345 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -12.831 -3.756 7.397 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -11.156 -3.408 7.779 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -14.414 -4.398 9.213 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -10.250 -3.890 9.953 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -14.641 -5.632 11.323 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -10.474 -5.121 12.067 1.00 0.00 H new ATOM 0 HZ PHE A 6 -12.671 -5.994 12.757 1.00 0.00 H new ATOM 104 N PHE A 7 -14.758 -1.507 7.383 1.00 0.00 N ATOM 105 CA PHE A 7 -16.211 -1.349 7.457 1.00 0.00 C ATOM 106 C PHE A 7 -16.912 -2.610 6.951 1.00 0.00 C ATOM 107 O PHE A 7 -16.275 -3.503 6.393 1.00 0.00 O ATOM 108 CB PHE A 7 -16.685 -0.124 6.661 1.00 0.00 C ATOM 109 CG PHE A 7 -15.706 0.375 5.633 1.00 0.00 C ATOM 110 CD1 PHE A 7 -15.607 -0.240 4.396 1.00 0.00 C ATOM 111 CD2 PHE A 7 -14.896 1.466 5.903 1.00 0.00 C ATOM 112 CE1 PHE A 7 -14.716 0.224 3.447 1.00 0.00 C ATOM 113 CE2 PHE A 7 -14.002 1.934 4.958 1.00 0.00 C ATOM 114 CZ PHE A 7 -13.912 1.312 3.728 1.00 0.00 C ATOM 0 H PHE A 7 -14.380 -1.502 6.436 1.00 0.00 H new ATOM 0 HA PHE A 7 -16.473 -1.192 8.503 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -17.621 -0.373 6.161 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -16.902 0.684 7.359 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -16.233 -1.091 4.171 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -14.964 1.957 6.863 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -14.648 -0.264 2.486 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -13.375 2.785 5.181 1.00 0.00 H new ATOM 0 HZ PHE A 7 -13.215 1.675 2.988 1.00 0.00 H new ATOM 124 N ASP A 8 -18.224 -2.685 7.170 1.00 0.00 N ATOM 125 CA ASP A 8 -19.003 -3.850 6.754 1.00 0.00 C ATOM 126 C ASP A 8 -19.059 -3.996 5.238 1.00 0.00 C ATOM 127 O ASP A 8 -19.937 -3.441 4.577 1.00 0.00 O ATOM 128 CB ASP A 8 -20.419 -3.778 7.309 1.00 0.00 C ATOM 129 CG ASP A 8 -21.057 -2.416 7.105 1.00 0.00 C ATOM 130 OD1 ASP A 8 -20.602 -1.677 6.208 1.00 0.00 O ATOM 131 OD2 ASP A 8 -22.010 -2.091 7.844 1.00 0.00 O ATOM 0 H ASP A 8 -18.768 -1.956 7.631 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.495 -4.726 7.158 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -21.033 -4.539 6.827 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -20.400 -4.011 8.374 1.00 0.00 H new ATOM 136 N VAL A 9 -18.125 -4.767 4.707 1.00 0.00 N ATOM 137 CA VAL A 9 -18.051 -5.030 3.273 1.00 0.00 C ATOM 138 C VAL A 9 -18.490 -6.459 2.946 1.00 0.00 C ATOM 139 O VAL A 9 -18.338 -7.366 3.764 1.00 0.00 O ATOM 140 CB VAL A 9 -16.639 -4.832 2.701 1.00 0.00 C ATOM 141 CG1 VAL A 9 -15.787 -6.054 3.015 1.00 0.00 C ATOM 142 CG2 VAL A 9 -16.739 -4.556 1.206 1.00 0.00 C ATOM 0 H VAL A 9 -17.397 -5.229 5.253 1.00 0.00 H new ATOM 0 HA VAL A 9 -18.725 -4.306 2.814 1.00 0.00 H new ATOM 0 HB VAL A 9 -16.152 -3.973 3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -14.785 -5.913 2.609 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -15.725 -6.187 4.095 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -16.239 -6.938 2.566 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -15.740 -4.415 0.794 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -17.219 -5.400 0.711 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -17.330 -3.655 1.041 1.00 0.00 H new ATOM 152 N THR A 10 -19.006 -6.657 1.738 1.00 0.00 N ATOM 153 CA THR A 10 -19.434 -7.981 1.296 1.00 0.00 C ATOM 154 C THR A 10 -18.995 -8.233 -0.149 1.00 0.00 C ATOM 155 O THR A 10 -19.646 -7.761 -1.080 1.00 0.00 O ATOM 156 CB THR A 10 -20.952 -8.099 1.409 1.00 0.00 C ATOM 157 OG1 THR A 10 -21.366 -7.979 2.758 1.00 0.00 O ATOM 158 CG2 THR A 10 -21.499 -9.406 0.875 1.00 0.00 C ATOM 0 H THR A 10 -19.138 -5.919 1.047 1.00 0.00 H new ATOM 0 HA THR A 10 -18.967 -8.730 1.935 1.00 0.00 H new ATOM 0 HB THR A 10 -21.347 -7.286 0.799 1.00 0.00 H new ATOM 0 HG1 THR A 10 -22.342 -8.056 2.809 1.00 0.00 H new ATOM 0 HG21 THR A 10 -22.583 -9.420 0.988 1.00 0.00 H new ATOM 0 HG22 THR A 10 -21.243 -9.504 -0.180 1.00 0.00 H new ATOM 0 HG23 THR A 10 -21.066 -10.237 1.432 1.00 0.00 H new ATOM 166 N ALA A 11 -17.876 -8.963 -0.324 1.00 0.00 N ATOM 167 CA ALA A 11 -17.317 -9.275 -1.644 1.00 0.00 C ATOM 168 C ALA A 11 -15.961 -8.611 -1.778 1.00 0.00 C ATOM 169 O ALA A 11 -15.010 -9.211 -2.257 1.00 0.00 O ATOM 170 CB ALA A 11 -18.233 -8.846 -2.787 1.00 0.00 C ATOM 0 H ALA A 11 -17.337 -9.351 0.450 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.216 -10.358 -1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -17.770 -9.101 -3.740 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -19.190 -9.361 -2.699 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.395 -7.769 -2.739 1.00 0.00 H new ATOM 176 N ASP A 12 -15.888 -7.373 -1.314 1.00 0.00 N ATOM 177 CA ASP A 12 -14.654 -6.599 -1.327 1.00 0.00 C ATOM 178 C ASP A 12 -14.364 -6.132 0.081 1.00 0.00 C ATOM 179 O ASP A 12 -15.196 -6.300 0.938 1.00 0.00 O ATOM 180 CB ASP A 12 -14.722 -5.396 -2.266 1.00 0.00 C ATOM 181 CG ASP A 12 -16.116 -5.138 -2.813 1.00 0.00 C ATOM 182 OD1 ASP A 12 -16.511 -5.823 -3.780 1.00 0.00 O ATOM 183 OD2 ASP A 12 -16.811 -4.252 -2.273 1.00 0.00 O ATOM 0 H ASP A 12 -16.684 -6.875 -0.917 1.00 0.00 H new ATOM 0 HA ASP A 12 -13.857 -7.243 -1.698 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -14.378 -4.509 -1.734 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -14.036 -5.554 -3.098 1.00 0.00 H new ATOM 188 N ALA A 13 -13.197 -5.556 0.319 1.00 0.00 N ATOM 189 CA ALA A 13 -12.854 -5.058 1.638 1.00 0.00 C ATOM 190 C ALA A 13 -11.977 -3.820 1.548 1.00 0.00 C ATOM 191 O ALA A 13 -10.880 -3.857 0.991 1.00 0.00 O ATOM 192 CB ALA A 13 -12.170 -6.140 2.450 1.00 0.00 C ATOM 0 H ALA A 13 -12.472 -5.422 -0.386 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.778 -4.775 2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -11.919 -5.751 3.437 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -12.840 -6.993 2.556 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.259 -6.455 1.942 1.00 0.00 H new ATOM 198 N GLY A 14 -12.470 -2.728 2.122 1.00 0.00 N ATOM 199 CA GLY A 14 -11.742 -1.475 2.125 1.00 0.00 C ATOM 200 C GLY A 14 -11.519 -0.980 3.534 1.00 0.00 C ATOM 201 O GLY A 14 -12.457 -0.919 4.328 1.00 0.00 O ATOM 0 H GLY A 14 -13.375 -2.691 2.592 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.782 -1.607 1.626 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.296 -0.728 1.557 1.00 0.00 H new ATOM 205 N PHE A 15 -10.287 -0.633 3.861 1.00 0.00 N ATOM 206 CA PHE A 15 -9.979 -0.150 5.197 1.00 0.00 C ATOM 207 C PHE A 15 -9.696 1.339 5.180 1.00 0.00 C ATOM 208 O PHE A 15 -9.231 1.885 4.180 1.00 0.00 O ATOM 209 CB PHE A 15 -8.782 -0.898 5.783 1.00 0.00 C ATOM 210 CG PHE A 15 -8.791 -2.373 5.498 1.00 0.00 C ATOM 211 CD1 PHE A 15 -8.531 -2.849 4.223 1.00 0.00 C ATOM 212 CD2 PHE A 15 -9.064 -3.282 6.506 1.00 0.00 C ATOM 213 CE1 PHE A 15 -8.543 -4.205 3.959 1.00 0.00 C ATOM 214 CE2 PHE A 15 -9.076 -4.639 6.249 1.00 0.00 C ATOM 215 CZ PHE A 15 -8.816 -5.101 4.975 1.00 0.00 C ATOM 0 H PHE A 15 -9.489 -0.676 3.227 1.00 0.00 H new ATOM 0 HA PHE A 15 -10.850 -0.335 5.825 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.864 -0.466 5.384 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -8.763 -0.746 6.862 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -8.316 -2.152 3.426 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -9.270 -2.926 7.505 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -8.340 -4.564 2.961 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -9.289 -5.338 7.044 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.826 -6.162 4.772 1.00 0.00 H new ATOM 225 N TRP A 16 -9.963 1.988 6.301 1.00 0.00 N ATOM 226 CA TRP A 16 -9.723 3.414 6.427 1.00 0.00 C ATOM 227 C TRP A 16 -8.581 3.649 7.398 1.00 0.00 C ATOM 228 O TRP A 16 -8.620 3.188 8.537 1.00 0.00 O ATOM 229 CB TRP A 16 -10.986 4.125 6.927 1.00 0.00 C ATOM 230 CG TRP A 16 -11.279 5.418 6.227 1.00 0.00 C ATOM 231 CD1 TRP A 16 -10.816 5.820 5.006 1.00 0.00 C ATOM 232 CD2 TRP A 16 -12.107 6.482 6.711 1.00 0.00 C ATOM 233 NE1 TRP A 16 -11.303 7.069 4.704 1.00 0.00 N ATOM 234 CE2 TRP A 16 -12.099 7.496 5.735 1.00 0.00 C ATOM 235 CE3 TRP A 16 -12.855 6.674 7.875 1.00 0.00 C ATOM 236 CZ2 TRP A 16 -12.810 8.683 5.889 1.00 0.00 C ATOM 237 CZ3 TRP A 16 -13.560 7.854 8.027 1.00 0.00 C ATOM 238 CH2 TRP A 16 -13.534 8.844 7.038 1.00 0.00 C ATOM 0 H TRP A 16 -10.347 1.548 7.138 1.00 0.00 H new ATOM 0 HA TRP A 16 -9.460 3.818 5.450 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -11.838 3.457 6.805 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -10.883 4.318 7.995 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -10.162 5.241 4.371 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -11.105 7.593 3.852 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -12.882 5.915 8.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -12.791 9.449 5.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -14.140 8.014 8.924 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -14.097 9.754 7.185 1.00 0.00 H new ATOM 249 N ALA A 17 -7.567 4.369 6.942 1.00 0.00 N ATOM 250 CA ALA A 17 -6.411 4.666 7.770 1.00 0.00 C ATOM 251 C ALA A 17 -6.140 6.141 7.785 1.00 0.00 C ATOM 252 O ALA A 17 -6.571 6.873 6.900 1.00 0.00 O ATOM 253 CB ALA A 17 -5.191 3.892 7.293 1.00 0.00 C ATOM 0 H ALA A 17 -7.523 4.759 6.000 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.629 4.350 8.790 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.338 4.130 7.928 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.395 2.823 7.346 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.965 4.168 6.263 1.00 0.00 H new ATOM 259 N TYR A 18 -5.452 6.577 8.819 1.00 0.00 N ATOM 260 CA TYR A 18 -5.157 7.980 8.974 1.00 0.00 C ATOM 261 C TYR A 18 -3.672 8.271 8.847 1.00 0.00 C ATOM 262 O TYR A 18 -2.831 7.386 9.000 1.00 0.00 O ATOM 263 CB TYR A 18 -5.677 8.480 10.312 1.00 0.00 C ATOM 264 CG TYR A 18 -6.854 7.707 10.854 1.00 0.00 C ATOM 265 CD1 TYR A 18 -8.049 7.649 10.149 1.00 0.00 C ATOM 266 CD2 TYR A 18 -6.774 7.045 12.068 1.00 0.00 C ATOM 267 CE1 TYR A 18 -9.132 6.949 10.641 1.00 0.00 C ATOM 268 CE2 TYR A 18 -7.851 6.343 12.569 1.00 0.00 C ATOM 269 CZ TYR A 18 -9.030 6.296 11.851 1.00 0.00 C ATOM 270 OH TYR A 18 -10.106 5.599 12.347 1.00 0.00 O ATOM 0 H TYR A 18 -5.089 5.979 9.561 1.00 0.00 H new ATOM 0 HA TYR A 18 -5.662 8.510 8.167 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -4.867 8.441 11.040 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -5.963 9.527 10.208 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -8.132 8.160 9.201 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -5.853 7.079 12.632 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -10.055 6.913 10.081 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -7.773 5.833 13.518 1.00 0.00 H new ATOM 0 HH TYR A 18 -9.867 5.197 13.208 1.00 0.00 H new ATOM 280 N GLY A 19 -3.366 9.528 8.553 1.00 0.00 N ATOM 281 CA GLY A 19 -1.994 9.943 8.390 1.00 0.00 C ATOM 282 C GLY A 19 -1.492 10.809 9.492 1.00 0.00 C ATOM 283 O GLY A 19 -2.136 11.006 10.522 1.00 0.00 O ATOM 0 H GLY A 19 -4.053 10.271 8.424 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.362 9.057 8.320 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -1.896 10.479 7.446 1.00 0.00 H new ATOM 287 N HIS A 20 -0.315 11.308 9.242 1.00 0.00 N ATOM 288 CA HIS A 20 0.381 12.160 10.150 1.00 0.00 C ATOM 289 C HIS A 20 1.068 13.283 9.379 1.00 0.00 C ATOM 290 O HIS A 20 1.748 14.127 9.960 1.00 0.00 O ATOM 291 CB HIS A 20 1.365 11.285 10.909 1.00 0.00 C ATOM 292 CG HIS A 20 2.805 11.689 10.808 1.00 0.00 C ATOM 293 ND1 HIS A 20 3.699 11.032 9.990 1.00 0.00 N ATOM 294 CD2 HIS A 20 3.510 12.672 11.418 1.00 0.00 C ATOM 295 CE1 HIS A 20 4.886 11.587 10.096 1.00 0.00 C ATOM 296 NE2 HIS A 20 4.803 12.588 10.956 1.00 0.00 N ATOM 0 H HIS A 20 0.196 11.126 8.378 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.292 12.642 10.859 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.081 11.279 11.961 1.00 0.00 H new ATOM 0 HB3 HIS A 20 1.267 10.262 10.547 1.00 0.00 H new ATOM 0 HD2 HIS A 20 3.129 13.387 12.132 1.00 0.00 H new ATOM 0 HE1 HIS A 20 5.777 11.278 9.570 1.00 0.00 H new ATOM 0 HE2 HIS A 20 5.572 13.198 11.232 1.00 0.00 H new ATOM 305 N ASP A 21 0.866 13.274 8.056 1.00 0.00 N ATOM 306 CA ASP A 21 1.444 14.277 7.157 1.00 0.00 C ATOM 307 C ASP A 21 1.562 13.710 5.745 1.00 0.00 C ATOM 308 O ASP A 21 2.590 13.866 5.087 1.00 0.00 O ATOM 309 CB ASP A 21 2.825 14.736 7.647 1.00 0.00 C ATOM 310 CG ASP A 21 2.769 16.070 8.368 1.00 0.00 C ATOM 311 OD1 ASP A 21 2.217 17.032 7.793 1.00 0.00 O ATOM 312 OD2 ASP A 21 3.277 16.153 9.505 1.00 0.00 O ATOM 0 H ASP A 21 0.298 12.572 7.580 1.00 0.00 H new ATOM 0 HA ASP A 21 0.779 15.141 7.149 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.239 13.982 8.316 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.502 14.814 6.796 1.00 0.00 H new ATOM 317 N LEU A 22 0.504 13.038 5.296 1.00 0.00 N ATOM 318 CA LEU A 22 0.475 12.423 3.970 1.00 0.00 C ATOM 319 C LEU A 22 1.402 11.214 3.923 1.00 0.00 C ATOM 320 O LEU A 22 0.975 10.099 3.628 1.00 0.00 O ATOM 321 CB LEU A 22 0.881 13.429 2.885 1.00 0.00 C ATOM 322 CG LEU A 22 -0.033 14.649 2.722 1.00 0.00 C ATOM 323 CD1 LEU A 22 -1.456 14.222 2.396 1.00 0.00 C ATOM 324 CD2 LEU A 22 -0.003 15.513 3.975 1.00 0.00 C ATOM 0 H LEU A 22 -0.351 12.905 5.836 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.547 12.099 3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.889 13.782 3.104 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.927 12.905 1.931 1.00 0.00 H new ATOM 0 HG LEU A 22 0.340 15.243 1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.085 15.106 2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.461 13.654 1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.843 13.600 3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.658 16.374 3.839 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.345 14.928 4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 22 1.015 15.857 4.155 1.00 0.00 H new ATOM 336 N GLU A 23 2.672 11.446 4.220 1.00 0.00 N ATOM 337 CA GLU A 23 3.673 10.387 4.217 1.00 0.00 C ATOM 338 C GLU A 23 3.228 9.196 5.063 1.00 0.00 C ATOM 339 O GLU A 23 3.584 8.054 4.776 1.00 0.00 O ATOM 340 CB GLU A 23 5.007 10.926 4.736 1.00 0.00 C ATOM 341 CG GLU A 23 6.215 10.201 4.180 1.00 0.00 C ATOM 342 CD GLU A 23 7.511 10.636 4.838 1.00 0.00 C ATOM 343 OE1 GLU A 23 7.878 11.822 4.697 1.00 0.00 O ATOM 344 OE2 GLU A 23 8.156 9.792 5.493 1.00 0.00 O ATOM 0 H GLU A 23 3.037 12.366 4.468 1.00 0.00 H new ATOM 0 HA GLU A 23 3.795 10.044 3.190 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.083 11.984 4.486 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.020 10.853 5.824 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.085 9.128 4.317 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.279 10.380 3.107 1.00 0.00 H new ATOM 351 N GLU A 24 2.464 9.469 6.116 1.00 0.00 N ATOM 352 CA GLU A 24 1.995 8.412 7.005 1.00 0.00 C ATOM 353 C GLU A 24 0.889 7.569 6.366 1.00 0.00 C ATOM 354 O GLU A 24 0.928 6.340 6.425 1.00 0.00 O ATOM 355 CB GLU A 24 1.478 9.001 8.314 1.00 0.00 C ATOM 356 CG GLU A 24 1.586 8.044 9.491 1.00 0.00 C ATOM 357 CD GLU A 24 2.997 7.945 10.037 1.00 0.00 C ATOM 358 OE1 GLU A 24 3.893 7.495 9.291 1.00 0.00 O ATOM 359 OE2 GLU A 24 3.208 8.317 11.210 1.00 0.00 O ATOM 0 H GLU A 24 2.158 10.407 6.374 1.00 0.00 H new ATOM 0 HA GLU A 24 2.850 7.765 7.200 1.00 0.00 H new ATOM 0 HB2 GLU A 24 2.037 9.909 8.541 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.435 9.292 8.186 1.00 0.00 H new ATOM 0 HG2 GLU A 24 0.916 8.374 10.285 1.00 0.00 H new ATOM 0 HG3 GLU A 24 1.250 7.054 9.181 1.00 0.00 H new ATOM 366 N VAL A 25 -0.111 8.229 5.778 1.00 0.00 N ATOM 367 CA VAL A 25 -1.232 7.513 5.161 1.00 0.00 C ATOM 368 C VAL A 25 -0.767 6.577 4.051 1.00 0.00 C ATOM 369 O VAL A 25 -1.125 5.399 4.039 1.00 0.00 O ATOM 370 CB VAL A 25 -2.324 8.457 4.602 1.00 0.00 C ATOM 371 CG1 VAL A 25 -3.355 8.770 5.673 1.00 0.00 C ATOM 372 CG2 VAL A 25 -1.729 9.740 4.042 1.00 0.00 C ATOM 0 H VAL A 25 -0.169 9.245 5.716 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.672 6.928 5.969 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.817 7.939 3.779 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.115 9.435 5.263 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.824 7.845 6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.866 9.255 6.518 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.528 10.375 3.660 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.193 10.267 4.831 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.039 9.498 3.233 1.00 0.00 H new ATOM 382 N PHE A 26 0.032 7.091 3.119 1.00 0.00 N ATOM 383 CA PHE A 26 0.534 6.271 2.020 1.00 0.00 C ATOM 384 C PHE A 26 1.132 4.976 2.562 1.00 0.00 C ATOM 385 O PHE A 26 0.968 3.906 1.980 1.00 0.00 O ATOM 386 CB PHE A 26 1.586 7.033 1.211 1.00 0.00 C ATOM 387 CG PHE A 26 1.159 8.416 0.810 1.00 0.00 C ATOM 388 CD1 PHE A 26 -0.007 8.617 0.088 1.00 0.00 C ATOM 389 CD2 PHE A 26 1.926 9.515 1.154 1.00 0.00 C ATOM 390 CE1 PHE A 26 -0.396 9.891 -0.282 1.00 0.00 C ATOM 391 CE2 PHE A 26 1.542 10.788 0.788 1.00 0.00 C ATOM 392 CZ PHE A 26 0.380 10.978 0.069 1.00 0.00 C ATOM 0 H PHE A 26 0.343 8.062 3.102 1.00 0.00 H new ATOM 0 HA PHE A 26 -0.301 6.032 1.362 1.00 0.00 H new ATOM 0 HB2 PHE A 26 2.502 7.102 1.798 1.00 0.00 H new ATOM 0 HB3 PHE A 26 1.824 6.462 0.314 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.618 7.770 -0.188 1.00 0.00 H new ATOM 0 HD2 PHE A 26 2.837 9.374 1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -1.306 10.036 -0.845 1.00 0.00 H new ATOM 0 HE2 PHE A 26 2.151 11.636 1.064 1.00 0.00 H new ATOM 0 HZ PHE A 26 0.078 11.974 -0.219 1.00 0.00 H new ATOM 402 N GLU A 27 1.811 5.091 3.697 1.00 0.00 N ATOM 403 CA GLU A 27 2.426 3.943 4.349 1.00 0.00 C ATOM 404 C GLU A 27 1.347 2.982 4.831 1.00 0.00 C ATOM 405 O GLU A 27 1.472 1.765 4.694 1.00 0.00 O ATOM 406 CB GLU A 27 3.279 4.417 5.528 1.00 0.00 C ATOM 407 CG GLU A 27 4.540 3.598 5.739 1.00 0.00 C ATOM 408 CD GLU A 27 4.415 2.626 6.895 1.00 0.00 C ATOM 409 OE1 GLU A 27 3.461 1.821 6.894 1.00 0.00 O ATOM 410 OE2 GLU A 27 5.272 2.670 7.803 1.00 0.00 O ATOM 0 H GLU A 27 1.950 5.975 4.187 1.00 0.00 H new ATOM 0 HA GLU A 27 3.065 3.422 3.636 1.00 0.00 H new ATOM 0 HB2 GLU A 27 3.556 5.459 5.368 1.00 0.00 H new ATOM 0 HB3 GLU A 27 2.678 4.382 6.437 1.00 0.00 H new ATOM 0 HG2 GLU A 27 4.767 3.046 4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.379 4.269 5.922 1.00 0.00 H new ATOM 417 N ASN A 28 0.279 3.547 5.389 1.00 0.00 N ATOM 418 CA ASN A 28 -0.841 2.756 5.886 1.00 0.00 C ATOM 419 C ASN A 28 -1.624 2.137 4.731 1.00 0.00 C ATOM 420 O ASN A 28 -2.247 1.087 4.884 1.00 0.00 O ATOM 421 CB ASN A 28 -1.765 3.628 6.742 1.00 0.00 C ATOM 422 CG ASN A 28 -1.901 3.108 8.160 1.00 0.00 C ATOM 423 OD1 ASN A 28 -1.681 3.840 9.125 1.00 0.00 O ATOM 424 ND2 ASN A 28 -2.264 1.838 8.293 1.00 0.00 N ATOM 0 H ASN A 28 0.167 4.554 5.508 1.00 0.00 H new ATOM 0 HA ASN A 28 -0.443 1.949 6.502 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.378 4.647 6.767 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.750 3.673 6.278 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -2.371 1.433 9.223 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.436 1.267 7.465 1.00 0.00 H new ATOM 431 N ALA A 29 -1.589 2.795 3.574 1.00 0.00 N ATOM 432 CA ALA A 29 -2.296 2.309 2.393 1.00 0.00 C ATOM 433 C ALA A 29 -1.921 0.864 2.090 1.00 0.00 C ATOM 434 O ALA A 29 -2.790 0.013 1.899 1.00 0.00 O ATOM 435 CB ALA A 29 -1.995 3.197 1.194 1.00 0.00 C ATOM 0 H ALA A 29 -1.078 3.666 3.430 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.366 2.346 2.598 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -2.529 2.822 0.321 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.317 4.217 1.406 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -0.923 3.189 0.995 1.00 0.00 H new ATOM 441 N ALA A 30 -0.622 0.590 2.062 1.00 0.00 N ATOM 442 CA ALA A 30 -0.134 -0.755 1.798 1.00 0.00 C ATOM 443 C ALA A 30 -0.443 -1.678 2.972 1.00 0.00 C ATOM 444 O ALA A 30 -0.590 -2.888 2.803 1.00 0.00 O ATOM 445 CB ALA A 30 1.361 -0.733 1.519 1.00 0.00 C ATOM 0 H ALA A 30 0.111 1.282 2.219 1.00 0.00 H new ATOM 0 HA ALA A 30 -0.645 -1.139 0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.710 -1.747 1.324 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.560 -0.107 0.649 1.00 0.00 H new ATOM 0 HB3 ALA A 30 1.887 -0.329 2.384 1.00 0.00 H new ATOM 451 N LEU A 31 -0.542 -1.094 4.162 1.00 0.00 N ATOM 452 CA LEU A 31 -0.835 -1.857 5.369 1.00 0.00 C ATOM 453 C LEU A 31 -2.230 -2.470 5.303 1.00 0.00 C ATOM 454 O LEU A 31 -2.422 -3.635 5.650 1.00 0.00 O ATOM 455 CB LEU A 31 -0.714 -0.961 6.606 1.00 0.00 C ATOM 456 CG LEU A 31 0.070 -1.571 7.772 1.00 0.00 C ATOM 457 CD1 LEU A 31 1.414 -0.879 7.935 1.00 0.00 C ATOM 458 CD2 LEU A 31 -0.735 -1.482 9.061 1.00 0.00 C ATOM 0 H LEU A 31 -0.423 -0.093 4.316 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.108 -2.666 5.442 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.234 -0.027 6.314 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.716 -0.709 6.954 1.00 0.00 H new ATOM 0 HG LEU A 31 0.251 -2.623 7.550 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.955 -1.327 8.768 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.996 -0.994 7.021 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.256 0.181 8.133 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.162 -1.920 9.879 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.947 -0.437 9.286 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.673 -2.025 8.943 1.00 0.00 H new ATOM 470 N ALA A 32 -3.202 -1.680 4.856 1.00 0.00 N ATOM 471 CA ALA A 32 -4.577 -2.152 4.748 1.00 0.00 C ATOM 472 C ALA A 32 -4.672 -3.345 3.803 1.00 0.00 C ATOM 473 O ALA A 32 -5.368 -4.321 4.087 1.00 0.00 O ATOM 474 CB ALA A 32 -5.486 -1.027 4.274 1.00 0.00 C ATOM 0 H ALA A 32 -3.063 -0.713 4.564 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.904 -2.475 5.736 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -6.510 -1.394 4.198 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.448 -0.203 4.987 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.153 -0.677 3.297 1.00 0.00 H new ATOM 480 N MET A 33 -3.971 -3.260 2.678 1.00 0.00 N ATOM 481 CA MET A 33 -3.976 -4.334 1.691 1.00 0.00 C ATOM 482 C MET A 33 -3.197 -5.543 2.197 1.00 0.00 C ATOM 483 O MET A 33 -3.678 -6.675 2.134 1.00 0.00 O ATOM 484 CB MET A 33 -3.380 -3.844 0.371 1.00 0.00 C ATOM 485 CG MET A 33 -3.482 -4.859 -0.756 1.00 0.00 C ATOM 486 SD MET A 33 -1.943 -5.761 -1.021 1.00 0.00 S ATOM 487 CE MET A 33 -1.599 -5.345 -2.729 1.00 0.00 C ATOM 0 H MET A 33 -3.392 -2.459 2.427 1.00 0.00 H new ATOM 0 HA MET A 33 -5.010 -4.636 1.525 1.00 0.00 H new ATOM 0 HB2 MET A 33 -3.888 -2.928 0.071 1.00 0.00 H new ATOM 0 HB3 MET A 33 -2.331 -3.591 0.527 1.00 0.00 H new ATOM 0 HG2 MET A 33 -4.279 -5.567 -0.531 1.00 0.00 H new ATOM 0 HG3 MET A 33 -3.761 -4.347 -1.677 1.00 0.00 H new ATOM 0 HE1 MET A 33 -1.923 -6.161 -3.375 1.00 0.00 H new ATOM 0 HE2 MET A 33 -2.136 -4.435 -2.997 1.00 0.00 H new ATOM 0 HE3 MET A 33 -0.528 -5.186 -2.856 1.00 0.00 H new ATOM 497 N PHE A 34 -1.991 -5.297 2.700 1.00 0.00 N ATOM 498 CA PHE A 34 -1.146 -6.367 3.218 1.00 0.00 C ATOM 499 C PHE A 34 -1.759 -6.984 4.469 1.00 0.00 C ATOM 500 O PHE A 34 -1.620 -8.181 4.712 1.00 0.00 O ATOM 501 CB PHE A 34 0.255 -5.838 3.527 1.00 0.00 C ATOM 502 CG PHE A 34 1.245 -6.084 2.426 1.00 0.00 C ATOM 503 CD1 PHE A 34 1.060 -5.524 1.172 1.00 0.00 C ATOM 504 CD2 PHE A 34 2.361 -6.876 2.644 1.00 0.00 C ATOM 505 CE1 PHE A 34 1.969 -5.749 0.156 1.00 0.00 C ATOM 506 CE2 PHE A 34 3.273 -7.106 1.631 1.00 0.00 C ATOM 507 CZ PHE A 34 3.077 -6.542 0.385 1.00 0.00 C ATOM 0 H PHE A 34 -1.577 -4.367 2.760 1.00 0.00 H new ATOM 0 HA PHE A 34 -1.071 -7.140 2.453 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.196 -4.767 3.719 1.00 0.00 H new ATOM 0 HB3 PHE A 34 0.618 -6.306 4.442 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.195 -4.904 0.987 1.00 0.00 H new ATOM 0 HD2 PHE A 34 2.520 -7.319 3.616 1.00 0.00 H new ATOM 0 HE1 PHE A 34 1.814 -5.305 -0.816 1.00 0.00 H new ATOM 0 HE2 PHE A 34 4.138 -7.726 1.813 1.00 0.00 H new ATOM 0 HZ PHE A 34 3.788 -6.721 -0.408 1.00 0.00 H new ATOM 517 N GLU A 35 -2.442 -6.162 5.257 1.00 0.00 N ATOM 518 CA GLU A 35 -3.081 -6.632 6.481 1.00 0.00 C ATOM 519 C GLU A 35 -4.054 -7.767 6.177 1.00 0.00 C ATOM 520 O GLU A 35 -4.268 -8.655 7.002 1.00 0.00 O ATOM 521 CB GLU A 35 -3.818 -5.484 7.172 1.00 0.00 C ATOM 522 CG GLU A 35 -2.954 -4.712 8.157 1.00 0.00 C ATOM 523 CD GLU A 35 -2.910 -5.361 9.526 1.00 0.00 C ATOM 524 OE1 GLU A 35 -2.541 -6.552 9.606 1.00 0.00 O ATOM 525 OE2 GLU A 35 -3.243 -4.679 10.517 1.00 0.00 O ATOM 0 H GLU A 35 -2.568 -5.167 5.071 1.00 0.00 H new ATOM 0 HA GLU A 35 -2.305 -7.006 7.149 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -4.194 -4.796 6.414 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -4.685 -5.884 7.698 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.941 -4.635 7.763 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.337 -3.696 8.253 1.00 0.00 H new ATOM 532 N VAL A 36 -4.637 -7.729 4.984 1.00 0.00 N ATOM 533 CA VAL A 36 -5.587 -8.753 4.561 1.00 0.00 C ATOM 534 C VAL A 36 -4.859 -9.953 3.966 1.00 0.00 C ATOM 535 O VAL A 36 -5.301 -11.094 4.104 1.00 0.00 O ATOM 536 CB VAL A 36 -6.591 -8.216 3.516 1.00 0.00 C ATOM 537 CG1 VAL A 36 -7.951 -8.870 3.697 1.00 0.00 C ATOM 538 CG2 VAL A 36 -6.713 -6.701 3.596 1.00 0.00 C ATOM 0 H VAL A 36 -4.469 -6.999 4.291 1.00 0.00 H new ATOM 0 HA VAL A 36 -6.137 -9.054 5.453 1.00 0.00 H new ATOM 0 HB VAL A 36 -6.211 -8.470 2.526 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -8.645 -8.479 2.952 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -7.855 -9.949 3.573 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -8.330 -8.652 4.695 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -7.426 -6.353 2.849 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -7.060 -6.416 4.589 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -5.740 -6.247 3.408 1.00 0.00 H new ATOM 548 N MET A 37 -3.740 -9.685 3.300 1.00 0.00 N ATOM 549 CA MET A 37 -2.947 -10.738 2.677 1.00 0.00 C ATOM 550 C MET A 37 -2.072 -11.449 3.705 1.00 0.00 C ATOM 551 O MET A 37 -1.753 -12.628 3.553 1.00 0.00 O ATOM 552 CB MET A 37 -2.075 -10.155 1.564 1.00 0.00 C ATOM 553 CG MET A 37 -2.871 -9.503 0.446 1.00 0.00 C ATOM 554 SD MET A 37 -3.171 -10.623 -0.935 1.00 0.00 S ATOM 555 CE MET A 37 -2.172 -9.861 -2.211 1.00 0.00 C ATOM 0 H MET A 37 -3.362 -8.746 3.178 1.00 0.00 H new ATOM 0 HA MET A 37 -3.634 -11.468 2.249 1.00 0.00 H new ATOM 0 HB2 MET A 37 -1.397 -9.418 1.994 1.00 0.00 H new ATOM 0 HB3 MET A 37 -1.458 -10.949 1.144 1.00 0.00 H new ATOM 0 HG2 MET A 37 -3.825 -9.154 0.840 1.00 0.00 H new ATOM 0 HG3 MET A 37 -2.334 -8.625 0.087 1.00 0.00 H new ATOM 0 HE1 MET A 37 -2.253 -10.440 -3.131 1.00 0.00 H new ATOM 0 HE2 MET A 37 -2.523 -8.845 -2.390 1.00 0.00 H new ATOM 0 HE3 MET A 37 -1.131 -9.834 -1.890 1.00 0.00 H new ATOM 565 N THR A 38 -1.680 -10.723 4.748 1.00 0.00 N ATOM 566 CA THR A 38 -0.836 -11.283 5.796 1.00 0.00 C ATOM 567 C THR A 38 -0.580 -10.256 6.897 1.00 0.00 C ATOM 568 O THR A 38 -1.266 -9.237 6.981 1.00 0.00 O ATOM 569 CB THR A 38 0.495 -11.753 5.205 1.00 0.00 C ATOM 570 OG1 THR A 38 1.278 -12.409 6.187 1.00 0.00 O ATOM 571 CG2 THR A 38 1.327 -10.624 4.634 1.00 0.00 C ATOM 0 H THR A 38 -1.934 -9.745 4.889 1.00 0.00 H new ATOM 0 HA THR A 38 -1.357 -12.135 6.233 1.00 0.00 H new ATOM 0 HB THR A 38 0.227 -12.433 4.396 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.127 -11.933 6.299 1.00 0.00 H new ATOM 0 HG21 THR A 38 2.257 -11.025 4.231 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.771 -10.129 3.838 1.00 0.00 H new ATOM 0 HG23 THR A 38 1.553 -9.904 5.421 1.00 0.00 H new ATOM 579 N ASP A 39 0.413 -10.529 7.739 1.00 0.00 N ATOM 580 CA ASP A 39 0.764 -9.630 8.831 1.00 0.00 C ATOM 581 C ASP A 39 2.224 -9.199 8.733 1.00 0.00 C ATOM 582 O ASP A 39 3.130 -9.968 9.052 1.00 0.00 O ATOM 583 CB ASP A 39 0.510 -10.308 10.179 1.00 0.00 C ATOM 584 CG ASP A 39 0.108 -9.321 11.257 1.00 0.00 C ATOM 585 OD1 ASP A 39 -0.946 -8.669 11.102 1.00 0.00 O ATOM 586 OD2 ASP A 39 0.846 -9.201 12.258 1.00 0.00 O ATOM 0 H ASP A 39 0.990 -11.369 7.684 1.00 0.00 H new ATOM 0 HA ASP A 39 0.136 -8.743 8.754 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.275 -11.056 10.064 1.00 0.00 H new ATOM 0 HB3 ASP A 39 1.410 -10.837 10.492 1.00 0.00 H new ATOM 591 N THR A 40 2.444 -7.967 8.287 1.00 0.00 N ATOM 592 CA THR A 40 3.796 -7.434 8.145 1.00 0.00 C ATOM 593 C THR A 40 4.427 -7.147 9.505 1.00 0.00 C ATOM 594 O THR A 40 5.649 -7.067 9.625 1.00 0.00 O ATOM 595 CB THR A 40 3.782 -6.159 7.301 1.00 0.00 C ATOM 596 OG1 THR A 40 3.133 -5.106 7.992 1.00 0.00 O ATOM 597 CG2 THR A 40 3.086 -6.331 5.968 1.00 0.00 C ATOM 0 H THR A 40 1.705 -7.318 8.017 1.00 0.00 H new ATOM 0 HA THR A 40 4.397 -8.191 7.642 1.00 0.00 H new ATOM 0 HB THR A 40 4.830 -5.923 7.118 1.00 0.00 H new ATOM 0 HG1 THR A 40 3.274 -4.264 7.511 1.00 0.00 H new ATOM 0 HG21 THR A 40 3.112 -5.389 5.420 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.594 -7.102 5.389 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.050 -6.626 6.134 1.00 0.00 H new ATOM 605 N SER A 41 3.584 -6.986 10.526 1.00 0.00 N ATOM 606 CA SER A 41 4.048 -6.699 11.884 1.00 0.00 C ATOM 607 C SER A 41 5.293 -7.508 12.249 1.00 0.00 C ATOM 608 O SER A 41 6.114 -7.066 13.052 1.00 0.00 O ATOM 609 CB SER A 41 2.933 -6.986 12.892 1.00 0.00 C ATOM 610 OG SER A 41 3.340 -6.661 14.209 1.00 0.00 O ATOM 0 H SER A 41 2.570 -7.050 10.437 1.00 0.00 H new ATOM 0 HA SER A 41 4.316 -5.643 11.919 1.00 0.00 H new ATOM 0 HB2 SER A 41 2.045 -6.411 12.630 1.00 0.00 H new ATOM 0 HB3 SER A 41 2.656 -8.039 12.843 1.00 0.00 H new ATOM 0 HG SER A 41 2.609 -6.852 14.834 1.00 0.00 H new ATOM 616 N LEU A 42 5.433 -8.691 11.656 1.00 0.00 N ATOM 617 CA LEU A 42 6.585 -9.545 11.929 1.00 0.00 C ATOM 618 C LEU A 42 7.471 -9.687 10.693 1.00 0.00 C ATOM 619 O LEU A 42 7.675 -10.789 10.183 1.00 0.00 O ATOM 620 CB LEU A 42 6.140 -10.927 12.426 1.00 0.00 C ATOM 621 CG LEU A 42 4.909 -11.527 11.735 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.639 -10.813 12.175 1.00 0.00 C ATOM 623 CD2 LEU A 42 5.061 -11.479 10.222 1.00 0.00 C ATOM 0 H LEU A 42 4.767 -9.078 10.987 1.00 0.00 H new ATOM 0 HA LEU A 42 7.169 -9.067 12.716 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.973 -11.620 12.306 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.935 -10.858 13.494 1.00 0.00 H new ATOM 0 HG LEU A 42 4.829 -12.572 12.034 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.780 -11.256 11.672 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.520 -10.914 13.254 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.707 -9.757 11.915 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.176 -11.910 9.754 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.174 -10.444 9.900 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.942 -12.049 9.927 1.00 0.00 H new ATOM 635 N VAL A 43 8.003 -8.564 10.222 1.00 0.00 N ATOM 636 CA VAL A 43 8.873 -8.560 9.051 1.00 0.00 C ATOM 637 C VAL A 43 10.336 -8.714 9.459 1.00 0.00 C ATOM 638 O VAL A 43 10.800 -8.064 10.397 1.00 0.00 O ATOM 639 CB VAL A 43 8.707 -7.265 8.231 1.00 0.00 C ATOM 640 CG1 VAL A 43 9.078 -6.049 9.067 1.00 0.00 C ATOM 641 CG2 VAL A 43 9.541 -7.323 6.960 1.00 0.00 C ATOM 0 H VAL A 43 7.847 -7.644 10.634 1.00 0.00 H new ATOM 0 HA VAL A 43 8.580 -9.408 8.432 1.00 0.00 H new ATOM 0 HB VAL A 43 7.659 -7.173 7.945 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.954 -5.145 8.470 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.430 -5.998 9.942 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.116 -6.132 9.389 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.409 -6.400 6.396 1.00 0.00 H new ATOM 0 HG22 VAL A 43 10.593 -7.443 7.220 1.00 0.00 H new ATOM 0 HG23 VAL A 43 9.219 -8.168 6.352 1.00 0.00 H new ATOM 651 N GLU A 44 11.055 -9.581 8.754 1.00 0.00 N ATOM 652 CA GLU A 44 12.464 -9.827 9.048 1.00 0.00 C ATOM 653 C GLU A 44 13.375 -8.922 8.221 1.00 0.00 C ATOM 654 O GLU A 44 14.532 -8.704 8.579 1.00 0.00 O ATOM 655 CB GLU A 44 12.812 -11.291 8.778 1.00 0.00 C ATOM 656 CG GLU A 44 13.966 -11.807 9.621 1.00 0.00 C ATOM 657 CD GLU A 44 15.146 -12.260 8.783 1.00 0.00 C ATOM 658 OE1 GLU A 44 15.150 -13.430 8.345 1.00 0.00 O ATOM 659 OE2 GLU A 44 16.068 -11.445 8.565 1.00 0.00 O ATOM 0 H GLU A 44 10.686 -10.126 7.975 1.00 0.00 H new ATOM 0 HA GLU A 44 12.625 -9.602 10.102 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.932 -11.906 8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 44 13.062 -11.408 7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 44 14.291 -11.022 10.304 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.619 -12.640 10.233 1.00 0.00 H new ATOM 666 N ALA A 45 12.854 -8.406 7.111 1.00 0.00 N ATOM 667 CA ALA A 45 13.633 -7.535 6.238 1.00 0.00 C ATOM 668 C ALA A 45 14.827 -8.282 5.652 1.00 0.00 C ATOM 669 O ALA A 45 15.747 -8.666 6.374 1.00 0.00 O ATOM 670 CB ALA A 45 14.098 -6.299 6.995 1.00 0.00 C ATOM 0 H ALA A 45 11.899 -8.576 6.796 1.00 0.00 H new ATOM 0 HA ALA A 45 12.992 -7.217 5.415 1.00 0.00 H new ATOM 0 HB1 ALA A 45 14.678 -5.661 6.328 1.00 0.00 H new ATOM 0 HB2 ALA A 45 13.231 -5.749 7.361 1.00 0.00 H new ATOM 0 HB3 ALA A 45 14.719 -6.601 7.838 1.00 0.00 H new ATOM 676 N ALA A 46 14.803 -8.484 4.340 1.00 0.00 N ATOM 677 CA ALA A 46 15.878 -9.183 3.649 1.00 0.00 C ATOM 678 C ALA A 46 16.453 -8.308 2.546 1.00 0.00 C ATOM 679 O ALA A 46 17.667 -8.154 2.421 1.00 0.00 O ATOM 680 CB ALA A 46 15.363 -10.494 3.070 1.00 0.00 C ATOM 0 H ALA A 46 14.046 -8.172 3.731 1.00 0.00 H new ATOM 0 HA ALA A 46 16.670 -9.403 4.365 1.00 0.00 H new ATOM 0 HB1 ALA A 46 16.175 -11.008 2.556 1.00 0.00 H new ATOM 0 HB2 ALA A 46 14.987 -11.125 3.876 1.00 0.00 H new ATOM 0 HB3 ALA A 46 14.558 -10.289 2.364 1.00 0.00 H new ATOM 686 N GLU A 47 15.558 -7.739 1.752 1.00 0.00 N ATOM 687 CA GLU A 47 15.938 -6.870 0.650 1.00 0.00 C ATOM 688 C GLU A 47 15.313 -5.502 0.816 1.00 0.00 C ATOM 689 O GLU A 47 14.464 -5.308 1.676 1.00 0.00 O ATOM 690 CB GLU A 47 15.493 -7.474 -0.679 1.00 0.00 C ATOM 691 CG GLU A 47 14.083 -7.100 -1.100 1.00 0.00 C ATOM 692 CD GLU A 47 14.031 -5.807 -1.889 1.00 0.00 C ATOM 693 OE1 GLU A 47 14.989 -5.534 -2.645 1.00 0.00 O ATOM 694 OE2 GLU A 47 13.034 -5.066 -1.753 1.00 0.00 O ATOM 0 H GLU A 47 14.551 -7.867 1.854 1.00 0.00 H new ATOM 0 HA GLU A 47 17.023 -6.770 0.654 1.00 0.00 H new ATOM 0 HB2 GLU A 47 16.187 -7.158 -1.458 1.00 0.00 H new ATOM 0 HB3 GLU A 47 15.563 -8.560 -0.612 1.00 0.00 H new ATOM 0 HG2 GLU A 47 13.663 -7.905 -1.702 1.00 0.00 H new ATOM 0 HG3 GLU A 47 13.457 -7.005 -0.213 1.00 0.00 H new ATOM 701 N GLU A 48 15.724 -4.558 -0.016 1.00 0.00 N ATOM 702 CA GLU A 48 15.165 -3.221 0.042 1.00 0.00 C ATOM 703 C GLU A 48 15.007 -2.635 -1.359 1.00 0.00 C ATOM 704 O GLU A 48 15.975 -2.524 -2.109 1.00 0.00 O ATOM 705 CB GLU A 48 16.035 -2.311 0.910 1.00 0.00 C ATOM 706 CG GLU A 48 15.510 -0.888 1.021 1.00 0.00 C ATOM 707 CD GLU A 48 16.556 0.081 1.537 1.00 0.00 C ATOM 708 OE1 GLU A 48 17.039 -0.117 2.671 1.00 0.00 O ATOM 709 OE2 GLU A 48 16.892 1.036 0.807 1.00 0.00 O ATOM 0 H GLU A 48 16.437 -4.693 -0.733 1.00 0.00 H new ATOM 0 HA GLU A 48 14.176 -3.287 0.495 1.00 0.00 H new ATOM 0 HB2 GLU A 48 16.110 -2.740 1.909 1.00 0.00 H new ATOM 0 HB3 GLU A 48 17.044 -2.286 0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 48 15.163 -0.555 0.043 1.00 0.00 H new ATOM 0 HG3 GLU A 48 14.647 -0.874 1.687 1.00 0.00 H new ATOM 716 N ARG A 49 13.779 -2.258 -1.700 1.00 0.00 N ATOM 717 CA ARG A 49 13.490 -1.678 -3.007 1.00 0.00 C ATOM 718 C ARG A 49 12.891 -0.285 -2.845 1.00 0.00 C ATOM 719 O ARG A 49 12.305 0.024 -1.810 1.00 0.00 O ATOM 720 CB ARG A 49 12.529 -2.574 -3.789 1.00 0.00 C ATOM 721 CG ARG A 49 11.264 -2.926 -3.022 1.00 0.00 C ATOM 722 CD ARG A 49 10.013 -2.549 -3.800 1.00 0.00 C ATOM 723 NE ARG A 49 8.990 -3.592 -3.731 1.00 0.00 N ATOM 724 CZ ARG A 49 9.005 -4.695 -4.474 1.00 0.00 C ATOM 725 NH1 ARG A 49 9.988 -4.907 -5.341 1.00 0.00 N ATOM 726 NH2 ARG A 49 8.035 -5.591 -4.350 1.00 0.00 N ATOM 0 H ARG A 49 12.967 -2.344 -1.089 1.00 0.00 H new ATOM 0 HA ARG A 49 14.424 -1.598 -3.564 1.00 0.00 H new ATOM 0 HB2 ARG A 49 12.254 -2.074 -4.717 1.00 0.00 H new ATOM 0 HB3 ARG A 49 13.045 -3.494 -4.063 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.252 -3.995 -2.810 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.265 -2.410 -2.062 1.00 0.00 H new ATOM 0 HD2 ARG A 49 9.608 -1.617 -3.406 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.275 -2.367 -4.842 1.00 0.00 H new ATOM 0 HE ARG A 49 8.220 -3.466 -3.074 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.737 -4.222 -5.440 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.994 -5.755 -5.908 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.278 -5.434 -3.685 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.046 -6.437 -4.920 1.00 0.00 H new ATOM 740 N ARG A 50 13.053 0.555 -3.861 1.00 0.00 N ATOM 741 CA ARG A 50 12.533 1.917 -3.808 1.00 0.00 C ATOM 742 C ARG A 50 11.598 2.211 -4.978 1.00 0.00 C ATOM 743 O ARG A 50 11.826 1.765 -6.102 1.00 0.00 O ATOM 744 CB ARG A 50 13.687 2.921 -3.795 1.00 0.00 C ATOM 745 CG ARG A 50 14.089 3.367 -2.398 1.00 0.00 C ATOM 746 CD ARG A 50 14.383 4.858 -2.351 1.00 0.00 C ATOM 747 NE ARG A 50 15.694 5.176 -2.911 1.00 0.00 N ATOM 748 CZ ARG A 50 16.089 6.409 -3.224 1.00 0.00 C ATOM 749 NH1 ARG A 50 15.277 7.441 -3.032 1.00 0.00 N ATOM 750 NH2 ARG A 50 17.299 6.610 -3.728 1.00 0.00 N ATOM 0 H ARG A 50 13.537 0.319 -4.727 1.00 0.00 H new ATOM 0 HA ARG A 50 11.956 2.015 -2.888 1.00 0.00 H new ATOM 0 HB2 ARG A 50 14.551 2.475 -4.288 1.00 0.00 H new ATOM 0 HB3 ARG A 50 13.403 3.796 -4.379 1.00 0.00 H new ATOM 0 HG2 ARG A 50 13.290 3.131 -1.696 1.00 0.00 H new ATOM 0 HG3 ARG A 50 14.970 2.811 -2.077 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.613 5.397 -2.903 1.00 0.00 H new ATOM 0 HD3 ARG A 50 14.336 5.204 -1.318 1.00 0.00 H new ATOM 0 HE ARG A 50 16.346 4.408 -3.072 1.00 0.00 H new ATOM 0 HH11 ARG A 50 14.346 7.292 -2.643 1.00 0.00 H new ATOM 0 HH12 ARG A 50 15.584 8.383 -3.273 1.00 0.00 H new ATOM 0 HH21 ARG A 50 17.927 5.820 -3.876 1.00 0.00 H new ATOM 0 HH22 ARG A 50 17.601 7.554 -3.968 1.00 0.00 H new ATOM 764 N VAL A 51 10.550 2.980 -4.698 1.00 0.00 N ATOM 765 CA VAL A 51 9.573 3.361 -5.710 1.00 0.00 C ATOM 766 C VAL A 51 9.374 4.873 -5.706 1.00 0.00 C ATOM 767 O VAL A 51 9.498 5.517 -4.664 1.00 0.00 O ATOM 768 CB VAL A 51 8.216 2.670 -5.477 1.00 0.00 C ATOM 769 CG1 VAL A 51 7.258 2.969 -6.620 1.00 0.00 C ATOM 770 CG2 VAL A 51 8.401 1.170 -5.306 1.00 0.00 C ATOM 0 H VAL A 51 10.356 3.354 -3.769 1.00 0.00 H new ATOM 0 HA VAL A 51 9.962 3.040 -6.677 1.00 0.00 H new ATOM 0 HB VAL A 51 7.783 3.066 -4.559 1.00 0.00 H new ATOM 0 HG11 VAL A 51 6.306 2.472 -6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.098 4.045 -6.689 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.683 2.605 -7.555 1.00 0.00 H new ATOM 0 HG21 VAL A 51 7.431 0.700 -5.142 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.858 0.755 -6.204 1.00 0.00 H new ATOM 0 HG23 VAL A 51 9.046 0.978 -4.449 1.00 0.00 H new ATOM 780 N GLU A 52 9.067 5.439 -6.868 1.00 0.00 N ATOM 781 CA GLU A 52 8.858 6.876 -6.980 1.00 0.00 C ATOM 782 C GLU A 52 7.506 7.169 -7.609 1.00 0.00 C ATOM 783 O GLU A 52 7.064 6.462 -8.514 1.00 0.00 O ATOM 784 CB GLU A 52 9.976 7.517 -7.801 1.00 0.00 C ATOM 785 CG GLU A 52 10.985 8.284 -6.961 1.00 0.00 C ATOM 786 CD GLU A 52 11.300 9.653 -7.532 1.00 0.00 C ATOM 787 OE1 GLU A 52 11.983 9.718 -8.576 1.00 0.00 O ATOM 788 OE2 GLU A 52 10.864 10.659 -6.935 1.00 0.00 O ATOM 0 H GLU A 52 8.958 4.926 -7.743 1.00 0.00 H new ATOM 0 HA GLU A 52 8.875 7.305 -5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 52 10.497 6.739 -8.359 1.00 0.00 H new ATOM 0 HB3 GLU A 52 9.536 8.194 -8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 52 10.598 8.397 -5.948 1.00 0.00 H new ATOM 0 HG3 GLU A 52 11.905 7.705 -6.887 1.00 0.00 H new ATOM 795 N ILE A 53 6.845 8.206 -7.115 1.00 0.00 N ATOM 796 CA ILE A 53 5.536 8.574 -7.625 1.00 0.00 C ATOM 797 C ILE A 53 5.379 10.084 -7.741 1.00 0.00 C ATOM 798 O ILE A 53 5.931 10.838 -6.943 1.00 0.00 O ATOM 799 CB ILE A 53 4.405 8.024 -6.729 1.00 0.00 C ATOM 800 CG1 ILE A 53 4.936 6.982 -5.739 1.00 0.00 C ATOM 801 CG2 ILE A 53 3.320 7.421 -7.590 1.00 0.00 C ATOM 802 CD1 ILE A 53 3.862 6.385 -4.857 1.00 0.00 C ATOM 0 H ILE A 53 7.193 8.804 -6.365 1.00 0.00 H new ATOM 0 HA ILE A 53 5.460 8.130 -8.618 1.00 0.00 H new ATOM 0 HB ILE A 53 3.992 8.852 -6.152 1.00 0.00 H new ATOM 0 HG12 ILE A 53 5.426 6.182 -6.294 1.00 0.00 H new ATOM 0 HG13 ILE A 53 5.696 7.445 -5.110 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.524 7.034 -6.954 1.00 0.00 H new ATOM 0 HG22 ILE A 53 2.915 8.185 -8.254 1.00 0.00 H new ATOM 0 HG23 ILE A 53 3.737 6.608 -8.184 1.00 0.00 H new ATOM 0 HD11 ILE A 53 4.310 5.656 -4.182 1.00 0.00 H new ATOM 0 HD12 ILE A 53 3.388 7.175 -4.275 1.00 0.00 H new ATOM 0 HD13 ILE A 53 3.113 5.893 -5.478 1.00 0.00 H new ATOM 814 N THR A 54 4.606 10.519 -8.732 1.00 0.00 N ATOM 815 CA THR A 54 4.358 11.939 -8.932 1.00 0.00 C ATOM 816 C THR A 54 2.861 12.227 -8.872 1.00 0.00 C ATOM 817 O THR A 54 2.097 11.780 -9.726 1.00 0.00 O ATOM 818 CB THR A 54 4.926 12.396 -10.276 1.00 0.00 C ATOM 819 OG1 THR A 54 4.316 11.692 -11.343 1.00 0.00 O ATOM 820 CG2 THR A 54 6.421 12.197 -10.391 1.00 0.00 C ATOM 0 H THR A 54 4.143 9.909 -9.406 1.00 0.00 H new ATOM 0 HA THR A 54 4.856 12.492 -8.136 1.00 0.00 H new ATOM 0 HB THR A 54 4.712 13.463 -10.333 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.364 11.562 -11.148 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.760 12.541 -11.368 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.925 12.767 -9.611 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.657 11.139 -10.277 1.00 0.00 H new ATOM 828 N SER A 55 2.453 12.979 -7.857 1.00 0.00 N ATOM 829 CA SER A 55 1.049 13.333 -7.681 1.00 0.00 C ATOM 830 C SER A 55 0.866 14.844 -7.686 1.00 0.00 C ATOM 831 O SER A 55 1.823 15.595 -7.509 1.00 0.00 O ATOM 832 CB SER A 55 0.510 12.746 -6.376 1.00 0.00 C ATOM 833 OG SER A 55 -0.630 13.457 -5.924 1.00 0.00 O ATOM 0 H SER A 55 3.075 13.356 -7.142 1.00 0.00 H new ATOM 0 HA SER A 55 0.488 12.914 -8.516 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.252 11.698 -6.526 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.287 12.777 -5.612 1.00 0.00 H new ATOM 0 HG SER A 55 -0.366 14.083 -5.217 1.00 0.00 H new ATOM 839 N GLU A 56 -0.372 15.282 -7.878 1.00 0.00 N ATOM 840 CA GLU A 56 -0.689 16.705 -7.892 1.00 0.00 C ATOM 841 C GLU A 56 -2.155 16.932 -7.545 1.00 0.00 C ATOM 842 O GLU A 56 -2.751 17.932 -7.944 1.00 0.00 O ATOM 843 CB GLU A 56 -0.376 17.310 -9.260 1.00 0.00 C ATOM 844 CG GLU A 56 0.992 16.922 -9.792 1.00 0.00 C ATOM 845 CD GLU A 56 1.357 17.663 -11.063 1.00 0.00 C ATOM 846 OE1 GLU A 56 1.375 18.912 -11.038 1.00 0.00 O ATOM 847 OE2 GLU A 56 1.626 16.996 -12.084 1.00 0.00 O ATOM 0 H GLU A 56 -1.175 14.671 -8.027 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.072 17.198 -7.140 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -1.138 16.993 -9.972 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.436 18.396 -9.191 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.744 17.124 -9.030 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.012 15.849 -9.983 1.00 0.00 H new ATOM 854 N ASP A 57 -2.734 15.992 -6.803 1.00 0.00 N ATOM 855 CA ASP A 57 -4.132 16.088 -6.408 1.00 0.00 C ATOM 856 C ASP A 57 -4.428 15.227 -5.178 1.00 0.00 C ATOM 857 O ASP A 57 -5.583 14.902 -4.905 1.00 0.00 O ATOM 858 CB ASP A 57 -5.027 15.665 -7.573 1.00 0.00 C ATOM 859 CG ASP A 57 -6.293 16.494 -7.663 1.00 0.00 C ATOM 860 OD1 ASP A 57 -7.207 16.275 -6.840 1.00 0.00 O ATOM 861 OD2 ASP A 57 -6.371 17.365 -8.555 1.00 0.00 O ATOM 0 H ASP A 57 -2.256 15.157 -6.465 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.340 17.125 -6.145 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.470 15.755 -8.506 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.292 14.614 -7.460 1.00 0.00 H new ATOM 866 N ARG A 58 -3.381 14.870 -4.433 1.00 0.00 N ATOM 867 CA ARG A 58 -3.529 14.056 -3.228 1.00 0.00 C ATOM 868 C ARG A 58 -4.022 12.649 -3.560 1.00 0.00 C ATOM 869 O ARG A 58 -3.299 11.670 -3.374 1.00 0.00 O ATOM 870 CB ARG A 58 -4.492 14.731 -2.247 1.00 0.00 C ATOM 871 CG ARG A 58 -3.792 15.455 -1.110 1.00 0.00 C ATOM 872 CD ARG A 58 -3.383 16.862 -1.512 1.00 0.00 C ATOM 873 NE ARG A 58 -2.134 17.273 -0.875 1.00 0.00 N ATOM 874 CZ ARG A 58 -1.528 18.434 -1.109 1.00 0.00 C ATOM 875 NH1 ARG A 58 -2.052 19.302 -1.967 1.00 0.00 N ATOM 876 NH2 ARG A 58 -0.395 18.728 -0.487 1.00 0.00 N ATOM 0 H ARG A 58 -2.419 15.133 -4.645 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.546 13.968 -2.764 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -5.113 15.442 -2.792 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -5.160 13.978 -1.830 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -4.453 15.501 -0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -2.910 14.891 -0.807 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.271 16.911 -2.595 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.175 17.561 -1.242 1.00 0.00 H new ATOM 0 HE ARG A 58 -1.701 16.631 -0.211 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -2.923 19.080 -2.450 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -1.584 20.191 -2.143 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.013 18.064 0.171 1.00 0.00 H new ATOM 0 HH22 ARG A 58 0.069 19.618 -0.667 1.00 0.00 H new ATOM 890 N VAL A 59 -5.256 12.555 -4.040 1.00 0.00 N ATOM 891 CA VAL A 59 -5.850 11.267 -4.387 1.00 0.00 C ATOM 892 C VAL A 59 -4.969 10.489 -5.360 1.00 0.00 C ATOM 893 O VAL A 59 -4.886 9.262 -5.290 1.00 0.00 O ATOM 894 CB VAL A 59 -7.246 11.445 -5.010 1.00 0.00 C ATOM 895 CG1 VAL A 59 -8.214 12.031 -3.994 1.00 0.00 C ATOM 896 CG2 VAL A 59 -7.170 12.319 -6.252 1.00 0.00 C ATOM 0 H VAL A 59 -5.867 13.356 -4.199 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.939 10.704 -3.458 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.618 10.465 -5.307 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -9.196 12.150 -4.453 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -8.292 11.361 -3.138 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.849 13.003 -3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.167 12.433 -6.678 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.776 13.299 -5.984 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -6.513 11.852 -6.986 1.00 0.00 H new ATOM 906 N SER A 60 -4.319 11.204 -6.270 1.00 0.00 N ATOM 907 CA SER A 60 -3.452 10.573 -7.258 1.00 0.00 C ATOM 908 C SER A 60 -2.326 9.794 -6.584 1.00 0.00 C ATOM 909 O SER A 60 -1.990 8.687 -7.005 1.00 0.00 O ATOM 910 CB SER A 60 -2.869 11.624 -8.205 1.00 0.00 C ATOM 911 OG SER A 60 -2.482 11.043 -9.438 1.00 0.00 O ATOM 0 H SER A 60 -4.375 12.220 -6.345 1.00 0.00 H new ATOM 0 HA SER A 60 -4.056 9.872 -7.834 1.00 0.00 H new ATOM 0 HB2 SER A 60 -3.607 12.406 -8.384 1.00 0.00 H new ATOM 0 HB3 SER A 60 -2.007 12.100 -7.738 1.00 0.00 H new ATOM 0 HG SER A 60 -2.290 10.091 -9.305 1.00 0.00 H new ATOM 917 N LEU A 61 -1.745 10.373 -5.536 1.00 0.00 N ATOM 918 CA LEU A 61 -0.659 9.718 -4.811 1.00 0.00 C ATOM 919 C LEU A 61 -1.089 8.323 -4.364 1.00 0.00 C ATOM 920 O LEU A 61 -0.366 7.347 -4.563 1.00 0.00 O ATOM 921 CB LEU A 61 -0.235 10.565 -3.597 1.00 0.00 C ATOM 922 CG LEU A 61 1.277 10.845 -3.428 1.00 0.00 C ATOM 923 CD1 LEU A 61 2.089 10.365 -4.626 1.00 0.00 C ATOM 924 CD2 LEU A 61 1.512 12.331 -3.196 1.00 0.00 C ATOM 0 H LEU A 61 -2.006 11.289 -5.171 1.00 0.00 H new ATOM 0 HA LEU A 61 0.197 9.621 -5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.752 11.523 -3.655 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -0.590 10.066 -2.695 1.00 0.00 H new ATOM 0 HG LEU A 61 1.617 10.282 -2.559 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.144 10.583 -4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.956 9.290 -4.749 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.748 10.878 -5.525 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.580 12.517 -3.078 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.137 12.896 -4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.988 12.646 -2.294 1.00 0.00 H new ATOM 936 N LEU A 62 -2.278 8.235 -3.775 1.00 0.00 N ATOM 937 CA LEU A 62 -2.808 6.955 -3.318 1.00 0.00 C ATOM 938 C LEU A 62 -3.174 6.078 -4.510 1.00 0.00 C ATOM 939 O LEU A 62 -2.818 4.900 -4.563 1.00 0.00 O ATOM 940 CB LEU A 62 -4.044 7.164 -2.434 1.00 0.00 C ATOM 941 CG LEU A 62 -4.336 6.040 -1.429 1.00 0.00 C ATOM 942 CD1 LEU A 62 -3.974 4.678 -2.014 1.00 0.00 C ATOM 943 CD2 LEU A 62 -3.576 6.280 -0.133 1.00 0.00 C ATOM 0 H LEU A 62 -2.891 9.032 -3.603 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.035 6.459 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.922 8.097 -1.884 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.914 7.286 -3.079 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.405 6.043 -1.215 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -4.190 3.899 -1.283 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.560 4.502 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.913 4.659 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.792 5.476 0.570 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.506 6.305 -0.338 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.885 7.232 0.299 1.00 0.00 H new ATOM 955 N TYR A 63 -3.888 6.664 -5.466 1.00 0.00 N ATOM 956 CA TYR A 63 -4.308 5.945 -6.663 1.00 0.00 C ATOM 957 C TYR A 63 -3.107 5.362 -7.398 1.00 0.00 C ATOM 958 O TYR A 63 -3.189 4.282 -7.983 1.00 0.00 O ATOM 959 CB TYR A 63 -5.087 6.876 -7.593 1.00 0.00 C ATOM 960 CG TYR A 63 -5.930 6.147 -8.615 1.00 0.00 C ATOM 961 CD1 TYR A 63 -6.900 5.234 -8.218 1.00 0.00 C ATOM 962 CD2 TYR A 63 -5.755 6.368 -9.974 1.00 0.00 C ATOM 963 CE1 TYR A 63 -7.671 4.564 -9.148 1.00 0.00 C ATOM 964 CE2 TYR A 63 -6.523 5.702 -10.910 1.00 0.00 C ATOM 965 CZ TYR A 63 -7.479 4.801 -10.492 1.00 0.00 C ATOM 966 OH TYR A 63 -8.245 4.135 -11.421 1.00 0.00 O ATOM 0 H TYR A 63 -4.188 7.638 -5.434 1.00 0.00 H new ATOM 0 HA TYR A 63 -4.955 5.124 -6.355 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -5.733 7.517 -6.993 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -4.384 7.528 -8.113 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.053 5.045 -7.166 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.006 7.072 -10.305 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.421 3.858 -8.823 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.375 5.886 -11.964 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.984 4.417 -12.323 1.00 0.00 H new ATOM 976 N ASP A 64 -1.995 6.086 -7.368 1.00 0.00 N ATOM 977 CA ASP A 64 -0.778 5.642 -8.035 1.00 0.00 C ATOM 978 C ASP A 64 0.139 4.882 -7.081 1.00 0.00 C ATOM 979 O ASP A 64 1.045 4.171 -7.518 1.00 0.00 O ATOM 980 CB ASP A 64 -0.033 6.842 -8.625 1.00 0.00 C ATOM 981 CG ASP A 64 -0.640 7.315 -9.931 1.00 0.00 C ATOM 982 OD1 ASP A 64 -1.691 7.988 -9.887 1.00 0.00 O ATOM 983 OD2 ASP A 64 -0.065 7.014 -10.997 1.00 0.00 O ATOM 0 H ASP A 64 -1.911 6.983 -6.889 1.00 0.00 H new ATOM 0 HA ASP A 64 -1.068 4.963 -8.837 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.042 7.661 -7.906 1.00 0.00 H new ATOM 0 HB3 ASP A 64 1.011 6.573 -8.789 1.00 0.00 H new ATOM 988 N TRP A 65 -0.090 5.031 -5.777 1.00 0.00 N ATOM 989 CA TRP A 65 0.734 4.351 -4.784 1.00 0.00 C ATOM 990 C TRP A 65 0.428 2.858 -4.743 1.00 0.00 C ATOM 991 O TRP A 65 1.332 2.029 -4.851 1.00 0.00 O ATOM 992 CB TRP A 65 0.534 4.965 -3.396 1.00 0.00 C ATOM 993 CG TRP A 65 1.251 4.223 -2.306 1.00 0.00 C ATOM 994 CD1 TRP A 65 0.781 3.959 -1.053 1.00 0.00 C ATOM 995 CD2 TRP A 65 2.564 3.647 -2.373 1.00 0.00 C ATOM 996 NE1 TRP A 65 1.719 3.255 -0.336 1.00 0.00 N ATOM 997 CE2 TRP A 65 2.821 3.053 -1.122 1.00 0.00 C ATOM 998 CE3 TRP A 65 3.548 3.575 -3.365 1.00 0.00 C ATOM 999 CZ2 TRP A 65 4.017 2.397 -0.839 1.00 0.00 C ATOM 1000 CZ3 TRP A 65 4.734 2.925 -3.082 1.00 0.00 C ATOM 1001 CH2 TRP A 65 4.960 2.343 -1.828 1.00 0.00 C ATOM 0 H TRP A 65 -0.833 5.612 -5.388 1.00 0.00 H new ATOM 0 HA TRP A 65 1.776 4.481 -5.078 1.00 0.00 H new ATOM 0 HB2 TRP A 65 0.881 5.998 -3.411 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -0.532 4.990 -3.168 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -0.187 4.259 -0.679 1.00 0.00 H new ATOM 0 HE1 TRP A 65 1.611 2.935 0.626 1.00 0.00 H new ATOM 0 HE3 TRP A 65 3.383 4.020 -4.335 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 4.193 1.947 0.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 5.500 2.865 -3.841 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.898 1.842 -1.638 1.00 0.00 H new ATOM 1012 N LEU A 66 -0.845 2.520 -4.585 1.00 0.00 N ATOM 1013 CA LEU A 66 -1.252 1.122 -4.528 1.00 0.00 C ATOM 1014 C LEU A 66 -1.083 0.455 -5.887 1.00 0.00 C ATOM 1015 O LEU A 66 -0.580 -0.664 -5.977 1.00 0.00 O ATOM 1016 CB LEU A 66 -2.701 1.003 -4.051 1.00 0.00 C ATOM 1017 CG LEU A 66 -2.914 0.080 -2.848 1.00 0.00 C ATOM 1018 CD1 LEU A 66 -4.394 -0.057 -2.536 1.00 0.00 C ATOM 1019 CD2 LEU A 66 -2.292 -1.284 -3.108 1.00 0.00 C ATOM 0 H LEU A 66 -1.609 3.190 -4.495 1.00 0.00 H new ATOM 0 HA LEU A 66 -0.609 0.609 -3.812 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -3.066 1.998 -3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.311 0.642 -4.879 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.422 0.523 -1.982 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.525 -0.717 -1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.810 0.924 -2.306 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.910 -0.477 -3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.452 -1.928 -2.243 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.755 -1.734 -3.986 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.222 -1.169 -3.281 1.00 0.00 H new ATOM 1031 N ASP A 67 -1.487 1.151 -6.948 1.00 0.00 N ATOM 1032 CA ASP A 67 -1.351 0.614 -8.296 1.00 0.00 C ATOM 1033 C ASP A 67 0.086 0.164 -8.524 1.00 0.00 C ATOM 1034 O ASP A 67 0.344 -0.820 -9.217 1.00 0.00 O ATOM 1035 CB ASP A 67 -1.749 1.662 -9.337 1.00 0.00 C ATOM 1036 CG ASP A 67 -1.721 1.114 -10.750 1.00 0.00 C ATOM 1037 OD1 ASP A 67 -0.621 0.765 -11.229 1.00 0.00 O ATOM 1038 OD2 ASP A 67 -2.797 1.033 -11.378 1.00 0.00 O ATOM 0 H ASP A 67 -1.907 2.079 -6.900 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.017 -0.242 -8.403 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -2.750 2.030 -9.113 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.073 2.514 -9.267 1.00 0.00 H new ATOM 1043 N GLU A 68 1.016 0.885 -7.906 1.00 0.00 N ATOM 1044 CA GLU A 68 2.431 0.559 -8.003 1.00 0.00 C ATOM 1045 C GLU A 68 2.694 -0.772 -7.312 1.00 0.00 C ATOM 1046 O GLU A 68 3.525 -1.567 -7.754 1.00 0.00 O ATOM 1047 CB GLU A 68 3.270 1.661 -7.356 1.00 0.00 C ATOM 1048 CG GLU A 68 4.448 2.111 -8.205 1.00 0.00 C ATOM 1049 CD GLU A 68 4.019 2.652 -9.555 1.00 0.00 C ATOM 1050 OE1 GLU A 68 3.807 1.840 -10.481 1.00 0.00 O ATOM 1051 OE2 GLU A 68 3.896 3.888 -9.688 1.00 0.00 O ATOM 0 H GLU A 68 0.812 1.702 -7.331 1.00 0.00 H new ATOM 0 HA GLU A 68 2.710 0.480 -9.054 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.631 2.520 -7.153 1.00 0.00 H new ATOM 0 HB3 GLU A 68 3.641 1.306 -6.395 1.00 0.00 H new ATOM 0 HG2 GLU A 68 5.005 2.880 -7.669 1.00 0.00 H new ATOM 0 HG3 GLU A 68 5.127 1.271 -8.353 1.00 0.00 H new ATOM 1058 N LEU A 69 1.964 -1.006 -6.226 1.00 0.00 N ATOM 1059 CA LEU A 69 2.091 -2.237 -5.461 1.00 0.00 C ATOM 1060 C LEU A 69 1.510 -3.412 -6.240 1.00 0.00 C ATOM 1061 O LEU A 69 1.972 -4.545 -6.117 1.00 0.00 O ATOM 1062 CB LEU A 69 1.382 -2.097 -4.111 1.00 0.00 C ATOM 1063 CG LEU A 69 2.193 -2.569 -2.904 1.00 0.00 C ATOM 1064 CD1 LEU A 69 1.534 -2.118 -1.609 1.00 0.00 C ATOM 1065 CD2 LEU A 69 2.348 -4.082 -2.925 1.00 0.00 C ATOM 0 H LEU A 69 1.274 -0.353 -5.856 1.00 0.00 H new ATOM 0 HA LEU A 69 3.150 -2.427 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.116 -1.050 -3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.450 -2.661 -4.147 1.00 0.00 H new ATOM 0 HG LEU A 69 3.185 -2.121 -2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.125 -2.463 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.474 -1.030 -1.591 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.530 -2.538 -1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.928 -4.400 -2.059 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.364 -4.549 -2.894 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.864 -4.382 -3.837 1.00 0.00 H new ATOM 1077 N LEU A 70 0.485 -3.129 -7.039 1.00 0.00 N ATOM 1078 CA LEU A 70 -0.174 -4.154 -7.839 1.00 0.00 C ATOM 1079 C LEU A 70 0.791 -4.792 -8.837 1.00 0.00 C ATOM 1080 O LEU A 70 0.862 -6.015 -8.948 1.00 0.00 O ATOM 1081 CB LEU A 70 -1.370 -3.554 -8.583 1.00 0.00 C ATOM 1082 CG LEU A 70 -2.597 -4.463 -8.676 1.00 0.00 C ATOM 1083 CD1 LEU A 70 -3.875 -3.644 -8.595 1.00 0.00 C ATOM 1084 CD2 LEU A 70 -2.562 -5.274 -9.963 1.00 0.00 C ATOM 0 H LEU A 70 0.092 -2.194 -7.149 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.522 -4.933 -7.160 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.660 -2.628 -8.087 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.055 -3.290 -9.593 1.00 0.00 H new ATOM 0 HG LEU A 70 -2.579 -5.154 -7.833 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.737 -4.307 -8.663 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.904 -3.107 -7.647 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.902 -2.929 -9.417 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.442 -5.915 -10.013 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.556 -4.599 -10.819 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.663 -5.890 -9.981 1.00 0.00 H new ATOM 1096 N PHE A 71 1.522 -3.955 -9.567 1.00 0.00 N ATOM 1097 CA PHE A 71 2.472 -4.440 -10.567 1.00 0.00 C ATOM 1098 C PHE A 71 3.683 -5.103 -9.912 1.00 0.00 C ATOM 1099 O PHE A 71 4.042 -6.231 -10.251 1.00 0.00 O ATOM 1100 CB PHE A 71 2.929 -3.285 -11.462 1.00 0.00 C ATOM 1101 CG PHE A 71 2.647 -3.509 -12.920 1.00 0.00 C ATOM 1102 CD1 PHE A 71 1.352 -3.436 -13.408 1.00 0.00 C ATOM 1103 CD2 PHE A 71 3.677 -3.789 -13.804 1.00 0.00 C ATOM 1104 CE1 PHE A 71 1.089 -3.640 -14.749 1.00 0.00 C ATOM 1105 CE2 PHE A 71 3.420 -3.994 -15.147 1.00 0.00 C ATOM 1106 CZ PHE A 71 2.125 -3.920 -15.620 1.00 0.00 C ATOM 0 H PHE A 71 1.476 -2.939 -9.486 1.00 0.00 H new ATOM 0 HA PHE A 71 1.965 -5.190 -11.174 1.00 0.00 H new ATOM 0 HB2 PHE A 71 2.433 -2.369 -11.141 1.00 0.00 H new ATOM 0 HB3 PHE A 71 4.000 -3.132 -11.326 1.00 0.00 H new ATOM 0 HD1 PHE A 71 0.539 -3.217 -12.732 1.00 0.00 H new ATOM 0 HD2 PHE A 71 4.692 -3.848 -13.440 1.00 0.00 H new ATOM 0 HE1 PHE A 71 0.075 -3.581 -15.116 1.00 0.00 H new ATOM 0 HE2 PHE A 71 4.232 -4.212 -15.825 1.00 0.00 H new ATOM 0 HZ PHE A 71 1.922 -4.081 -16.669 1.00 0.00 H new ATOM 1116 N ILE A 72 4.312 -4.395 -8.981 1.00 0.00 N ATOM 1117 CA ILE A 72 5.486 -4.913 -8.285 1.00 0.00 C ATOM 1118 C ILE A 72 5.199 -6.260 -7.626 1.00 0.00 C ATOM 1119 O ILE A 72 6.079 -7.115 -7.537 1.00 0.00 O ATOM 1120 CB ILE A 72 6.002 -3.925 -7.220 1.00 0.00 C ATOM 1121 CG1 ILE A 72 4.967 -3.737 -6.112 1.00 0.00 C ATOM 1122 CG2 ILE A 72 6.346 -2.589 -7.862 1.00 0.00 C ATOM 1123 CD1 ILE A 72 5.045 -4.788 -5.026 1.00 0.00 C ATOM 0 H ILE A 72 4.029 -3.459 -8.690 1.00 0.00 H new ATOM 0 HA ILE A 72 6.258 -5.046 -9.043 1.00 0.00 H new ATOM 0 HB ILE A 72 6.906 -4.339 -6.774 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.102 -2.753 -5.664 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.970 -3.754 -6.551 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.709 -1.901 -7.098 1.00 0.00 H new ATOM 0 HG22 ILE A 72 7.120 -2.736 -8.615 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.456 -2.172 -8.333 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.281 -4.591 -4.274 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.880 -5.774 -5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 72 6.030 -4.757 -4.560 1.00 0.00 H new ATOM 1135 N HIS A 73 3.968 -6.438 -7.153 1.00 0.00 N ATOM 1136 CA HIS A 73 3.574 -7.679 -6.488 1.00 0.00 C ATOM 1137 C HIS A 73 3.963 -8.901 -7.316 1.00 0.00 C ATOM 1138 O HIS A 73 4.621 -9.809 -6.814 1.00 0.00 O ATOM 1139 CB HIS A 73 2.067 -7.684 -6.224 1.00 0.00 C ATOM 1140 CG HIS A 73 1.711 -7.997 -4.804 1.00 0.00 C ATOM 1141 ND1 HIS A 73 0.903 -7.186 -4.035 1.00 0.00 N ATOM 1142 CD2 HIS A 73 2.056 -9.041 -4.012 1.00 0.00 C ATOM 1143 CE1 HIS A 73 0.768 -7.716 -2.832 1.00 0.00 C ATOM 1144 NE2 HIS A 73 1.456 -8.841 -2.793 1.00 0.00 N ATOM 0 H HIS A 73 3.227 -5.740 -7.217 1.00 0.00 H new ATOM 0 HA HIS A 73 4.105 -7.731 -5.537 1.00 0.00 H new ATOM 0 HB2 HIS A 73 1.657 -6.709 -6.487 1.00 0.00 H new ATOM 0 HB3 HIS A 73 1.594 -8.416 -6.879 1.00 0.00 H new ATOM 0 HD2 HIS A 73 2.685 -9.874 -4.288 1.00 0.00 H new ATOM 0 HE1 HIS A 73 0.192 -7.299 -2.019 1.00 0.00 H new ATOM 0 HE2 HIS A 73 1.530 -9.462 -1.987 1.00 0.00 H new ATOM 1153 N ASP A 74 3.564 -8.925 -8.581 1.00 0.00 N ATOM 1154 CA ASP A 74 3.896 -10.049 -9.448 1.00 0.00 C ATOM 1155 C ASP A 74 5.362 -10.010 -9.831 1.00 0.00 C ATOM 1156 O ASP A 74 6.017 -11.050 -9.908 1.00 0.00 O ATOM 1157 CB ASP A 74 3.013 -10.057 -10.697 1.00 0.00 C ATOM 1158 CG ASP A 74 2.632 -11.460 -11.127 1.00 0.00 C ATOM 1159 OD1 ASP A 74 3.424 -12.394 -10.879 1.00 0.00 O ATOM 1160 OD2 ASP A 74 1.540 -11.627 -11.711 1.00 0.00 O ATOM 0 H ASP A 74 3.016 -8.189 -9.026 1.00 0.00 H new ATOM 0 HA ASP A 74 3.707 -10.970 -8.896 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.108 -9.481 -10.502 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.538 -9.560 -11.513 1.00 0.00 H new ATOM 1165 N THR A 75 5.891 -8.812 -10.034 1.00 0.00 N ATOM 1166 CA THR A 75 7.298 -8.677 -10.363 1.00 0.00 C ATOM 1167 C THR A 75 8.125 -9.167 -9.184 1.00 0.00 C ATOM 1168 O THR A 75 9.303 -9.495 -9.324 1.00 0.00 O ATOM 1169 CB THR A 75 7.652 -7.225 -10.705 1.00 0.00 C ATOM 1170 OG1 THR A 75 7.902 -6.475 -9.529 1.00 0.00 O ATOM 1171 CG2 THR A 75 6.572 -6.509 -11.486 1.00 0.00 C ATOM 0 H THR A 75 5.375 -7.934 -9.977 1.00 0.00 H new ATOM 0 HA THR A 75 7.519 -9.279 -11.244 1.00 0.00 H new ATOM 0 HB THR A 75 8.544 -7.289 -11.328 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.332 -6.805 -8.803 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.890 -5.487 -11.693 1.00 0.00 H new ATOM 0 HG22 THR A 75 6.395 -7.032 -12.426 1.00 0.00 H new ATOM 0 HG23 THR A 75 5.652 -6.492 -10.902 1.00 0.00 H new ATOM 1179 N GLU A 76 7.478 -9.241 -8.023 1.00 0.00 N ATOM 1180 CA GLU A 76 8.122 -9.720 -6.820 1.00 0.00 C ATOM 1181 C GLU A 76 7.095 -10.126 -5.783 1.00 0.00 C ATOM 1182 O GLU A 76 6.845 -9.411 -4.813 1.00 0.00 O ATOM 1183 CB GLU A 76 9.083 -8.669 -6.257 1.00 0.00 C ATOM 1184 CG GLU A 76 10.491 -9.193 -6.026 1.00 0.00 C ATOM 1185 CD GLU A 76 11.079 -9.851 -7.259 1.00 0.00 C ATOM 1186 OE1 GLU A 76 11.646 -9.127 -8.104 1.00 0.00 O ATOM 1187 OE2 GLU A 76 10.970 -11.089 -7.380 1.00 0.00 O ATOM 0 H GLU A 76 6.502 -8.972 -7.898 1.00 0.00 H new ATOM 0 HA GLU A 76 8.706 -10.603 -7.080 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.127 -7.824 -6.944 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.685 -8.293 -5.314 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.135 -8.370 -5.716 1.00 0.00 H new ATOM 0 HG3 GLU A 76 10.477 -9.912 -5.207 1.00 0.00 H new ATOM 1194 N PHE A 77 6.507 -11.295 -6.001 1.00 0.00 N ATOM 1195 CA PHE A 77 5.511 -11.828 -5.089 1.00 0.00 C ATOM 1196 C PHE A 77 6.105 -11.983 -3.697 1.00 0.00 C ATOM 1197 O PHE A 77 6.773 -12.971 -3.402 1.00 0.00 O ATOM 1198 CB PHE A 77 4.990 -13.175 -5.596 1.00 0.00 C ATOM 1199 CG PHE A 77 3.520 -13.170 -5.908 1.00 0.00 C ATOM 1200 CD1 PHE A 77 2.581 -13.136 -4.889 1.00 0.00 C ATOM 1201 CD2 PHE A 77 3.077 -13.198 -7.221 1.00 0.00 C ATOM 1202 CE1 PHE A 77 1.230 -13.130 -5.173 1.00 0.00 C ATOM 1203 CE2 PHE A 77 1.726 -13.193 -7.511 1.00 0.00 C ATOM 1204 CZ PHE A 77 0.801 -13.159 -6.486 1.00 0.00 C ATOM 0 H PHE A 77 6.705 -11.891 -6.804 1.00 0.00 H new ATOM 0 HA PHE A 77 4.675 -11.130 -5.039 1.00 0.00 H new ATOM 0 HB2 PHE A 77 5.543 -13.455 -6.493 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.191 -13.939 -4.845 1.00 0.00 H new ATOM 0 HD1 PHE A 77 2.910 -13.114 -3.861 1.00 0.00 H new ATOM 0 HD2 PHE A 77 3.796 -13.224 -8.027 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.509 -13.103 -4.369 1.00 0.00 H new ATOM 0 HE2 PHE A 77 1.394 -13.216 -8.538 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.255 -13.155 -6.710 1.00 0.00 H new ATOM 1214 N ILE A 78 5.874 -10.986 -2.857 1.00 0.00 N ATOM 1215 CA ILE A 78 6.395 -10.997 -1.496 1.00 0.00 C ATOM 1216 C ILE A 78 5.269 -11.112 -0.471 1.00 0.00 C ATOM 1217 O ILE A 78 4.178 -10.576 -0.669 1.00 0.00 O ATOM 1218 CB ILE A 78 7.228 -9.733 -1.210 1.00 0.00 C ATOM 1219 CG1 ILE A 78 6.344 -8.481 -1.232 1.00 0.00 C ATOM 1220 CG2 ILE A 78 8.348 -9.613 -2.230 1.00 0.00 C ATOM 1221 CD1 ILE A 78 6.471 -7.631 0.013 1.00 0.00 C ATOM 0 H ILE A 78 5.328 -10.157 -3.093 1.00 0.00 H new ATOM 0 HA ILE A 78 7.039 -11.872 -1.407 1.00 0.00 H new ATOM 0 HB ILE A 78 7.663 -9.819 -0.214 1.00 0.00 H new ATOM 0 HG12 ILE A 78 6.603 -7.878 -2.102 1.00 0.00 H new ATOM 0 HG13 ILE A 78 5.303 -8.783 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 78 8.934 -8.717 -2.023 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.992 -10.490 -2.168 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.923 -9.545 -3.231 1.00 0.00 H new ATOM 0 HD11 ILE A 78 5.818 -6.762 -0.071 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.183 -8.218 0.885 1.00 0.00 H new ATOM 0 HD13 ILE A 78 7.503 -7.299 0.123 1.00 0.00 H new ATOM 1233 N LEU A 79 5.538 -11.828 0.615 1.00 0.00 N ATOM 1234 CA LEU A 79 4.547 -12.033 1.667 1.00 0.00 C ATOM 1235 C LEU A 79 4.412 -10.799 2.559 1.00 0.00 C ATOM 1236 O LEU A 79 3.404 -10.094 2.506 1.00 0.00 O ATOM 1237 CB LEU A 79 4.921 -13.253 2.512 1.00 0.00 C ATOM 1238 CG LEU A 79 3.739 -14.022 3.106 1.00 0.00 C ATOM 1239 CD1 LEU A 79 2.797 -13.077 3.833 1.00 0.00 C ATOM 1240 CD2 LEU A 79 2.997 -14.787 2.020 1.00 0.00 C ATOM 0 H LEU A 79 6.436 -12.278 0.791 1.00 0.00 H new ATOM 0 HA LEU A 79 3.583 -12.207 1.188 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.505 -13.936 1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 79 5.567 -12.926 3.327 1.00 0.00 H new ATOM 0 HG LEU A 79 4.127 -14.741 3.827 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.963 -13.643 4.248 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.334 -12.577 4.639 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.418 -12.332 3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.160 -15.327 2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.623 -14.087 1.273 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.676 -15.495 1.545 1.00 0.00 H new ATOM 1252 N PHE A 80 5.425 -10.548 3.383 1.00 0.00 N ATOM 1253 CA PHE A 80 5.407 -9.404 4.290 1.00 0.00 C ATOM 1254 C PHE A 80 6.625 -8.514 4.074 1.00 0.00 C ATOM 1255 O PHE A 80 7.725 -9.003 3.826 1.00 0.00 O ATOM 1256 CB PHE A 80 5.366 -9.880 5.742 1.00 0.00 C ATOM 1257 CG PHE A 80 6.356 -10.969 6.045 1.00 0.00 C ATOM 1258 CD1 PHE A 80 7.678 -10.662 6.326 1.00 0.00 C ATOM 1259 CD2 PHE A 80 5.964 -12.298 6.050 1.00 0.00 C ATOM 1260 CE1 PHE A 80 8.591 -11.661 6.605 1.00 0.00 C ATOM 1261 CE2 PHE A 80 6.873 -13.301 6.328 1.00 0.00 C ATOM 1262 CZ PHE A 80 8.188 -12.982 6.606 1.00 0.00 C ATOM 0 H PHE A 80 6.267 -11.120 3.442 1.00 0.00 H new ATOM 0 HA PHE A 80 4.511 -8.821 4.077 1.00 0.00 H new ATOM 0 HB2 PHE A 80 5.558 -9.032 6.399 1.00 0.00 H new ATOM 0 HB3 PHE A 80 4.362 -10.239 5.970 1.00 0.00 H new ATOM 0 HD1 PHE A 80 7.998 -9.631 6.327 1.00 0.00 H new ATOM 0 HD2 PHE A 80 4.937 -12.553 5.834 1.00 0.00 H new ATOM 0 HE1 PHE A 80 9.619 -11.409 6.822 1.00 0.00 H new ATOM 0 HE2 PHE A 80 6.556 -14.333 6.328 1.00 0.00 H new ATOM 0 HZ PHE A 80 8.900 -13.764 6.824 1.00 0.00 H new ATOM 1272 N SER A 81 6.420 -7.204 4.170 1.00 0.00 N ATOM 1273 CA SER A 81 7.505 -6.248 3.985 1.00 0.00 C ATOM 1274 C SER A 81 7.229 -4.950 4.737 1.00 0.00 C ATOM 1275 O SER A 81 6.084 -4.641 5.065 1.00 0.00 O ATOM 1276 CB SER A 81 7.698 -5.955 2.497 1.00 0.00 C ATOM 1277 OG SER A 81 8.543 -6.918 1.891 1.00 0.00 O ATOM 0 H SER A 81 5.514 -6.781 4.374 1.00 0.00 H new ATOM 0 HA SER A 81 8.416 -6.689 4.388 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.730 -5.950 1.996 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.127 -4.961 2.372 1.00 0.00 H new ATOM 0 HG SER A 81 8.513 -7.750 2.407 1.00 0.00 H new ATOM 1283 N LYS A 82 8.288 -4.189 4.999 1.00 0.00 N ATOM 1284 CA LYS A 82 8.161 -2.917 5.703 1.00 0.00 C ATOM 1285 C LYS A 82 7.753 -1.814 4.734 1.00 0.00 C ATOM 1286 O LYS A 82 8.078 -1.869 3.548 1.00 0.00 O ATOM 1287 CB LYS A 82 9.481 -2.553 6.387 1.00 0.00 C ATOM 1288 CG LYS A 82 9.333 -1.492 7.466 1.00 0.00 C ATOM 1289 CD LYS A 82 10.125 -1.850 8.713 1.00 0.00 C ATOM 1290 CE LYS A 82 10.825 -0.634 9.298 1.00 0.00 C ATOM 1291 NZ LYS A 82 12.261 -0.579 8.906 1.00 0.00 N ATOM 0 H LYS A 82 9.243 -4.431 4.735 1.00 0.00 H new ATOM 0 HA LYS A 82 7.388 -3.019 6.465 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.912 -3.451 6.829 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.185 -2.199 5.634 1.00 0.00 H new ATOM 0 HG2 LYS A 82 9.673 -0.531 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.280 -1.378 7.723 1.00 0.00 H new ATOM 0 HD2 LYS A 82 9.456 -2.280 9.459 1.00 0.00 H new ATOM 0 HD3 LYS A 82 10.863 -2.614 8.469 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.322 0.272 8.961 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.746 -0.657 10.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 12.703 0.264 9.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 12.748 -1.432 9.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.336 -0.531 7.870 1.00 0.00 H new ATOM 1305 N PHE A 83 7.029 -0.818 5.235 1.00 0.00 N ATOM 1306 CA PHE A 83 6.574 0.282 4.394 1.00 0.00 C ATOM 1307 C PHE A 83 7.136 1.618 4.851 1.00 0.00 C ATOM 1308 O PHE A 83 6.922 2.053 5.982 1.00 0.00 O ATOM 1309 CB PHE A 83 5.046 0.340 4.382 1.00 0.00 C ATOM 1310 CG PHE A 83 4.397 -0.994 4.154 1.00 0.00 C ATOM 1311 CD1 PHE A 83 4.446 -1.600 2.909 1.00 0.00 C ATOM 1312 CD2 PHE A 83 3.737 -1.644 5.186 1.00 0.00 C ATOM 1313 CE1 PHE A 83 3.849 -2.827 2.696 1.00 0.00 C ATOM 1314 CE2 PHE A 83 3.139 -2.872 4.979 1.00 0.00 C ATOM 1315 CZ PHE A 83 3.194 -3.465 3.732 1.00 0.00 C ATOM 0 H PHE A 83 6.747 -0.750 6.213 1.00 0.00 H new ATOM 0 HA PHE A 83 6.942 0.094 3.385 1.00 0.00 H new ATOM 0 HB2 PHE A 83 4.698 0.746 5.332 1.00 0.00 H new ATOM 0 HB3 PHE A 83 4.723 1.030 3.603 1.00 0.00 H new ATOM 0 HD1 PHE A 83 4.957 -1.107 2.095 1.00 0.00 H new ATOM 0 HD2 PHE A 83 3.690 -1.185 6.162 1.00 0.00 H new ATOM 0 HE1 PHE A 83 3.894 -3.288 1.720 1.00 0.00 H new ATOM 0 HE2 PHE A 83 2.629 -3.368 5.791 1.00 0.00 H new ATOM 0 HZ PHE A 83 2.726 -4.425 3.568 1.00 0.00 H new ATOM 1325 N LYS A 84 7.832 2.271 3.933 1.00 0.00 N ATOM 1326 CA LYS A 84 8.413 3.578 4.177 1.00 0.00 C ATOM 1327 C LYS A 84 8.064 4.485 3.005 1.00 0.00 C ATOM 1328 O LYS A 84 8.470 4.224 1.874 1.00 0.00 O ATOM 1329 CB LYS A 84 9.933 3.467 4.366 1.00 0.00 C ATOM 1330 CG LYS A 84 10.750 4.285 3.376 1.00 0.00 C ATOM 1331 CD LYS A 84 12.213 4.353 3.783 1.00 0.00 C ATOM 1332 CE LYS A 84 12.442 5.397 4.864 1.00 0.00 C ATOM 1333 NZ LYS A 84 11.940 6.738 4.458 1.00 0.00 N ATOM 0 H LYS A 84 8.009 1.907 2.997 1.00 0.00 H new ATOM 0 HA LYS A 84 8.007 4.003 5.095 1.00 0.00 H new ATOM 0 HB2 LYS A 84 10.186 3.785 5.378 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.222 2.420 4.280 1.00 0.00 H new ATOM 0 HG2 LYS A 84 10.668 3.844 2.383 1.00 0.00 H new ATOM 0 HG3 LYS A 84 10.342 5.294 3.312 1.00 0.00 H new ATOM 0 HD2 LYS A 84 12.537 3.377 4.144 1.00 0.00 H new ATOM 0 HD3 LYS A 84 12.824 4.590 2.912 1.00 0.00 H new ATOM 0 HE2 LYS A 84 11.942 5.085 5.781 1.00 0.00 H new ATOM 0 HE3 LYS A 84 13.507 5.461 5.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 12.641 7.463 4.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 11.783 6.753 3.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 11.044 6.936 4.948 1.00 0.00 H new ATOM 1347 N VAL A 85 7.290 5.524 3.267 1.00 0.00 N ATOM 1348 CA VAL A 85 6.870 6.433 2.209 1.00 0.00 C ATOM 1349 C VAL A 85 7.521 7.801 2.338 1.00 0.00 C ATOM 1350 O VAL A 85 7.843 8.259 3.432 1.00 0.00 O ATOM 1351 CB VAL A 85 5.324 6.567 2.143 1.00 0.00 C ATOM 1352 CG1 VAL A 85 4.670 5.944 3.360 1.00 0.00 C ATOM 1353 CG2 VAL A 85 4.864 8.009 2.001 1.00 0.00 C ATOM 0 H VAL A 85 6.940 5.760 4.196 1.00 0.00 H new ATOM 0 HA VAL A 85 7.210 5.992 1.272 1.00 0.00 H new ATOM 0 HB VAL A 85 5.013 6.030 1.247 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.588 6.052 3.287 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.926 4.886 3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 85 5.025 6.445 4.260 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.775 8.041 1.960 1.00 0.00 H new ATOM 0 HG22 VAL A 85 5.212 8.588 2.856 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.274 8.433 1.085 1.00 0.00 H new ATOM 1363 N LYS A 86 7.718 8.430 1.191 1.00 0.00 N ATOM 1364 CA LYS A 86 8.330 9.742 1.111 1.00 0.00 C ATOM 1365 C LYS A 86 7.485 10.667 0.238 1.00 0.00 C ATOM 1366 O LYS A 86 7.306 10.398 -0.937 1.00 0.00 O ATOM 1367 CB LYS A 86 9.725 9.597 0.505 1.00 0.00 C ATOM 1368 CG LYS A 86 10.749 10.563 1.081 1.00 0.00 C ATOM 1369 CD LYS A 86 12.111 9.907 1.228 1.00 0.00 C ATOM 1370 CE LYS A 86 12.860 10.445 2.437 1.00 0.00 C ATOM 1371 NZ LYS A 86 13.672 11.646 2.099 1.00 0.00 N ATOM 0 H LYS A 86 7.456 8.041 0.285 1.00 0.00 H new ATOM 0 HA LYS A 86 8.398 10.173 2.110 1.00 0.00 H new ATOM 0 HB2 LYS A 86 10.074 8.576 0.661 1.00 0.00 H new ATOM 0 HB3 LYS A 86 9.661 9.750 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS A 86 10.832 11.436 0.433 1.00 0.00 H new ATOM 0 HG3 LYS A 86 10.408 10.919 2.053 1.00 0.00 H new ATOM 0 HD2 LYS A 86 11.988 8.828 1.325 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.699 10.081 0.327 1.00 0.00 H new ATOM 0 HE2 LYS A 86 12.148 10.698 3.222 1.00 0.00 H new ATOM 0 HE3 LYS A 86 13.511 9.667 2.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 14.167 11.981 2.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 14.369 11.399 1.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 13.048 12.398 1.742 1.00 0.00 H new ATOM 1385 N ILE A 87 6.980 11.761 0.789 1.00 0.00 N ATOM 1386 CA ILE A 87 6.177 12.692 -0.005 1.00 0.00 C ATOM 1387 C ILE A 87 6.778 14.091 0.050 1.00 0.00 C ATOM 1388 O ILE A 87 7.277 14.523 1.090 1.00 0.00 O ATOM 1389 CB ILE A 87 4.701 12.722 0.455 1.00 0.00 C ATOM 1390 CG1 ILE A 87 3.940 13.899 -0.181 1.00 0.00 C ATOM 1391 CG2 ILE A 87 4.630 12.780 1.966 1.00 0.00 C ATOM 1392 CD1 ILE A 87 2.595 14.185 0.462 1.00 0.00 C ATOM 0 H ILE A 87 7.106 12.027 1.766 1.00 0.00 H new ATOM 0 HA ILE A 87 6.190 12.337 -1.036 1.00 0.00 H new ATOM 0 HB ILE A 87 4.217 11.805 0.119 1.00 0.00 H new ATOM 0 HG12 ILE A 87 4.559 14.794 -0.119 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.788 13.690 -1.240 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.587 12.801 2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 87 5.119 11.901 2.387 1.00 0.00 H new ATOM 0 HG23 ILE A 87 5.134 13.680 2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 87 2.122 15.028 -0.043 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.956 13.306 0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 87 2.739 14.427 1.515 1.00 0.00 H new ATOM 1404 N ASP A 88 6.753 14.784 -1.083 1.00 0.00 N ATOM 1405 CA ASP A 88 7.319 16.115 -1.168 1.00 0.00 C ATOM 1406 C ASP A 88 6.372 17.084 -1.865 1.00 0.00 C ATOM 1407 O ASP A 88 5.996 16.872 -3.015 1.00 0.00 O ATOM 1408 CB ASP A 88 8.633 16.037 -1.940 1.00 0.00 C ATOM 1409 CG ASP A 88 9.829 16.433 -1.097 1.00 0.00 C ATOM 1410 OD1 ASP A 88 9.643 17.186 -0.117 1.00 0.00 O ATOM 1411 OD2 ASP A 88 10.952 15.988 -1.414 1.00 0.00 O ATOM 0 H ASP A 88 6.345 14.441 -1.953 1.00 0.00 H new ATOM 0 HA ASP A 88 7.488 16.488 -0.158 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.774 15.021 -2.309 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.577 16.688 -2.812 1.00 0.00 H new ATOM 1416 N GLU A 89 6.016 18.163 -1.178 1.00 0.00 N ATOM 1417 CA GLU A 89 5.143 19.174 -1.759 1.00 0.00 C ATOM 1418 C GLU A 89 5.967 20.122 -2.606 1.00 0.00 C ATOM 1419 O GLU A 89 6.812 20.858 -2.096 1.00 0.00 O ATOM 1420 CB GLU A 89 4.405 19.945 -0.662 1.00 0.00 C ATOM 1421 CG GLU A 89 2.983 19.460 -0.430 1.00 0.00 C ATOM 1422 CD GLU A 89 2.395 19.980 0.867 1.00 0.00 C ATOM 1423 OE1 GLU A 89 2.123 21.196 0.951 1.00 0.00 O ATOM 1424 OE2 GLU A 89 2.206 19.171 1.800 1.00 0.00 O ATOM 0 H GLU A 89 6.317 18.359 -0.223 1.00 0.00 H new ATOM 0 HA GLU A 89 4.398 18.683 -2.386 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.965 19.861 0.269 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.381 21.002 -0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.355 19.777 -1.262 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.972 18.370 -0.419 1.00 0.00 H new ATOM 1431 N LYS A 90 5.721 20.089 -3.902 1.00 0.00 N ATOM 1432 CA LYS A 90 6.445 20.935 -4.829 1.00 0.00 C ATOM 1433 C LYS A 90 5.707 22.228 -5.065 1.00 0.00 C ATOM 1434 O LYS A 90 4.760 22.556 -4.349 1.00 0.00 O ATOM 1435 CB LYS A 90 6.702 20.207 -6.154 1.00 0.00 C ATOM 1436 CG LYS A 90 7.569 18.968 -6.001 1.00 0.00 C ATOM 1437 CD LYS A 90 8.673 19.196 -4.984 1.00 0.00 C ATOM 1438 CE LYS A 90 9.980 18.555 -5.422 1.00 0.00 C ATOM 1439 NZ LYS A 90 10.810 19.486 -6.235 1.00 0.00 N ATOM 0 H LYS A 90 5.024 19.484 -4.336 1.00 0.00 H new ATOM 0 HA LYS A 90 7.411 21.171 -4.382 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.747 19.921 -6.595 1.00 0.00 H new ATOM 0 HB3 LYS A 90 7.182 20.894 -6.851 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.952 18.125 -5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 90 8.006 18.705 -6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 90 8.822 20.266 -4.842 1.00 0.00 H new ATOM 0 HD3 LYS A 90 8.371 18.786 -4.020 1.00 0.00 H new ATOM 0 HE2 LYS A 90 10.543 18.241 -4.543 1.00 0.00 H new ATOM 0 HE3 LYS A 90 9.767 17.657 -6.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 11.692 19.011 -6.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 10.284 19.766 -7.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 11.035 20.332 -5.673 1.00 0.00 H new ATOM 1453 N ASP A 91 6.160 22.976 -6.052 1.00 0.00 N ATOM 1454 CA ASP A 91 5.557 24.252 -6.359 1.00 0.00 C ATOM 1455 C ASP A 91 4.065 24.133 -6.703 1.00 0.00 C ATOM 1456 O ASP A 91 3.443 25.117 -7.099 1.00 0.00 O ATOM 1457 CB ASP A 91 6.304 24.924 -7.511 1.00 0.00 C ATOM 1458 CG ASP A 91 6.727 26.341 -7.178 1.00 0.00 C ATOM 1459 OD1 ASP A 91 7.432 26.529 -6.164 1.00 0.00 O ATOM 1460 OD2 ASP A 91 6.352 27.265 -7.931 1.00 0.00 O ATOM 0 H ASP A 91 6.943 22.720 -6.653 1.00 0.00 H new ATOM 0 HA ASP A 91 5.634 24.864 -5.460 1.00 0.00 H new ATOM 0 HB2 ASP A 91 7.186 24.334 -7.762 1.00 0.00 H new ATOM 0 HB3 ASP A 91 5.667 24.936 -8.395 1.00 0.00 H new ATOM 1465 N ASP A 92 3.489 22.937 -6.554 1.00 0.00 N ATOM 1466 CA ASP A 92 2.075 22.725 -6.857 1.00 0.00 C ATOM 1467 C ASP A 92 1.739 21.242 -6.784 1.00 0.00 C ATOM 1468 O ASP A 92 0.666 20.855 -6.320 1.00 0.00 O ATOM 1469 CB ASP A 92 1.730 23.267 -8.248 1.00 0.00 C ATOM 1470 CG ASP A 92 2.764 22.893 -9.291 1.00 0.00 C ATOM 1471 OD1 ASP A 92 2.684 21.769 -9.830 1.00 0.00 O ATOM 1472 OD2 ASP A 92 3.655 23.723 -9.568 1.00 0.00 O ATOM 0 H ASP A 92 3.980 22.105 -6.227 1.00 0.00 H new ATOM 0 HA ASP A 92 1.484 23.264 -6.117 1.00 0.00 H new ATOM 0 HB2 ASP A 92 0.756 22.883 -8.553 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.644 24.353 -8.200 1.00 0.00 H new ATOM 1477 N GLY A 93 2.674 20.419 -7.238 1.00 0.00 N ATOM 1478 CA GLY A 93 2.481 18.982 -7.212 1.00 0.00 C ATOM 1479 C GLY A 93 3.360 18.324 -6.172 1.00 0.00 C ATOM 1480 O GLY A 93 4.254 18.964 -5.625 1.00 0.00 O ATOM 0 H GLY A 93 3.567 20.722 -7.626 1.00 0.00 H new ATOM 0 HA2 GLY A 93 1.435 18.758 -7.001 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.704 18.566 -8.194 1.00 0.00 H new ATOM 1484 N LEU A 94 3.116 17.054 -5.881 1.00 0.00 N ATOM 1485 CA LEU A 94 3.918 16.356 -4.887 1.00 0.00 C ATOM 1486 C LEU A 94 4.305 14.955 -5.347 1.00 0.00 C ATOM 1487 O LEU A 94 3.482 14.215 -5.883 1.00 0.00 O ATOM 1488 CB LEU A 94 3.180 16.290 -3.549 1.00 0.00 C ATOM 1489 CG LEU A 94 1.711 15.872 -3.630 1.00 0.00 C ATOM 1490 CD1 LEU A 94 1.197 15.494 -2.251 1.00 0.00 C ATOM 1491 CD2 LEU A 94 0.868 16.991 -4.225 1.00 0.00 C ATOM 0 H LEU A 94 2.381 16.493 -6.312 1.00 0.00 H new ATOM 0 HA LEU A 94 4.838 16.926 -4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.704 15.590 -2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.236 17.269 -3.074 1.00 0.00 H new ATOM 0 HG LEU A 94 1.633 15.002 -4.282 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.150 15.198 -2.321 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.783 14.663 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.288 16.349 -1.582 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.174 16.675 -4.274 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.948 17.879 -3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.225 17.221 -5.229 1.00 0.00 H new ATOM 1503 N HIS A 95 5.567 14.598 -5.120 1.00 0.00 N ATOM 1504 CA HIS A 95 6.076 13.285 -5.498 1.00 0.00 C ATOM 1505 C HIS A 95 6.245 12.400 -4.268 1.00 0.00 C ATOM 1506 O HIS A 95 6.614 12.879 -3.195 1.00 0.00 O ATOM 1507 CB HIS A 95 7.410 13.420 -6.239 1.00 0.00 C ATOM 1508 CG HIS A 95 8.529 13.923 -5.380 1.00 0.00 C ATOM 1509 ND1 HIS A 95 9.306 13.283 -4.474 1.00 0.00 N flip ATOM 1510 CD2 HIS A 95 8.965 15.231 -5.398 1.00 0.00 C flip ATOM 1511 CE1 HIS A 95 10.187 14.207 -3.968 1.00 0.00 C flip ATOM 1512 NE2 HIS A 95 9.961 15.374 -4.542 1.00 0.00 N flip ATOM 0 H HIS A 95 6.257 15.203 -4.675 1.00 0.00 H new ATOM 0 HA HIS A 95 5.352 12.817 -6.165 1.00 0.00 H new ATOM 0 HB2 HIS A 95 7.687 12.449 -6.649 1.00 0.00 H new ATOM 0 HB3 HIS A 95 7.279 14.097 -7.083 1.00 0.00 H new ATOM 0 HD1 HIS A 95 9.248 12.298 -4.216 1.00 0.00 H new ATOM 0 HD2 HIS A 95 8.556 16.017 -6.016 1.00 0.00 H new ATOM 0 HE1 HIS A 95 10.942 14.011 -3.221 1.00 0.00 H new ATOM 1521 N LEU A 96 5.964 11.111 -4.425 1.00 0.00 N ATOM 1522 CA LEU A 96 6.080 10.171 -3.320 1.00 0.00 C ATOM 1523 C LEU A 96 7.175 9.135 -3.575 1.00 0.00 C ATOM 1524 O LEU A 96 7.335 8.646 -4.690 1.00 0.00 O ATOM 1525 CB LEU A 96 4.741 9.467 -3.079 1.00 0.00 C ATOM 1526 CG LEU A 96 4.680 8.593 -1.825 1.00 0.00 C ATOM 1527 CD1 LEU A 96 3.234 8.347 -1.420 1.00 0.00 C ATOM 1528 CD2 LEU A 96 5.403 7.274 -2.055 1.00 0.00 C ATOM 0 H LEU A 96 5.655 10.696 -5.304 1.00 0.00 H new ATOM 0 HA LEU A 96 6.355 10.739 -2.431 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.958 10.223 -3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.514 8.847 -3.946 1.00 0.00 H new ATOM 0 HG LEU A 96 5.181 9.120 -1.013 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.207 7.724 -0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.747 9.300 -1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.710 7.841 -2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.348 6.667 -1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.932 6.740 -2.880 1.00 0.00 H new ATOM 0 HD23 LEU A 96 6.447 7.469 -2.298 1.00 0.00 H new ATOM 1540 N THR A 97 7.914 8.792 -2.525 1.00 0.00 N ATOM 1541 CA THR A 97 8.973 7.796 -2.619 1.00 0.00 C ATOM 1542 C THR A 97 8.733 6.706 -1.582 1.00 0.00 C ATOM 1543 O THR A 97 8.689 6.973 -0.385 1.00 0.00 O ATOM 1544 CB THR A 97 10.349 8.434 -2.419 1.00 0.00 C ATOM 1545 OG1 THR A 97 10.296 9.828 -2.668 1.00 0.00 O ATOM 1546 CG2 THR A 97 11.416 7.848 -3.317 1.00 0.00 C ATOM 0 H THR A 97 7.797 9.192 -1.594 1.00 0.00 H new ATOM 0 HA THR A 97 8.956 7.357 -3.617 1.00 0.00 H new ATOM 0 HB THR A 97 10.616 8.228 -1.382 1.00 0.00 H new ATOM 0 HG1 THR A 97 11.185 10.218 -2.533 1.00 0.00 H new ATOM 0 HG21 THR A 97 12.367 8.345 -3.124 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.516 6.782 -3.115 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.135 7.995 -4.360 1.00 0.00 H new ATOM 1554 N GLY A 98 8.558 5.489 -2.049 1.00 0.00 N ATOM 1555 CA GLY A 98 8.294 4.377 -1.151 1.00 0.00 C ATOM 1556 C GLY A 98 9.370 3.310 -1.178 1.00 0.00 C ATOM 1557 O GLY A 98 10.002 3.079 -2.207 1.00 0.00 O ATOM 0 H GLY A 98 8.593 5.241 -3.038 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.196 4.757 -0.134 1.00 0.00 H new ATOM 0 HA3 GLY A 98 7.338 3.925 -1.416 1.00 0.00 H new ATOM 1561 N THR A 99 9.577 2.660 -0.037 1.00 0.00 N ATOM 1562 CA THR A 99 10.584 1.612 0.081 1.00 0.00 C ATOM 1563 C THR A 99 9.983 0.330 0.652 1.00 0.00 C ATOM 1564 O THR A 99 9.132 0.377 1.541 1.00 0.00 O ATOM 1565 CB THR A 99 11.728 2.078 0.977 1.00 0.00 C ATOM 1566 OG1 THR A 99 12.084 3.417 0.678 1.00 0.00 O ATOM 1567 CG2 THR A 99 12.974 1.228 0.850 1.00 0.00 C ATOM 0 H THR A 99 9.058 2.842 0.822 1.00 0.00 H new ATOM 0 HA THR A 99 10.964 1.403 -0.919 1.00 0.00 H new ATOM 0 HB THR A 99 11.353 1.988 1.996 1.00 0.00 H new ATOM 0 HG1 THR A 99 13.037 3.552 0.865 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.747 1.615 1.514 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.742 0.199 1.124 1.00 0.00 H new ATOM 0 HG23 THR A 99 13.331 1.258 -0.179 1.00 0.00 H new ATOM 1575 N ALA A 100 10.434 -0.815 0.145 1.00 0.00 N ATOM 1576 CA ALA A 100 9.940 -2.103 0.624 1.00 0.00 C ATOM 1577 C ALA A 100 11.091 -3.067 0.909 1.00 0.00 C ATOM 1578 O ALA A 100 11.997 -3.231 0.091 1.00 0.00 O ATOM 1579 CB ALA A 100 8.981 -2.707 -0.392 1.00 0.00 C ATOM 0 H ALA A 100 11.136 -0.877 -0.592 1.00 0.00 H new ATOM 0 HA ALA A 100 9.406 -1.935 1.559 1.00 0.00 H new ATOM 0 HB1 ALA A 100 8.619 -3.667 -0.024 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.137 -2.034 -0.541 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.500 -2.853 -1.340 1.00 0.00 H new ATOM 1585 N MET A 101 11.039 -3.704 2.075 1.00 0.00 N ATOM 1586 CA MET A 101 12.064 -4.662 2.488 1.00 0.00 C ATOM 1587 C MET A 101 11.424 -5.950 2.984 1.00 0.00 C ATOM 1588 O MET A 101 10.267 -5.956 3.404 1.00 0.00 O ATOM 1589 CB MET A 101 12.947 -4.063 3.584 1.00 0.00 C ATOM 1590 CG MET A 101 13.403 -2.644 3.292 1.00 0.00 C ATOM 1591 SD MET A 101 14.845 -2.165 4.262 1.00 0.00 S ATOM 1592 CE MET A 101 14.329 -0.561 4.866 1.00 0.00 C ATOM 0 H MET A 101 10.292 -3.573 2.757 1.00 0.00 H new ATOM 0 HA MET A 101 12.684 -4.890 1.621 1.00 0.00 H new ATOM 0 HB2 MET A 101 12.399 -4.073 4.526 1.00 0.00 H new ATOM 0 HB3 MET A 101 13.824 -4.697 3.719 1.00 0.00 H new ATOM 0 HG2 MET A 101 13.637 -2.553 2.231 1.00 0.00 H new ATOM 0 HG3 MET A 101 12.585 -1.954 3.499 1.00 0.00 H new ATOM 0 HE1 MET A 101 15.118 -0.134 5.485 1.00 0.00 H new ATOM 0 HE2 MET A 101 14.133 0.100 4.022 1.00 0.00 H new ATOM 0 HE3 MET A 101 13.421 -0.670 5.460 1.00 0.00 H new ATOM 1602 N GLY A 102 12.171 -7.044 2.915 1.00 0.00 N ATOM 1603 CA GLY A 102 11.638 -8.323 3.345 1.00 0.00 C ATOM 1604 C GLY A 102 10.840 -8.960 2.236 1.00 0.00 C ATOM 1605 O GLY A 102 9.688 -9.348 2.422 1.00 0.00 O ATOM 0 H GLY A 102 13.131 -7.070 2.571 1.00 0.00 H new ATOM 0 HA2 GLY A 102 12.454 -8.983 3.640 1.00 0.00 H new ATOM 0 HA3 GLY A 102 11.007 -8.184 4.223 1.00 0.00 H new ATOM 1609 N GLU A 103 11.458 -9.032 1.070 1.00 0.00 N ATOM 1610 CA GLU A 103 10.814 -9.581 -0.106 1.00 0.00 C ATOM 1611 C GLU A 103 11.104 -11.076 -0.262 1.00 0.00 C ATOM 1612 O GLU A 103 12.250 -11.483 -0.454 1.00 0.00 O ATOM 1613 CB GLU A 103 11.269 -8.777 -1.334 1.00 0.00 C ATOM 1614 CG GLU A 103 12.015 -9.586 -2.390 1.00 0.00 C ATOM 1615 CD GLU A 103 12.360 -8.765 -3.618 1.00 0.00 C ATOM 1616 OE1 GLU A 103 11.844 -7.635 -3.742 1.00 0.00 O ATOM 1617 OE2 GLU A 103 13.147 -9.253 -4.455 1.00 0.00 O ATOM 0 H GLU A 103 12.414 -8.713 0.914 1.00 0.00 H new ATOM 0 HA GLU A 103 9.732 -9.494 -0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 103 10.393 -8.322 -1.797 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.912 -7.963 -0.999 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.931 -9.986 -1.956 1.00 0.00 H new ATOM 0 HG3 GLU A 103 11.405 -10.439 -2.687 1.00 0.00 H new ATOM 1624 N GLU A 104 10.047 -11.884 -0.174 1.00 0.00 N ATOM 1625 CA GLU A 104 10.163 -13.336 -0.303 1.00 0.00 C ATOM 1626 C GLU A 104 8.838 -14.015 0.040 1.00 0.00 C ATOM 1627 O GLU A 104 8.388 -13.971 1.186 1.00 0.00 O ATOM 1628 CB GLU A 104 11.275 -13.872 0.606 1.00 0.00 C ATOM 1629 CG GLU A 104 12.322 -14.691 -0.132 1.00 0.00 C ATOM 1630 CD GLU A 104 12.369 -16.134 0.331 1.00 0.00 C ATOM 1631 OE1 GLU A 104 12.904 -16.388 1.431 1.00 0.00 O ATOM 1632 OE2 GLU A 104 11.871 -17.011 -0.408 1.00 0.00 O ATOM 0 H GLU A 104 9.095 -11.554 -0.013 1.00 0.00 H new ATOM 0 HA GLU A 104 10.416 -13.563 -1.339 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.764 -13.033 1.101 1.00 0.00 H new ATOM 0 HB3 GLU A 104 10.829 -14.487 1.388 1.00 0.00 H new ATOM 0 HG2 GLU A 104 12.112 -14.663 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.302 -14.235 0.012 1.00 0.00 H new ATOM 1639 N ILE A 105 8.215 -14.642 -0.955 1.00 0.00 N ATOM 1640 CA ILE A 105 6.941 -15.327 -0.749 1.00 0.00 C ATOM 1641 C ILE A 105 7.161 -16.774 -0.310 1.00 0.00 C ATOM 1642 O ILE A 105 8.024 -17.472 -0.842 1.00 0.00 O ATOM 1643 CB ILE A 105 6.062 -15.290 -2.029 1.00 0.00 C ATOM 1644 CG1 ILE A 105 4.970 -14.226 -1.889 1.00 0.00 C ATOM 1645 CG2 ILE A 105 5.434 -16.650 -2.315 1.00 0.00 C ATOM 1646 CD1 ILE A 105 3.962 -14.534 -0.803 1.00 0.00 C ATOM 0 H ILE A 105 8.570 -14.690 -1.910 1.00 0.00 H new ATOM 0 HA ILE A 105 6.415 -14.796 0.044 1.00 0.00 H new ATOM 0 HB ILE A 105 6.708 -15.035 -2.870 1.00 0.00 H new ATOM 0 HG12 ILE A 105 5.436 -13.264 -1.678 1.00 0.00 H new ATOM 0 HG13 ILE A 105 4.448 -14.126 -2.840 1.00 0.00 H new ATOM 0 HG21 ILE A 105 4.826 -16.587 -3.217 1.00 0.00 H new ATOM 0 HG22 ILE A 105 6.220 -17.391 -2.458 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.806 -16.945 -1.474 1.00 0.00 H new ATOM 0 HD11 ILE A 105 3.218 -13.738 -0.760 1.00 0.00 H new ATOM 0 HD12 ILE A 105 3.468 -15.481 -1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 105 4.472 -14.605 0.157 1.00 0.00 H new ATOM 1658 N LYS A 106 6.364 -17.218 0.658 1.00 0.00 N ATOM 1659 CA LYS A 106 6.458 -18.581 1.168 1.00 0.00 C ATOM 1660 C LYS A 106 5.128 -19.310 1.003 1.00 0.00 C ATOM 1661 O LYS A 106 4.202 -18.797 0.375 1.00 0.00 O ATOM 1662 CB LYS A 106 6.878 -18.575 2.639 1.00 0.00 C ATOM 1663 CG LYS A 106 7.929 -19.622 2.976 1.00 0.00 C ATOM 1664 CD LYS A 106 7.412 -20.634 3.986 1.00 0.00 C ATOM 1665 CE LYS A 106 8.011 -20.405 5.364 1.00 0.00 C ATOM 1666 NZ LYS A 106 7.351 -21.241 6.405 1.00 0.00 N ATOM 0 H LYS A 106 5.644 -16.651 1.106 1.00 0.00 H new ATOM 0 HA LYS A 106 7.217 -19.109 0.590 1.00 0.00 H new ATOM 0 HB2 LYS A 106 7.265 -17.588 2.894 1.00 0.00 H new ATOM 0 HB3 LYS A 106 5.998 -18.742 3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 106 8.232 -20.139 2.066 1.00 0.00 H new ATOM 0 HG3 LYS A 106 8.817 -19.131 3.375 1.00 0.00 H new ATOM 0 HD2 LYS A 106 6.326 -20.567 4.045 1.00 0.00 H new ATOM 0 HD3 LYS A 106 7.652 -21.642 3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 106 9.077 -20.632 5.338 1.00 0.00 H new ATOM 0 HE3 LYS A 106 7.916 -19.352 5.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 7.789 -21.054 7.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 6.339 -21.007 6.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.464 -22.247 6.165 1.00 0.00 H new ATOM 1680 N GLU A 107 5.040 -20.512 1.565 1.00 0.00 N ATOM 1681 CA GLU A 107 3.823 -21.313 1.470 1.00 0.00 C ATOM 1682 C GLU A 107 2.912 -21.090 2.676 1.00 0.00 C ATOM 1683 O GLU A 107 3.251 -21.461 3.800 1.00 0.00 O ATOM 1684 CB GLU A 107 4.172 -22.796 1.352 1.00 0.00 C ATOM 1685 CG GLU A 107 3.150 -23.601 0.567 1.00 0.00 C ATOM 1686 CD GLU A 107 3.753 -24.825 -0.094 1.00 0.00 C ATOM 1687 OE1 GLU A 107 4.859 -24.708 -0.662 1.00 0.00 O ATOM 1688 OE2 GLU A 107 3.119 -25.900 -0.044 1.00 0.00 O ATOM 0 H GLU A 107 5.795 -20.953 2.090 1.00 0.00 H new ATOM 0 HA GLU A 107 3.287 -20.995 0.576 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.146 -22.894 0.872 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.265 -23.219 2.352 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.347 -23.912 1.236 1.00 0.00 H new ATOM 0 HG3 GLU A 107 2.701 -22.965 -0.196 1.00 0.00 H new ATOM 1695 N GLY A 108 1.749 -20.491 2.428 1.00 0.00 N ATOM 1696 CA GLY A 108 0.791 -20.235 3.493 1.00 0.00 C ATOM 1697 C GLY A 108 1.417 -19.601 4.722 1.00 0.00 C ATOM 1698 O GLY A 108 1.098 -19.976 5.850 1.00 0.00 O ATOM 0 H GLY A 108 1.452 -20.177 1.504 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.005 -19.581 3.116 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.316 -21.173 3.779 1.00 0.00 H new ATOM 1702 N HIS A 109 2.307 -18.641 4.505 1.00 0.00 N ATOM 1703 CA HIS A 109 2.973 -17.956 5.608 1.00 0.00 C ATOM 1704 C HIS A 109 2.108 -16.823 6.152 1.00 0.00 C ATOM 1705 O HIS A 109 1.913 -15.805 5.488 1.00 0.00 O ATOM 1706 CB HIS A 109 4.325 -17.409 5.151 1.00 0.00 C ATOM 1707 CG HIS A 109 5.241 -17.052 6.281 1.00 0.00 C ATOM 1708 ND1 HIS A 109 4.806 -16.883 7.579 1.00 0.00 N ATOM 1709 CD2 HIS A 109 6.577 -16.831 6.302 1.00 0.00 C ATOM 1710 CE1 HIS A 109 5.834 -16.573 8.349 1.00 0.00 C ATOM 1711 NE2 HIS A 109 6.920 -16.537 7.599 1.00 0.00 N ATOM 0 H HIS A 109 2.585 -18.319 3.578 1.00 0.00 H new ATOM 0 HA HIS A 109 3.132 -18.679 6.408 1.00 0.00 H new ATOM 0 HB2 HIS A 109 4.813 -18.151 4.520 1.00 0.00 H new ATOM 0 HB3 HIS A 109 4.160 -16.525 4.535 1.00 0.00 H new ATOM 0 HD2 HIS A 109 7.248 -16.877 5.457 1.00 0.00 H new ATOM 0 HE1 HIS A 109 5.793 -16.382 9.411 1.00 0.00 H new ATOM 0 HE2 HIS A 109 7.861 -16.325 7.929 1.00 0.00 H new ATOM 1720 N GLU A 110 1.594 -17.007 7.365 1.00 0.00 N ATOM 1721 CA GLU A 110 0.751 -15.999 8.000 1.00 0.00 C ATOM 1722 C GLU A 110 -0.458 -15.668 7.131 1.00 0.00 C ATOM 1723 O GLU A 110 -0.444 -14.696 6.375 1.00 0.00 O ATOM 1724 CB GLU A 110 1.559 -14.728 8.273 1.00 0.00 C ATOM 1725 CG GLU A 110 2.264 -14.731 9.618 1.00 0.00 C ATOM 1726 CD GLU A 110 1.366 -14.266 10.748 1.00 0.00 C ATOM 1727 OE1 GLU A 110 0.144 -14.514 10.676 1.00 0.00 O ATOM 1728 OE2 GLU A 110 1.884 -13.654 11.705 1.00 0.00 O ATOM 0 H GLU A 110 1.746 -17.844 7.927 1.00 0.00 H new ATOM 0 HA GLU A 110 0.393 -16.407 8.945 1.00 0.00 H new ATOM 0 HB2 GLU A 110 2.301 -14.603 7.484 1.00 0.00 H new ATOM 0 HB3 GLU A 110 0.893 -13.867 8.224 1.00 0.00 H new ATOM 0 HG2 GLU A 110 2.622 -15.738 9.834 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.141 -14.085 9.566 1.00 0.00 H new ATOM 1735 N ARG A 111 -1.503 -16.483 7.242 1.00 0.00 N ATOM 1736 CA ARG A 111 -2.718 -16.276 6.463 1.00 0.00 C ATOM 1737 C ARG A 111 -3.865 -15.794 7.347 1.00 0.00 C ATOM 1738 O ARG A 111 -4.480 -16.581 8.066 1.00 0.00 O ATOM 1739 CB ARG A 111 -3.118 -17.570 5.751 1.00 0.00 C ATOM 1740 CG ARG A 111 -2.033 -18.122 4.839 1.00 0.00 C ATOM 1741 CD ARG A 111 -2.416 -18.001 3.372 1.00 0.00 C ATOM 1742 NE ARG A 111 -1.334 -17.439 2.567 1.00 0.00 N ATOM 1743 CZ ARG A 111 -1.066 -16.137 2.488 1.00 0.00 C ATOM 1744 NH1 ARG A 111 -1.799 -15.260 3.164 1.00 0.00 N ATOM 1745 NH2 ARG A 111 -0.064 -15.711 1.734 1.00 0.00 N ATOM 0 H ARG A 111 -1.532 -17.292 7.863 1.00 0.00 H new ATOM 0 HA ARG A 111 -2.512 -15.506 5.720 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -3.371 -18.323 6.498 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -4.018 -17.389 5.163 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -1.101 -17.586 5.017 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -1.851 -19.169 5.082 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -2.682 -18.984 2.985 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -3.301 -17.372 3.279 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.749 -18.082 2.034 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -2.571 -15.583 3.747 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -1.590 -14.264 3.100 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.503 -16.380 1.213 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.141 -14.714 1.674 1.00 0.00 H new ATOM 1759 N ARG A 112 -4.152 -14.497 7.282 1.00 0.00 N ATOM 1760 CA ARG A 112 -5.230 -13.913 8.071 1.00 0.00 C ATOM 1761 C ARG A 112 -6.529 -13.896 7.270 1.00 0.00 C ATOM 1762 O ARG A 112 -7.536 -14.470 7.685 1.00 0.00 O ATOM 1763 CB ARG A 112 -4.863 -12.491 8.502 1.00 0.00 C ATOM 1764 CG ARG A 112 -4.319 -12.407 9.919 1.00 0.00 C ATOM 1765 CD ARG A 112 -3.388 -11.218 10.089 1.00 0.00 C ATOM 1766 NE ARG A 112 -3.387 -10.714 11.461 1.00 0.00 N ATOM 1767 CZ ARG A 112 -4.330 -9.919 11.960 1.00 0.00 C ATOM 1768 NH1 ARG A 112 -5.355 -9.538 11.207 1.00 0.00 N ATOM 1769 NH2 ARG A 112 -4.250 -9.504 13.217 1.00 0.00 N ATOM 0 H ARG A 112 -3.653 -13.832 6.691 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.375 -14.525 8.961 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -4.120 -12.091 7.812 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -5.746 -11.857 8.422 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.147 -12.326 10.623 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -3.785 -13.326 10.160 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.375 -11.508 9.809 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.691 -10.421 9.410 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.618 -10.988 12.072 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -5.423 -9.855 10.240 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -6.075 -8.928 11.596 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.466 -9.794 13.801 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -4.973 -8.895 13.600 1.00 0.00 H new ATOM 1783 N ASP A 113 -6.493 -13.238 6.116 1.00 0.00 N ATOM 1784 CA ASP A 113 -7.658 -13.147 5.244 1.00 0.00 C ATOM 1785 C ASP A 113 -7.314 -13.649 3.847 1.00 0.00 C ATOM 1786 O ASP A 113 -6.144 -13.700 3.470 1.00 0.00 O ATOM 1787 CB ASP A 113 -8.160 -11.705 5.176 1.00 0.00 C ATOM 1788 CG ASP A 113 -9.560 -11.605 4.600 1.00 0.00 C ATOM 1789 OD1 ASP A 113 -10.165 -12.661 4.317 1.00 0.00 O ATOM 1790 OD2 ASP A 113 -10.052 -10.469 4.430 1.00 0.00 O ATOM 0 H ASP A 113 -5.666 -12.758 5.762 1.00 0.00 H new ATOM 0 HA ASP A 113 -8.449 -13.773 5.657 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -8.150 -11.273 6.176 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.477 -11.114 4.567 1.00 0.00 H new ATOM 1795 N GLU A 114 -8.333 -14.027 3.082 1.00 0.00 N ATOM 1796 CA GLU A 114 -8.114 -14.531 1.731 1.00 0.00 C ATOM 1797 C GLU A 114 -8.610 -13.550 0.673 1.00 0.00 C ATOM 1798 O GLU A 114 -9.809 -13.452 0.411 1.00 0.00 O ATOM 1799 CB GLU A 114 -8.812 -15.880 1.553 1.00 0.00 C ATOM 1800 CG GLU A 114 -8.482 -16.567 0.238 1.00 0.00 C ATOM 1801 CD GLU A 114 -7.119 -17.230 0.252 1.00 0.00 C ATOM 1802 OE1 GLU A 114 -6.645 -17.589 1.351 1.00 0.00 O ATOM 1803 OE2 GLU A 114 -6.525 -17.389 -0.834 1.00 0.00 O ATOM 0 H GLU A 114 -9.311 -13.995 3.371 1.00 0.00 H new ATOM 0 HA GLU A 114 -7.039 -14.654 1.597 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -8.531 -16.536 2.377 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -9.890 -15.733 1.616 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -9.244 -17.316 0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -8.517 -15.835 -0.569 1.00 0.00 H new ATOM 1810 N VAL A 115 -7.671 -12.843 0.052 1.00 0.00 N ATOM 1811 CA VAL A 115 -7.992 -11.885 -1.000 1.00 0.00 C ATOM 1812 C VAL A 115 -7.468 -12.389 -2.342 1.00 0.00 C ATOM 1813 O VAL A 115 -6.258 -12.427 -2.568 1.00 0.00 O ATOM 1814 CB VAL A 115 -7.381 -10.500 -0.710 1.00 0.00 C ATOM 1815 CG1 VAL A 115 -7.830 -9.485 -1.751 1.00 0.00 C ATOM 1816 CG2 VAL A 115 -7.753 -10.040 0.692 1.00 0.00 C ATOM 0 H VAL A 115 -6.675 -12.917 0.261 1.00 0.00 H new ATOM 0 HA VAL A 115 -9.077 -11.785 -1.034 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.296 -10.582 -0.767 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -7.387 -8.514 -1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -7.508 -9.811 -2.740 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -8.917 -9.401 -1.732 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -7.314 -9.060 0.882 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -8.838 -9.974 0.778 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -7.374 -10.755 1.422 1.00 0.00 H new ATOM 1826 N LYS A 116 -8.377 -12.785 -3.225 1.00 0.00 N ATOM 1827 CA LYS A 116 -7.987 -13.296 -4.533 1.00 0.00 C ATOM 1828 C LYS A 116 -8.115 -12.227 -5.615 1.00 0.00 C ATOM 1829 O LYS A 116 -8.219 -12.548 -6.799 1.00 0.00 O ATOM 1830 CB LYS A 116 -8.836 -14.517 -4.900 1.00 0.00 C ATOM 1831 CG LYS A 116 -10.281 -14.180 -5.238 1.00 0.00 C ATOM 1832 CD LYS A 116 -10.644 -14.622 -6.648 1.00 0.00 C ATOM 1833 CE LYS A 116 -11.498 -13.583 -7.358 1.00 0.00 C ATOM 1834 NZ LYS A 116 -10.917 -13.188 -8.670 1.00 0.00 N ATOM 0 H LYS A 116 -9.383 -12.762 -3.061 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.939 -13.590 -4.474 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -8.381 -15.021 -5.753 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -8.822 -15.221 -4.068 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -10.945 -14.664 -4.522 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -10.437 -13.106 -5.141 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.733 -14.798 -7.220 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -11.182 -15.569 -6.606 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -12.501 -13.981 -7.511 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -11.598 -12.701 -6.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -11.529 -12.479 -9.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.970 -12.785 -8.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -10.846 -14.024 -9.284 1.00 0.00 H new ATOM 1848 N ALA A 117 -8.105 -10.959 -5.212 1.00 0.00 N ATOM 1849 CA ALA A 117 -8.221 -9.867 -6.172 1.00 0.00 C ATOM 1850 C ALA A 117 -8.128 -8.500 -5.502 1.00 0.00 C ATOM 1851 O ALA A 117 -8.932 -8.165 -4.632 1.00 0.00 O ATOM 1852 CB ALA A 117 -9.527 -9.982 -6.945 1.00 0.00 C ATOM 0 H ALA A 117 -8.019 -10.665 -4.239 1.00 0.00 H new ATOM 0 HA ALA A 117 -7.381 -9.951 -6.862 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -9.601 -9.161 -7.658 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.550 -10.931 -7.481 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -10.366 -9.936 -6.251 1.00 0.00 H new ATOM 1858 N VAL A 118 -7.153 -7.707 -5.935 1.00 0.00 N ATOM 1859 CA VAL A 118 -6.959 -6.362 -5.408 1.00 0.00 C ATOM 1860 C VAL A 118 -7.526 -5.341 -6.386 1.00 0.00 C ATOM 1861 O VAL A 118 -6.974 -5.121 -7.464 1.00 0.00 O ATOM 1862 CB VAL A 118 -5.463 -6.067 -5.152 1.00 0.00 C ATOM 1863 CG1 VAL A 118 -4.618 -6.482 -6.349 1.00 0.00 C ATOM 1864 CG2 VAL A 118 -5.244 -4.596 -4.821 1.00 0.00 C ATOM 0 H VAL A 118 -6.481 -7.976 -6.654 1.00 0.00 H new ATOM 0 HA VAL A 118 -7.484 -6.292 -4.456 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.148 -6.656 -4.291 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.569 -6.265 -6.147 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -4.740 -7.550 -6.528 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -4.939 -5.928 -7.231 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -4.183 -4.417 -4.646 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -5.583 -3.981 -5.655 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.809 -4.337 -3.926 1.00 0.00 H new ATOM 1874 N THR A 119 -8.640 -4.730 -6.009 1.00 0.00 N ATOM 1875 CA THR A 119 -9.292 -3.745 -6.859 1.00 0.00 C ATOM 1876 C THR A 119 -9.251 -2.357 -6.230 1.00 0.00 C ATOM 1877 O THR A 119 -9.659 -2.174 -5.084 1.00 0.00 O ATOM 1878 CB THR A 119 -10.743 -4.162 -7.124 1.00 0.00 C ATOM 1879 OG1 THR A 119 -11.275 -3.452 -8.229 1.00 0.00 O ATOM 1880 CG2 THR A 119 -11.665 -3.931 -5.944 1.00 0.00 C ATOM 0 H THR A 119 -9.111 -4.899 -5.120 1.00 0.00 H new ATOM 0 HA THR A 119 -8.751 -3.701 -7.804 1.00 0.00 H new ATOM 0 HB THR A 119 -10.700 -5.233 -7.323 1.00 0.00 H new ATOM 0 HG1 THR A 119 -12.201 -3.733 -8.383 1.00 0.00 H new ATOM 0 HG21 THR A 119 -12.675 -4.249 -6.204 1.00 0.00 H new ATOM 0 HG22 THR A 119 -11.312 -4.507 -5.088 1.00 0.00 H new ATOM 0 HG23 THR A 119 -11.672 -2.871 -5.690 1.00 0.00 H new ATOM 1888 N PHE A 120 -8.771 -1.381 -6.991 1.00 0.00 N ATOM 1889 CA PHE A 120 -8.701 -0.004 -6.510 1.00 0.00 C ATOM 1890 C PHE A 120 -10.107 0.570 -6.385 1.00 0.00 C ATOM 1891 O PHE A 120 -10.495 1.463 -7.139 1.00 0.00 O ATOM 1892 CB PHE A 120 -7.858 0.863 -7.458 1.00 0.00 C ATOM 1893 CG PHE A 120 -8.008 0.516 -8.917 1.00 0.00 C ATOM 1894 CD1 PHE A 120 -9.239 0.149 -9.442 1.00 0.00 C ATOM 1895 CD2 PHE A 120 -6.911 0.560 -9.763 1.00 0.00 C ATOM 1896 CE1 PHE A 120 -9.371 -0.166 -10.780 1.00 0.00 C ATOM 1897 CE2 PHE A 120 -7.038 0.245 -11.103 1.00 0.00 C ATOM 1898 CZ PHE A 120 -8.269 -0.118 -11.613 1.00 0.00 C ATOM 0 H PHE A 120 -8.425 -1.515 -7.941 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.223 -0.002 -5.531 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -8.132 1.908 -7.315 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -6.808 0.768 -7.180 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -10.104 0.109 -8.797 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -5.946 0.844 -9.371 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -10.335 -0.450 -11.176 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -6.175 0.283 -11.751 1.00 0.00 H new ATOM 0 HZ PHE A 120 -8.370 -0.364 -12.660 1.00 0.00 H new ATOM 1908 N HIS A 121 -10.883 0.029 -5.449 1.00 0.00 N ATOM 1909 CA HIS A 121 -12.259 0.468 -5.262 1.00 0.00 C ATOM 1910 C HIS A 121 -12.351 1.947 -4.898 1.00 0.00 C ATOM 1911 O HIS A 121 -13.194 2.668 -5.432 1.00 0.00 O ATOM 1912 CB HIS A 121 -12.942 -0.368 -4.187 1.00 0.00 C ATOM 1913 CG HIS A 121 -14.425 -0.163 -4.121 1.00 0.00 C ATOM 1914 ND1 HIS A 121 -15.091 0.771 -4.887 1.00 0.00 N ATOM 1915 CD2 HIS A 121 -15.374 -0.779 -3.375 1.00 0.00 C ATOM 1916 CE1 HIS A 121 -16.383 0.721 -4.614 1.00 0.00 C ATOM 1917 NE2 HIS A 121 -16.580 -0.211 -3.701 1.00 0.00 N ATOM 0 H HIS A 121 -10.583 -0.710 -4.813 1.00 0.00 H new ATOM 0 HA HIS A 121 -12.769 0.329 -6.215 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -12.737 -1.422 -4.373 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -12.506 -0.125 -3.218 1.00 0.00 H new ATOM 0 HD1 HIS A 121 -14.654 1.402 -5.559 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -15.211 -1.570 -2.658 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -17.148 1.338 -5.062 1.00 0.00 H new ATOM 1926 N MET A 122 -11.489 2.402 -3.994 1.00 0.00 N ATOM 1927 CA MET A 122 -11.500 3.799 -3.584 1.00 0.00 C ATOM 1928 C MET A 122 -10.128 4.430 -3.781 1.00 0.00 C ATOM 1929 O MET A 122 -9.965 5.340 -4.594 1.00 0.00 O ATOM 1930 CB MET A 122 -11.933 3.920 -2.122 1.00 0.00 C ATOM 1931 CG MET A 122 -13.423 4.179 -1.953 1.00 0.00 C ATOM 1932 SD MET A 122 -14.176 3.134 -0.691 1.00 0.00 S ATOM 1933 CE MET A 122 -15.898 3.601 -0.851 1.00 0.00 C ATOM 0 H MET A 122 -10.781 1.829 -3.536 1.00 0.00 H new ATOM 0 HA MET A 122 -12.216 4.333 -4.208 1.00 0.00 H new ATOM 0 HB2 MET A 122 -11.669 3.003 -1.595 1.00 0.00 H new ATOM 0 HB3 MET A 122 -11.375 4.730 -1.651 1.00 0.00 H new ATOM 0 HG2 MET A 122 -13.578 5.226 -1.691 1.00 0.00 H new ATOM 0 HG3 MET A 122 -13.926 4.011 -2.905 1.00 0.00 H new ATOM 0 HE1 MET A 122 -16.496 3.038 -0.134 1.00 0.00 H new ATOM 0 HE2 MET A 122 -16.005 4.668 -0.655 1.00 0.00 H new ATOM 0 HE3 MET A 122 -16.242 3.381 -1.862 1.00 0.00 H new ATOM 1943 N MET A 123 -9.144 3.944 -3.029 1.00 0.00 N ATOM 1944 CA MET A 123 -7.782 4.464 -3.116 1.00 0.00 C ATOM 1945 C MET A 123 -7.787 5.987 -3.131 1.00 0.00 C ATOM 1946 O MET A 123 -7.021 6.618 -3.859 1.00 0.00 O ATOM 1947 CB MET A 123 -7.091 3.930 -4.371 1.00 0.00 C ATOM 1948 CG MET A 123 -7.312 2.443 -4.596 1.00 0.00 C ATOM 1949 SD MET A 123 -5.777 1.549 -4.902 1.00 0.00 S ATOM 1950 CE MET A 123 -5.016 2.595 -6.140 1.00 0.00 C ATOM 0 H MET A 123 -9.264 3.190 -2.352 1.00 0.00 H new ATOM 0 HA MET A 123 -7.231 4.128 -2.238 1.00 0.00 H new ATOM 0 HB2 MET A 123 -7.456 4.479 -5.239 1.00 0.00 H new ATOM 0 HB3 MET A 123 -6.021 4.124 -4.298 1.00 0.00 H new ATOM 0 HG2 MET A 123 -7.807 2.018 -3.723 1.00 0.00 H new ATOM 0 HG3 MET A 123 -7.984 2.304 -5.443 1.00 0.00 H new ATOM 0 HE1 MET A 123 -4.422 1.983 -6.819 1.00 0.00 H new ATOM 0 HE2 MET A 123 -5.791 3.114 -6.704 1.00 0.00 H new ATOM 0 HE3 MET A 123 -4.371 3.326 -5.652 1.00 0.00 H new ATOM 1960 N GLU A 124 -8.664 6.569 -2.321 1.00 0.00 N ATOM 1961 CA GLU A 124 -8.781 8.019 -2.239 1.00 0.00 C ATOM 1962 C GLU A 124 -8.387 8.509 -0.854 1.00 0.00 C ATOM 1963 O GLU A 124 -8.669 7.852 0.149 1.00 0.00 O ATOM 1964 CB GLU A 124 -10.210 8.458 -2.566 1.00 0.00 C ATOM 1965 CG GLU A 124 -10.400 8.880 -4.014 1.00 0.00 C ATOM 1966 CD GLU A 124 -11.849 8.809 -4.455 1.00 0.00 C ATOM 1967 OE1 GLU A 124 -12.547 7.856 -4.050 1.00 0.00 O ATOM 1968 OE2 GLU A 124 -12.285 9.708 -5.205 1.00 0.00 O ATOM 0 H GLU A 124 -9.304 6.059 -1.712 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.103 8.460 -2.970 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.893 7.639 -2.342 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.484 9.288 -1.915 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.034 9.899 -4.143 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.796 8.240 -4.658 1.00 0.00 H new ATOM 1975 N ILE A 125 -7.730 9.660 -0.801 1.00 0.00 N ATOM 1976 CA ILE A 125 -7.299 10.220 0.469 1.00 0.00 C ATOM 1977 C ILE A 125 -8.071 11.487 0.814 1.00 0.00 C ATOM 1978 O ILE A 125 -7.925 12.517 0.157 1.00 0.00 O ATOM 1979 CB ILE A 125 -5.789 10.531 0.464 1.00 0.00 C ATOM 1980 CG1 ILE A 125 -4.994 9.265 0.155 1.00 0.00 C ATOM 1981 CG2 ILE A 125 -5.356 11.118 1.800 1.00 0.00 C ATOM 1982 CD1 ILE A 125 -3.500 9.490 0.104 1.00 0.00 C ATOM 0 H ILE A 125 -7.486 10.220 -1.618 1.00 0.00 H new ATOM 0 HA ILE A 125 -7.504 9.464 1.227 1.00 0.00 H new ATOM 0 HB ILE A 125 -5.590 11.270 -0.312 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -5.215 8.513 0.912 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -5.326 8.861 -0.802 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -4.287 11.330 1.775 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -5.905 12.041 1.987 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -5.566 10.404 2.596 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -2.998 8.549 -0.120 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -3.268 10.219 -0.673 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -3.155 9.865 1.068 1.00 0.00 H new ATOM 1994 N LEU A 126 -8.877 11.404 1.866 1.00 0.00 N ATOM 1995 CA LEU A 126 -9.658 12.547 2.322 1.00 0.00 C ATOM 1996 C LEU A 126 -9.047 13.113 3.597 1.00 0.00 C ATOM 1997 O LEU A 126 -8.656 12.361 4.489 1.00 0.00 O ATOM 1998 CB LEU A 126 -11.112 12.137 2.573 1.00 0.00 C ATOM 1999 CG LEU A 126 -11.678 11.113 1.587 1.00 0.00 C ATOM 2000 CD1 LEU A 126 -11.512 9.702 2.129 1.00 0.00 C ATOM 2001 CD2 LEU A 126 -13.143 11.405 1.296 1.00 0.00 C ATOM 0 H LEU A 126 -9.007 10.557 2.419 1.00 0.00 H new ATOM 0 HA LEU A 126 -9.644 13.313 1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.189 11.729 3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.735 13.031 2.542 1.00 0.00 H new ATOM 0 HG LEU A 126 -11.121 11.190 0.654 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.920 8.987 1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -10.453 9.494 2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.043 9.611 3.076 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -13.528 10.667 0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -13.715 11.357 2.223 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.237 12.401 0.864 1.00 0.00 H new ATOM 2013 N ASP A 127 -8.951 14.436 3.683 1.00 0.00 N ATOM 2014 CA ASP A 127 -8.365 15.066 4.860 1.00 0.00 C ATOM 2015 C ASP A 127 -9.426 15.757 5.716 1.00 0.00 C ATOM 2016 O ASP A 127 -10.135 16.647 5.247 1.00 0.00 O ATOM 2017 CB ASP A 127 -7.299 16.079 4.440 1.00 0.00 C ATOM 2018 CG ASP A 127 -6.493 16.592 5.618 1.00 0.00 C ATOM 2019 OD1 ASP A 127 -7.070 17.300 6.469 1.00 0.00 O ATOM 2020 OD2 ASP A 127 -5.284 16.286 5.687 1.00 0.00 O ATOM 0 H ASP A 127 -9.267 15.085 2.962 1.00 0.00 H new ATOM 0 HA ASP A 127 -7.906 14.281 5.461 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -6.627 15.616 3.717 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -7.778 16.919 3.937 1.00 0.00 H new ATOM 2025 N GLU A 128 -9.514 15.346 6.978 1.00 0.00 N ATOM 2026 CA GLU A 128 -10.470 15.927 7.915 1.00 0.00 C ATOM 2027 C GLU A 128 -9.757 16.443 9.165 1.00 0.00 C ATOM 2028 O GLU A 128 -8.954 15.730 9.762 1.00 0.00 O ATOM 2029 CB GLU A 128 -11.527 14.893 8.306 1.00 0.00 C ATOM 2030 CG GLU A 128 -12.939 15.455 8.356 1.00 0.00 C ATOM 2031 CD GLU A 128 -13.999 14.383 8.198 1.00 0.00 C ATOM 2032 OE1 GLU A 128 -13.665 13.285 7.703 1.00 0.00 O ATOM 2033 OE2 GLU A 128 -15.163 14.639 8.569 1.00 0.00 O ATOM 0 H GLU A 128 -8.932 14.609 7.376 1.00 0.00 H new ATOM 0 HA GLU A 128 -10.961 16.767 7.423 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.498 14.069 7.593 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -11.275 14.479 9.282 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.087 15.971 9.305 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -13.059 16.198 7.567 1.00 0.00 H new ATOM 2040 N ASP A 129 -10.057 17.676 9.566 1.00 0.00 N ATOM 2041 CA ASP A 129 -9.436 18.253 10.758 1.00 0.00 C ATOM 2042 C ASP A 129 -7.917 18.264 10.638 1.00 0.00 C ATOM 2043 O ASP A 129 -7.206 18.305 11.642 1.00 0.00 O ATOM 2044 CB ASP A 129 -9.824 17.434 11.982 1.00 0.00 C ATOM 2045 CG ASP A 129 -11.316 17.451 12.246 1.00 0.00 C ATOM 2046 OD1 ASP A 129 -12.084 17.058 11.342 1.00 0.00 O ATOM 2047 OD2 ASP A 129 -11.718 17.858 13.356 1.00 0.00 O ATOM 0 H ASP A 129 -10.718 18.290 9.090 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.788 19.280 10.858 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -9.495 16.404 11.845 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -9.300 17.822 12.855 1.00 0.00 H new ATOM 2052 N GLY A 130 -7.429 18.194 9.413 1.00 0.00 N ATOM 2053 CA GLY A 130 -5.998 18.161 9.185 1.00 0.00 C ATOM 2054 C GLY A 130 -5.475 16.736 9.180 1.00 0.00 C ATOM 2055 O GLY A 130 -4.281 16.499 8.998 1.00 0.00 O ATOM 0 H GLY A 130 -7.998 18.159 8.567 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -5.768 18.639 8.233 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -5.490 18.735 9.960 1.00 0.00 H new ATOM 2059 N LEU A 131 -6.390 15.787 9.369 1.00 0.00 N ATOM 2060 CA LEU A 131 -6.058 14.371 9.380 1.00 0.00 C ATOM 2061 C LEU A 131 -6.213 13.802 7.978 1.00 0.00 C ATOM 2062 O LEU A 131 -7.165 14.127 7.275 1.00 0.00 O ATOM 2063 CB LEU A 131 -6.984 13.632 10.353 1.00 0.00 C ATOM 2064 CG LEU A 131 -6.723 12.138 10.540 1.00 0.00 C ATOM 2065 CD1 LEU A 131 -7.151 11.360 9.309 1.00 0.00 C ATOM 2066 CD2 LEU A 131 -5.261 11.881 10.863 1.00 0.00 C ATOM 0 H LEU A 131 -7.380 15.982 9.518 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.026 14.241 9.706 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.911 14.116 11.327 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -8.011 13.759 10.010 1.00 0.00 H new ATOM 0 HG LEU A 131 -7.320 11.792 11.384 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -6.956 10.299 9.463 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -8.216 11.512 9.135 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -6.588 11.710 8.444 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -5.100 10.811 10.992 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -4.638 12.246 10.046 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -4.995 12.401 11.783 1.00 0.00 H new ATOM 2078 N ILE A 132 -5.284 12.947 7.582 1.00 0.00 N ATOM 2079 CA ILE A 132 -5.337 12.328 6.258 1.00 0.00 C ATOM 2080 C ILE A 132 -5.870 10.916 6.353 1.00 0.00 C ATOM 2081 O ILE A 132 -5.301 10.085 7.053 1.00 0.00 O ATOM 2082 CB ILE A 132 -3.960 12.244 5.557 1.00 0.00 C ATOM 2083 CG1 ILE A 132 -2.801 12.455 6.543 1.00 0.00 C ATOM 2084 CG2 ILE A 132 -3.873 13.242 4.416 1.00 0.00 C ATOM 2085 CD1 ILE A 132 -2.391 13.904 6.716 1.00 0.00 C ATOM 0 H ILE A 132 -4.486 12.664 8.151 1.00 0.00 H new ATOM 0 HA ILE A 132 -5.991 12.972 5.671 1.00 0.00 H new ATOM 0 HB ILE A 132 -3.867 11.237 5.150 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -3.086 12.051 7.514 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -1.939 11.883 6.201 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -2.896 13.164 3.938 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -4.652 13.028 3.685 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -4.008 14.251 4.804 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.568 13.967 7.428 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.072 14.309 5.756 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -3.238 14.480 7.089 1.00 0.00 H new ATOM 2097 N LYS A 133 -6.943 10.627 5.634 1.00 0.00 N ATOM 2098 CA LYS A 133 -7.497 9.287 5.654 1.00 0.00 C ATOM 2099 C LYS A 133 -7.418 8.650 4.270 1.00 0.00 C ATOM 2100 O LYS A 133 -7.720 9.289 3.266 1.00 0.00 O ATOM 2101 CB LYS A 133 -8.953 9.318 6.126 1.00 0.00 C ATOM 2102 CG LYS A 133 -9.193 10.242 7.308 1.00 0.00 C ATOM 2103 CD LYS A 133 -10.674 10.526 7.503 1.00 0.00 C ATOM 2104 CE LYS A 133 -10.927 11.311 8.779 1.00 0.00 C ATOM 2105 NZ LYS A 133 -12.240 10.969 9.392 1.00 0.00 N ATOM 0 H LYS A 133 -7.439 11.291 5.040 1.00 0.00 H new ATOM 0 HA LYS A 133 -6.909 8.689 6.350 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -9.588 9.631 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -9.259 8.308 6.398 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -8.786 9.790 8.213 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -8.659 11.180 7.152 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -11.054 11.086 6.649 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -11.224 9.586 7.538 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -10.129 11.108 9.494 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -10.896 12.378 8.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -12.792 11.838 9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -12.763 10.330 8.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -12.084 10.499 10.307 1.00 0.00 H new ATOM 2119 N ALA A 134 -7.026 7.384 4.235 1.00 0.00 N ATOM 2120 CA ALA A 134 -6.918 6.635 2.981 1.00 0.00 C ATOM 2121 C ALA A 134 -7.870 5.440 2.988 1.00 0.00 C ATOM 2122 O ALA A 134 -8.054 4.798 4.022 1.00 0.00 O ATOM 2123 CB ALA A 134 -5.485 6.174 2.762 1.00 0.00 C ATOM 0 H ALA A 134 -6.775 6.847 5.065 1.00 0.00 H new ATOM 0 HA ALA A 134 -7.199 7.293 2.159 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -5.420 5.619 1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -4.827 7.042 2.715 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -5.180 5.531 3.587 1.00 0.00 H new ATOM 2129 N ARG A 135 -8.490 5.150 1.842 1.00 0.00 N ATOM 2130 CA ARG A 135 -9.439 4.034 1.765 1.00 0.00 C ATOM 2131 C ARG A 135 -9.304 3.209 0.493 1.00 0.00 C ATOM 2132 O ARG A 135 -9.532 3.711 -0.605 1.00 0.00 O ATOM 2133 CB ARG A 135 -10.873 4.558 1.831 1.00 0.00 C ATOM 2134 CG ARG A 135 -11.025 5.980 1.308 1.00 0.00 C ATOM 2135 CD ARG A 135 -12.221 6.113 0.379 1.00 0.00 C ATOM 2136 NE ARG A 135 -13.252 6.984 0.938 1.00 0.00 N ATOM 2137 CZ ARG A 135 -14.087 7.720 0.206 1.00 0.00 C ATOM 2138 NH1 ARG A 135 -14.020 7.699 -1.121 1.00 0.00 N ATOM 2139 NH2 ARG A 135 -14.994 8.482 0.802 1.00 0.00 N ATOM 0 H ARG A 135 -8.357 5.661 0.969 1.00 0.00 H new ATOM 0 HA ARG A 135 -9.207 3.390 2.613 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.520 3.896 1.255 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -11.218 4.521 2.864 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -11.138 6.666 2.147 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -10.118 6.272 0.778 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -11.892 6.510 -0.581 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -12.644 5.127 0.188 1.00 0.00 H new ATOM 0 HE ARG A 135 -13.338 7.032 1.953 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -13.325 7.116 -1.587 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -14.664 8.266 -1.673 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -15.052 8.504 1.820 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -15.634 9.046 0.242 1.00 0.00 H new ATOM 2153 N VAL A 136 -8.994 1.923 0.652 1.00 0.00 N ATOM 2154 CA VAL A 136 -8.903 1.023 -0.490 1.00 0.00 C ATOM 2155 C VAL A 136 -9.698 -0.264 -0.253 1.00 0.00 C ATOM 2156 O VAL A 136 -9.328 -1.076 0.593 1.00 0.00 O ATOM 2157 CB VAL A 136 -7.437 0.653 -0.800 1.00 0.00 C ATOM 2158 CG1 VAL A 136 -7.351 -0.303 -1.988 1.00 0.00 C ATOM 2159 CG2 VAL A 136 -6.617 1.909 -1.055 1.00 0.00 C ATOM 0 H VAL A 136 -8.804 1.486 1.554 1.00 0.00 H new ATOM 0 HA VAL A 136 -9.327 1.556 -1.341 1.00 0.00 H new ATOM 0 HB VAL A 136 -7.023 0.141 0.069 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.307 -0.547 -2.184 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.900 -1.217 -1.760 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.784 0.171 -2.869 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -5.585 1.632 -1.272 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -7.034 2.450 -1.905 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -6.643 2.546 -0.171 1.00 0.00 H new ATOM 2169 N ILE A 137 -10.751 -0.471 -1.044 1.00 0.00 N ATOM 2170 CA ILE A 137 -11.558 -1.679 -0.959 1.00 0.00 C ATOM 2171 C ILE A 137 -11.146 -2.652 -2.041 1.00 0.00 C ATOM 2172 O ILE A 137 -11.177 -2.348 -3.230 1.00 0.00 O ATOM 2173 CB ILE A 137 -13.068 -1.420 -1.075 1.00 0.00 C ATOM 2174 CG1 ILE A 137 -13.423 -0.091 -0.425 1.00 0.00 C ATOM 2175 CG2 ILE A 137 -13.848 -2.566 -0.450 1.00 0.00 C ATOM 2176 CD1 ILE A 137 -14.866 0.013 0.027 1.00 0.00 C ATOM 0 H ILE A 137 -11.063 0.191 -1.755 1.00 0.00 H new ATOM 0 HA ILE A 137 -11.376 -2.094 0.032 1.00 0.00 H new ATOM 0 HB ILE A 137 -13.341 -1.364 -2.129 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -12.772 0.065 0.435 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -13.216 0.713 -1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -14.917 -2.370 -0.539 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -13.605 -3.495 -0.966 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -13.582 -2.655 0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -15.036 0.990 0.479 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -15.526 -0.109 -0.832 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -15.075 -0.767 0.759 1.00 0.00 H new ATOM 2188 N LEU A 138 -10.735 -3.813 -1.595 1.00 0.00 N ATOM 2189 CA LEU A 138 -10.265 -4.876 -2.474 1.00 0.00 C ATOM 2190 C LEU A 138 -11.277 -5.998 -2.575 1.00 0.00 C ATOM 2191 O LEU A 138 -12.087 -6.188 -1.682 1.00 0.00 O ATOM 2192 CB LEU A 138 -8.910 -5.385 -2.000 1.00 0.00 C ATOM 2193 CG LEU A 138 -7.820 -4.311 -1.962 1.00 0.00 C ATOM 2194 CD1 LEU A 138 -6.446 -4.942 -2.109 1.00 0.00 C ATOM 2195 CD2 LEU A 138 -8.055 -3.266 -3.054 1.00 0.00 C ATOM 0 H LEU A 138 -10.714 -4.057 -0.605 1.00 0.00 H new ATOM 0 HA LEU A 138 -10.145 -4.467 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.022 -5.810 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.587 -6.193 -2.656 1.00 0.00 H new ATOM 0 HG LEU A 138 -7.865 -3.809 -0.995 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.683 -4.164 -2.080 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.279 -5.645 -1.293 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.388 -5.471 -3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.270 -2.511 -3.010 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.039 -3.750 -4.030 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -9.024 -2.791 -2.900 1.00 0.00 H new ATOM 2207 N ASP A 139 -11.254 -6.711 -3.689 1.00 0.00 N ATOM 2208 CA ASP A 139 -12.218 -7.780 -3.917 1.00 0.00 C ATOM 2209 C ASP A 139 -11.816 -9.064 -3.199 1.00 0.00 C ATOM 2210 O ASP A 139 -10.637 -9.401 -3.096 1.00 0.00 O ATOM 2211 CB ASP A 139 -12.360 -8.046 -5.418 1.00 0.00 C ATOM 2212 CG ASP A 139 -13.741 -7.704 -5.940 1.00 0.00 C ATOM 2213 OD1 ASP A 139 -14.640 -8.566 -5.851 1.00 0.00 O ATOM 2214 OD2 ASP A 139 -13.924 -6.572 -6.436 1.00 0.00 O ATOM 0 H ASP A 139 -10.584 -6.572 -4.446 1.00 0.00 H new ATOM 0 HA ASP A 139 -13.176 -7.455 -3.511 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -11.616 -7.462 -5.959 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.149 -9.096 -5.619 1.00 0.00 H new ATOM 2219 N LEU A 140 -12.838 -9.750 -2.677 1.00 0.00 N ATOM 2220 CA LEU A 140 -12.681 -10.995 -1.921 1.00 0.00 C ATOM 2221 C LEU A 140 -11.520 -11.839 -2.441 1.00 0.00 C ATOM 2222 O LEU A 140 -11.174 -11.699 -3.633 1.00 0.00 O ATOM 2223 CB LEU A 140 -13.978 -11.813 -1.977 1.00 0.00 C ATOM 2224 CG LEU A 140 -14.884 -11.706 -0.742 1.00 0.00 C ATOM 2225 CD1 LEU A 140 -15.898 -12.839 -0.729 1.00 0.00 C ATOM 2226 CD2 LEU A 140 -14.065 -11.713 0.542 1.00 0.00 C ATOM 2227 OXT LEU A 140 -10.974 -12.639 -1.654 1.00 0.00 O ATOM 0 H LEU A 140 -13.809 -9.452 -2.769 1.00 0.00 H new ATOM 0 HA LEU A 140 -12.459 -10.722 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -14.547 -11.498 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -13.719 -12.861 -2.126 1.00 0.00 H new ATOM 0 HG LEU A 140 -15.418 -10.757 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -16.533 -12.749 0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -16.514 -12.786 -1.627 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -15.375 -13.795 -0.704 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -14.733 -11.636 1.400 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -13.497 -12.641 0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -13.378 -10.867 0.540 1.00 0.00 H new