USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1136 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 68 ASN : amide:sc= -1.22 K(o=-3.4,f=-2.7) USER MOD Set 1.2: A 81 ASN : amide:sc= -2.18 K(o=-3.4,f=-4) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 19:sc= 0.675 USER MOD Single : A 5 SER OG : rot -74:sc= 0.639 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0905 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -0.719 K(o=-0.72,f=0) USER MOD Single : A 14 CYS SG : rot 180:sc=-0.000342 USER MOD Single : A 16 GLN : amide:sc= -0.5 X(o=-0.5,f=-0.48) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 139:sc= -2.16! USER MOD Single : A 22 LYS NZ :NH3+ 158:sc= 0.0691 (180deg=0.00436) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -14.8! C(o=-15!,f=-16!) USER MOD Single : A 31 THR OG1 : rot 180:sc=-0.00725 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 42 GLN : amide:sc= -0.0627 K(o=-0.063,f=-0.68) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 70:sc= -6.5! USER MOD Single : A 52 GLN : amide:sc= -1.35 K(o=-1.3,f=-6.4!) USER MOD Single : A 55 ASN : amide:sc= -3.42 K(o=-3.4,f=-16!) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 92:sc= 0.15 USER MOD Single : A 63 ASN : amide:sc= -4.81! C(o=-4.8!,f=-20!) USER MOD Single : A 65 LYS NZ :NH3+ 166:sc= -1.19 (180deg=-1.5) USER MOD Single : A 72 GLN : amide:sc= -0.0154 K(o=-0.015,f=-0.93) USER MOD Single : A 73 MET CE :methyl -121:sc= -0.296 (180deg=-1.99!) USER MOD Single : A 74 SER OG : rot 100:sc= 0.0707 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 78 CYS SG : rot 90:sc= -0.142 USER MOD Single : A 80 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00709) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 71:sc= 1.13 USER MOD Single : A 89 CYS SG : rot 129:sc= -1.39 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 80:sc= -0.686 USER MOD Single : A 95 MET CE :methyl -157:sc= 0 (180deg=-0.368) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 100:sc= 0 USER MOD Single : A 120 SER OG : rot 64:sc= 1.16 USER MOD Single : A 123 SER OG : rot -69:sc= 1.2 USER MOD Single : A 125 THR OG1 : rot -104:sc= 1.05 USER MOD Single : A 131 THR OG1 : rot -63:sc= 0.0235 USER MOD Single : A 138 SER OG : rot 180:sc= -0.155 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.261 11.388 20.747 1.00 0.00 N ATOM 2 CA GLY A 1 12.116 12.279 20.729 1.00 0.00 C ATOM 3 C GLY A 1 10.799 11.531 20.794 1.00 0.00 C ATOM 4 O GLY A 1 9.987 11.765 21.689 1.00 0.00 O ATOM 0 H1 GLY A 1 14.137 11.947 20.701 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.253 10.830 21.624 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.216 10.748 19.929 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.182 12.967 21.572 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.143 12.883 19.822 1.00 0.00 H new ATOM 8 N SER A 2 10.585 10.628 19.841 1.00 0.00 N ATOM 9 CA SER A 2 9.355 9.848 19.791 1.00 0.00 C ATOM 10 C SER A 2 9.659 8.366 19.591 1.00 0.00 C ATOM 11 O SER A 2 9.108 7.509 20.282 1.00 0.00 O ATOM 12 CB SER A 2 8.453 10.351 18.662 1.00 0.00 C ATOM 13 OG SER A 2 7.647 11.432 19.097 1.00 0.00 O ATOM 0 H SER A 2 11.248 10.419 19.094 1.00 0.00 H new ATOM 0 HA SER A 2 8.838 9.970 20.743 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.065 10.666 17.817 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.818 9.538 18.310 1.00 0.00 H new ATOM 0 HG SER A 2 7.081 11.737 18.357 1.00 0.00 H new ATOM 19 N SER A 3 10.542 8.072 18.642 1.00 0.00 N ATOM 20 CA SER A 3 10.918 6.695 18.348 1.00 0.00 C ATOM 21 C SER A 3 12.288 6.637 17.678 1.00 0.00 C ATOM 22 O SER A 3 12.522 7.288 16.661 1.00 0.00 O ATOM 23 CB SER A 3 9.870 6.038 17.448 1.00 0.00 C ATOM 24 OG SER A 3 8.731 5.646 18.194 1.00 0.00 O ATOM 0 H SER A 3 11.010 8.770 18.064 1.00 0.00 H new ATOM 0 HA SER A 3 10.970 6.150 19.291 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.573 6.733 16.663 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.303 5.168 16.955 1.00 0.00 H new ATOM 0 HG SER A 3 8.711 6.136 19.042 1.00 0.00 H new ATOM 30 N GLY A 4 13.191 5.851 18.257 1.00 0.00 N ATOM 31 CA GLY A 4 14.526 5.722 17.704 1.00 0.00 C ATOM 32 C GLY A 4 14.547 4.908 16.425 1.00 0.00 C ATOM 33 O GLY A 4 13.813 3.930 16.292 1.00 0.00 O ATOM 0 H GLY A 4 13.021 5.301 19.099 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.932 6.714 17.506 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.177 5.252 18.441 1.00 0.00 H new ATOM 37 N SER A 5 15.391 5.314 15.481 1.00 0.00 N ATOM 38 CA SER A 5 15.501 4.619 14.204 1.00 0.00 C ATOM 39 C SER A 5 16.891 4.015 14.033 1.00 0.00 C ATOM 40 O SER A 5 17.031 2.831 13.727 1.00 0.00 O ATOM 41 CB SER A 5 15.204 5.579 13.050 1.00 0.00 C ATOM 42 OG SER A 5 14.995 4.872 11.840 1.00 0.00 O ATOM 0 H SER A 5 16.008 6.120 15.577 1.00 0.00 H new ATOM 0 HA SER A 5 14.769 3.811 14.193 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.321 6.173 13.285 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.034 6.275 12.929 1.00 0.00 H new ATOM 0 HG SER A 5 15.852 4.536 11.505 1.00 0.00 H new ATOM 48 N SER A 6 17.916 4.837 14.233 1.00 0.00 N ATOM 49 CA SER A 6 19.296 4.385 14.097 1.00 0.00 C ATOM 50 C SER A 6 19.446 3.447 12.903 1.00 0.00 C ATOM 51 O SER A 6 20.136 2.432 12.980 1.00 0.00 O ATOM 52 CB SER A 6 19.752 3.679 15.375 1.00 0.00 C ATOM 53 OG SER A 6 18.987 2.510 15.613 1.00 0.00 O ATOM 0 H SER A 6 17.817 5.819 14.490 1.00 0.00 H new ATOM 0 HA SER A 6 19.924 5.260 13.930 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.807 3.417 15.293 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.658 4.358 16.223 1.00 0.00 H new ATOM 0 HG SER A 6 19.299 2.076 16.435 1.00 0.00 H new ATOM 59 N GLY A 7 18.792 3.796 11.799 1.00 0.00 N ATOM 60 CA GLY A 7 18.864 2.976 10.604 1.00 0.00 C ATOM 61 C GLY A 7 17.761 3.294 9.614 1.00 0.00 C ATOM 62 O GLY A 7 16.620 3.537 10.005 1.00 0.00 O ATOM 0 H GLY A 7 18.214 4.632 11.711 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.832 3.123 10.124 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.804 1.924 10.885 1.00 0.00 H new ATOM 66 N MET A 8 18.103 3.295 8.330 1.00 0.00 N ATOM 67 CA MET A 8 17.132 3.587 7.282 1.00 0.00 C ATOM 68 C MET A 8 15.807 2.884 7.557 1.00 0.00 C ATOM 69 O MET A 8 15.756 1.660 7.671 1.00 0.00 O ATOM 70 CB MET A 8 17.677 3.158 5.918 1.00 0.00 C ATOM 71 CG MET A 8 17.127 3.974 4.760 1.00 0.00 C ATOM 72 SD MET A 8 18.039 5.507 4.495 1.00 0.00 S ATOM 73 CE MET A 8 19.059 5.056 3.093 1.00 0.00 C ATOM 0 H MET A 8 19.044 3.097 7.990 1.00 0.00 H new ATOM 0 HA MET A 8 16.957 4.663 7.273 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.764 3.242 5.927 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.440 2.107 5.756 1.00 0.00 H new ATOM 0 HG2 MET A 8 17.160 3.374 3.850 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.079 4.207 4.950 1.00 0.00 H new ATOM 0 HE1 MET A 8 19.683 5.904 2.809 1.00 0.00 H new ATOM 0 HE2 MET A 8 19.694 4.212 3.362 1.00 0.00 H new ATOM 0 HE3 MET A 8 18.422 4.778 2.254 1.00 0.00 H new ATOM 83 N GLU A 9 14.737 3.666 7.663 1.00 0.00 N ATOM 84 CA GLU A 9 13.412 3.116 7.926 1.00 0.00 C ATOM 85 C GLU A 9 12.982 2.173 6.806 1.00 0.00 C ATOM 86 O GLU A 9 13.476 2.240 5.680 1.00 0.00 O ATOM 87 CB GLU A 9 12.389 4.244 8.079 1.00 0.00 C ATOM 88 CG GLU A 9 12.295 4.793 9.492 1.00 0.00 C ATOM 89 CD GLU A 9 11.399 3.957 10.385 1.00 0.00 C ATOM 90 OE1 GLU A 9 10.172 4.188 10.379 1.00 0.00 O ATOM 91 OE2 GLU A 9 11.926 3.071 11.091 1.00 0.00 O ATOM 0 H GLU A 9 14.762 4.682 7.571 1.00 0.00 H new ATOM 0 HA GLU A 9 13.460 2.549 8.856 1.00 0.00 H new ATOM 0 HB2 GLU A 9 12.651 5.055 7.400 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.409 3.878 7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.293 4.839 9.927 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.915 5.814 9.456 1.00 0.00 H new ATOM 98 N PRO A 10 12.040 1.272 7.122 1.00 0.00 N ATOM 99 CA PRO A 10 11.523 0.297 6.157 1.00 0.00 C ATOM 100 C PRO A 10 10.674 0.950 5.072 1.00 0.00 C ATOM 101 O PRO A 10 10.405 0.346 4.033 1.00 0.00 O ATOM 102 CB PRO A 10 10.666 -0.634 7.018 1.00 0.00 C ATOM 103 CG PRO A 10 10.261 0.196 8.187 1.00 0.00 C ATOM 104 CD PRO A 10 11.408 1.135 8.444 1.00 0.00 C ATOM 0 HA PRO A 10 12.325 -0.212 5.623 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.797 -0.993 6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 10 11.229 -1.512 7.333 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.345 0.747 7.976 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.064 -0.428 9.059 1.00 0.00 H new ATOM 0 HD2 PRO A 10 11.063 2.096 8.826 1.00 0.00 H new ATOM 0 HD3 PRO A 10 12.102 0.730 9.181 1.00 0.00 H new ATOM 112 N TRP A 11 10.255 2.186 5.319 1.00 0.00 N ATOM 113 CA TRP A 11 9.436 2.921 4.361 1.00 0.00 C ATOM 114 C TRP A 11 10.306 3.591 3.303 1.00 0.00 C ATOM 115 O TRP A 11 9.907 3.712 2.144 1.00 0.00 O ATOM 116 CB TRP A 11 8.590 3.972 5.083 1.00 0.00 C ATOM 117 CG TRP A 11 9.299 5.279 5.269 1.00 0.00 C ATOM 118 CD1 TRP A 11 9.916 5.723 6.404 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.461 6.313 4.291 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.452 6.970 6.190 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.187 7.354 4.902 1.00 0.00 C ATOM 122 CE3 TRP A 11 9.065 6.459 2.959 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.523 8.523 4.225 1.00 0.00 C ATOM 124 CZ3 TRP A 11 9.399 7.620 2.289 1.00 0.00 C ATOM 125 CH2 TRP A 11 10.123 8.640 2.922 1.00 0.00 C ATOM 0 H TRP A 11 10.468 2.700 6.174 1.00 0.00 H new ATOM 0 HA TRP A 11 8.775 2.210 3.865 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.673 4.141 4.518 1.00 0.00 H new ATOM 0 HB3 TRP A 11 8.296 3.584 6.058 1.00 0.00 H new ATOM 0 HD1 TRP A 11 9.974 5.175 7.333 1.00 0.00 H new ATOM 0 HE1 TRP A 11 10.964 7.521 6.879 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.508 5.678 2.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 11.080 9.310 4.711 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 9.097 7.744 1.260 1.00 0.00 H new ATOM 0 HH2 TRP A 11 10.370 9.535 2.370 1.00 0.00 H new ATOM 136 N LYS A 12 11.495 4.023 3.707 1.00 0.00 N ATOM 137 CA LYS A 12 12.422 4.680 2.793 1.00 0.00 C ATOM 138 C LYS A 12 12.642 3.835 1.542 1.00 0.00 C ATOM 139 O LYS A 12 12.608 4.347 0.423 1.00 0.00 O ATOM 140 CB LYS A 12 13.760 4.937 3.489 1.00 0.00 C ATOM 141 CG LYS A 12 13.623 5.637 4.830 1.00 0.00 C ATOM 142 CD LYS A 12 14.789 6.576 5.091 1.00 0.00 C ATOM 143 CE LYS A 12 14.360 7.784 5.909 1.00 0.00 C ATOM 144 NZ LYS A 12 15.520 8.634 6.295 1.00 0.00 N ATOM 0 H LYS A 12 11.840 3.930 4.662 1.00 0.00 H new ATOM 0 HA LYS A 12 11.985 5.633 2.495 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.272 3.986 3.636 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.390 5.541 2.836 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.690 6.199 4.854 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.568 4.894 5.625 1.00 0.00 H new ATOM 0 HD2 LYS A 12 15.578 6.040 5.618 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.209 6.909 4.142 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.650 8.378 5.334 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.841 7.449 6.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.185 9.446 6.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.186 8.075 6.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.001 8.975 5.438 1.00 0.00 H new ATOM 158 N GLN A 13 12.867 2.540 1.740 1.00 0.00 N ATOM 159 CA GLN A 13 13.091 1.625 0.627 1.00 0.00 C ATOM 160 C GLN A 13 11.784 1.313 -0.094 1.00 0.00 C ATOM 161 O GLN A 13 11.739 1.263 -1.324 1.00 0.00 O ATOM 162 CB GLN A 13 13.734 0.330 1.125 1.00 0.00 C ATOM 163 CG GLN A 13 12.874 -0.432 2.121 1.00 0.00 C ATOM 164 CD GLN A 13 13.552 -1.685 2.639 1.00 0.00 C ATOM 165 OE1 GLN A 13 13.788 -2.633 1.890 1.00 0.00 O ATOM 166 NE2 GLN A 13 13.870 -1.696 3.928 1.00 0.00 N ATOM 0 H GLN A 13 12.899 2.101 2.660 1.00 0.00 H new ATOM 0 HA GLN A 13 13.766 2.110 -0.078 1.00 0.00 H new ATOM 0 HB2 GLN A 13 13.943 -0.314 0.271 1.00 0.00 H new ATOM 0 HB3 GLN A 13 14.692 0.565 1.589 1.00 0.00 H new ATOM 0 HG2 GLN A 13 12.633 0.220 2.961 1.00 0.00 H new ATOM 0 HG3 GLN A 13 11.930 -0.703 1.648 1.00 0.00 H new ATOM 0 HE21 GLN A 13 13.656 -0.888 4.513 1.00 0.00 H new ATOM 0 HE22 GLN A 13 14.328 -2.512 4.333 1.00 0.00 H new ATOM 175 N CYS A 14 10.724 1.105 0.678 1.00 0.00 N ATOM 176 CA CYS A 14 9.415 0.797 0.113 1.00 0.00 C ATOM 177 C CYS A 14 9.067 1.765 -1.013 1.00 0.00 C ATOM 178 O CYS A 14 8.623 1.352 -2.084 1.00 0.00 O ATOM 179 CB CYS A 14 8.340 0.854 1.200 1.00 0.00 C ATOM 180 SG CYS A 14 6.693 0.368 0.636 1.00 0.00 S ATOM 0 H CYS A 14 10.745 1.144 1.697 1.00 0.00 H new ATOM 0 HA CYS A 14 9.453 -0.212 -0.298 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.637 0.204 2.024 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.292 1.869 1.596 1.00 0.00 H new ATOM 0 HG CYS A 14 5.854 0.447 1.626 1.00 0.00 H new ATOM 186 N ALA A 15 9.272 3.054 -0.763 1.00 0.00 N ATOM 187 CA ALA A 15 8.981 4.080 -1.756 1.00 0.00 C ATOM 188 C ALA A 15 9.413 3.635 -3.149 1.00 0.00 C ATOM 189 O ALA A 15 8.684 3.820 -4.123 1.00 0.00 O ATOM 190 CB ALA A 15 9.665 5.386 -1.381 1.00 0.00 C ATOM 0 H ALA A 15 9.639 3.412 0.119 1.00 0.00 H new ATOM 0 HA ALA A 15 7.903 4.239 -1.773 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.439 6.144 -2.131 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.304 5.720 -0.408 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.743 5.232 -1.334 1.00 0.00 H new ATOM 196 N GLN A 16 10.603 3.048 -3.235 1.00 0.00 N ATOM 197 CA GLN A 16 11.132 2.579 -4.510 1.00 0.00 C ATOM 198 C GLN A 16 10.179 1.580 -5.160 1.00 0.00 C ATOM 199 O GLN A 16 9.595 1.856 -6.207 1.00 0.00 O ATOM 200 CB GLN A 16 12.505 1.936 -4.310 1.00 0.00 C ATOM 201 CG GLN A 16 13.548 2.890 -3.750 1.00 0.00 C ATOM 202 CD GLN A 16 14.034 3.892 -4.777 1.00 0.00 C ATOM 203 OE1 GLN A 16 15.108 3.733 -5.357 1.00 0.00 O ATOM 204 NE2 GLN A 16 13.243 4.934 -5.009 1.00 0.00 N ATOM 0 H GLN A 16 11.218 2.886 -2.438 1.00 0.00 H new ATOM 0 HA GLN A 16 11.234 3.439 -5.172 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.404 1.085 -3.636 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.857 1.546 -5.265 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.126 3.424 -2.898 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.397 2.316 -3.378 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.361 5.027 -4.506 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.518 5.641 -5.691 1.00 0.00 H new ATOM 213 N TRP A 17 10.029 0.420 -4.531 1.00 0.00 N ATOM 214 CA TRP A 17 9.147 -0.621 -5.049 1.00 0.00 C ATOM 215 C TRP A 17 7.909 -0.012 -5.699 1.00 0.00 C ATOM 216 O TRP A 17 7.549 -0.363 -6.823 1.00 0.00 O ATOM 217 CB TRP A 17 8.732 -1.572 -3.926 1.00 0.00 C ATOM 218 CG TRP A 17 7.904 -2.727 -4.401 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.293 -3.716 -5.260 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.547 -3.012 -4.047 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.259 -4.598 -5.460 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.177 -4.189 -4.726 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.609 -2.388 -3.220 1.00 0.00 C ATOM 224 CZ2 TRP A 17 4.909 -4.752 -4.604 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.351 -2.948 -3.099 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.010 -4.120 -3.787 1.00 0.00 C ATOM 0 H TRP A 17 10.506 0.176 -3.663 1.00 0.00 H new ATOM 0 HA TRP A 17 9.694 -1.182 -5.807 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.627 -1.954 -3.434 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.169 -1.015 -3.177 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.270 -3.793 -5.715 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.292 -5.424 -6.058 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.862 -1.485 -2.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 4.644 -5.655 -5.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.618 -2.474 -2.463 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.019 -4.533 -3.671 1.00 0.00 H new ATOM 237 N LEU A 18 7.262 0.903 -4.986 1.00 0.00 N ATOM 238 CA LEU A 18 6.063 1.562 -5.494 1.00 0.00 C ATOM 239 C LEU A 18 6.329 2.204 -6.852 1.00 0.00 C ATOM 240 O LEU A 18 5.615 1.945 -7.821 1.00 0.00 O ATOM 241 CB LEU A 18 5.581 2.622 -4.502 1.00 0.00 C ATOM 242 CG LEU A 18 4.990 2.096 -3.193 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.051 3.165 -2.113 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.557 1.630 -3.404 1.00 0.00 C ATOM 0 H LEU A 18 7.547 1.206 -4.055 1.00 0.00 H new ATOM 0 HA LEU A 18 5.287 0.807 -5.615 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.420 3.275 -4.262 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.829 3.238 -4.996 1.00 0.00 H new ATOM 0 HG LEU A 18 5.584 1.243 -2.865 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.626 2.773 -1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.089 3.451 -1.943 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.482 4.038 -2.432 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.153 1.259 -2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.951 2.465 -3.755 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.540 0.832 -4.146 1.00 0.00 H new ATOM 256 N ILE A 19 7.361 3.039 -6.914 1.00 0.00 N ATOM 257 CA ILE A 19 7.722 3.714 -8.154 1.00 0.00 C ATOM 258 C ILE A 19 7.900 2.715 -9.293 1.00 0.00 C ATOM 259 O ILE A 19 7.461 2.955 -10.418 1.00 0.00 O ATOM 260 CB ILE A 19 9.019 4.529 -7.994 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.873 5.542 -6.856 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.366 5.234 -9.297 1.00 0.00 C ATOM 263 CD1 ILE A 19 10.178 6.192 -6.454 1.00 0.00 C ATOM 0 H ILE A 19 7.961 3.264 -6.121 1.00 0.00 H new ATOM 0 HA ILE A 19 6.903 4.392 -8.394 1.00 0.00 H new ATOM 0 HB ILE A 19 9.832 3.846 -7.746 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.169 6.317 -7.159 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.443 5.042 -5.988 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.285 5.806 -9.168 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.507 4.494 -10.085 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.555 5.908 -9.573 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.998 6.898 -5.643 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.878 5.426 -6.120 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.599 6.721 -7.309 1.00 0.00 H new ATOM 275 N HIS A 20 8.547 1.593 -8.992 1.00 0.00 N ATOM 276 CA HIS A 20 8.781 0.555 -9.990 1.00 0.00 C ATOM 277 C HIS A 20 7.491 -0.195 -10.307 1.00 0.00 C ATOM 278 O HIS A 20 7.289 -0.655 -11.431 1.00 0.00 O ATOM 279 CB HIS A 20 9.847 -0.424 -9.497 1.00 0.00 C ATOM 280 CG HIS A 20 11.239 0.126 -9.556 1.00 0.00 C ATOM 281 ND1 HIS A 20 12.135 -0.199 -10.552 1.00 0.00 N ATOM 282 CD2 HIS A 20 11.886 0.986 -8.735 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.274 0.436 -10.340 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.149 1.162 -9.243 1.00 0.00 N ATOM 0 H HIS A 20 8.918 1.380 -8.066 1.00 0.00 H new ATOM 0 HA HIS A 20 9.134 1.035 -10.903 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.621 -0.708 -8.469 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.799 -1.333 -10.096 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.483 1.448 -7.846 1.00 0.00 H new ATOM 0 HE1 HIS A 20 14.157 0.373 -10.958 1.00 0.00 H new ATOM 0 HE2 HIS A 20 13.873 1.756 -8.839 1.00 0.00 H new ATOM 293 N CYS A 21 6.623 -0.316 -9.309 1.00 0.00 N ATOM 294 CA CYS A 21 5.353 -1.012 -9.481 1.00 0.00 C ATOM 295 C CYS A 21 4.386 -0.181 -10.318 1.00 0.00 C ATOM 296 O CYS A 21 3.243 -0.579 -10.544 1.00 0.00 O ATOM 297 CB CYS A 21 4.730 -1.324 -8.119 1.00 0.00 C ATOM 298 SG CYS A 21 5.519 -2.694 -7.243 1.00 0.00 S ATOM 0 H CYS A 21 6.775 0.059 -8.373 1.00 0.00 H new ATOM 0 HA CYS A 21 5.548 -1.947 -10.006 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.780 -0.431 -7.496 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.674 -1.556 -8.259 1.00 0.00 H new ATOM 0 HG CYS A 21 5.620 -2.401 -5.981 1.00 0.00 H new ATOM 304 N LYS A 22 4.851 0.976 -10.774 1.00 0.00 N ATOM 305 CA LYS A 22 4.029 1.865 -11.586 1.00 0.00 C ATOM 306 C LYS A 22 2.851 2.405 -10.780 1.00 0.00 C ATOM 307 O LYS A 22 1.715 2.418 -11.255 1.00 0.00 O ATOM 308 CB LYS A 22 3.517 1.129 -12.827 1.00 0.00 C ATOM 309 CG LYS A 22 4.618 0.479 -13.645 1.00 0.00 C ATOM 310 CD LYS A 22 5.547 1.516 -14.255 1.00 0.00 C ATOM 311 CE LYS A 22 6.557 0.876 -15.194 1.00 0.00 C ATOM 312 NZ LYS A 22 7.803 0.477 -14.482 1.00 0.00 N ATOM 0 H LYS A 22 5.794 1.321 -10.595 1.00 0.00 H new ATOM 0 HA LYS A 22 4.648 2.706 -11.899 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.806 0.363 -12.517 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.974 1.832 -13.458 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.192 -0.197 -13.011 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.176 -0.125 -14.437 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.960 2.256 -14.800 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.072 2.047 -13.461 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.111 -0.001 -15.664 1.00 0.00 H new ATOM 0 HE3 LYS A 22 6.804 1.575 -15.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 8.293 -0.261 -15.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 8.425 1.304 -14.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 7.562 0.109 -13.540 1.00 0.00 H new ATOM 326 N VAL A 23 3.130 2.850 -9.559 1.00 0.00 N ATOM 327 CA VAL A 23 2.095 3.393 -8.689 1.00 0.00 C ATOM 328 C VAL A 23 2.426 4.820 -8.264 1.00 0.00 C ATOM 329 O VAL A 23 1.535 5.606 -7.942 1.00 0.00 O ATOM 330 CB VAL A 23 1.907 2.525 -7.430 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.289 1.184 -7.794 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.235 2.332 -6.714 1.00 0.00 C ATOM 0 H VAL A 23 4.065 2.845 -9.150 1.00 0.00 H new ATOM 0 HA VAL A 23 1.168 3.394 -9.263 1.00 0.00 H new ATOM 0 HB VAL A 23 1.226 3.040 -6.752 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.164 0.584 -6.892 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.317 1.346 -8.260 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.943 0.659 -8.491 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.084 1.717 -5.827 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.940 1.838 -7.382 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.634 3.303 -6.419 1.00 0.00 H new ATOM 342 N LEU A 24 3.714 5.147 -8.264 1.00 0.00 N ATOM 343 CA LEU A 24 4.164 6.480 -7.879 1.00 0.00 C ATOM 344 C LEU A 24 5.206 7.007 -8.861 1.00 0.00 C ATOM 345 O LEU A 24 5.979 6.251 -9.449 1.00 0.00 O ATOM 346 CB LEU A 24 4.747 6.454 -6.465 1.00 0.00 C ATOM 347 CG LEU A 24 3.749 6.212 -5.332 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.479 5.955 -4.023 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.802 7.395 -5.194 1.00 0.00 C ATOM 0 H LEU A 24 4.464 4.508 -8.526 1.00 0.00 H new ATOM 0 HA LEU A 24 3.303 7.148 -7.898 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.510 5.677 -6.422 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.249 7.404 -6.283 1.00 0.00 H new ATOM 0 HG LEU A 24 3.160 5.327 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.752 5.785 -3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.115 5.076 -4.128 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.094 6.820 -3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.099 7.205 -4.383 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.375 8.296 -4.974 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.253 7.532 -6.126 1.00 0.00 H new ATOM 361 N PRO A 25 5.229 8.336 -9.042 1.00 0.00 N ATOM 362 CA PRO A 25 6.173 8.995 -9.950 1.00 0.00 C ATOM 363 C PRO A 25 7.607 8.941 -9.434 1.00 0.00 C ATOM 364 O PRO A 25 7.848 8.612 -8.272 1.00 0.00 O ATOM 365 CB PRO A 25 5.673 10.441 -9.993 1.00 0.00 C ATOM 366 CG PRO A 25 4.950 10.630 -8.704 1.00 0.00 C ATOM 367 CD PRO A 25 4.336 9.298 -8.374 1.00 0.00 C ATOM 0 HA PRO A 25 6.205 8.512 -10.927 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.501 11.143 -10.089 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.014 10.607 -10.845 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.633 10.951 -7.917 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.185 11.401 -8.795 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.296 9.129 -7.298 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.314 9.223 -8.746 1.00 0.00 H new ATOM 375 N THR A 26 8.557 9.268 -10.305 1.00 0.00 N ATOM 376 CA THR A 26 9.967 9.256 -9.938 1.00 0.00 C ATOM 377 C THR A 26 10.315 10.449 -9.055 1.00 0.00 C ATOM 378 O THR A 26 11.202 10.368 -8.207 1.00 0.00 O ATOM 379 CB THR A 26 10.872 9.273 -11.184 1.00 0.00 C ATOM 380 OG1 THR A 26 10.732 10.519 -11.875 1.00 0.00 O ATOM 381 CG2 THR A 26 10.525 8.126 -12.121 1.00 0.00 C ATOM 0 H THR A 26 8.375 9.544 -11.270 1.00 0.00 H new ATOM 0 HA THR A 26 10.142 8.334 -9.384 1.00 0.00 H new ATOM 0 HB THR A 26 11.905 9.154 -10.857 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.312 10.522 -12.665 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.177 8.159 -12.994 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.662 7.178 -11.601 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.487 8.218 -12.440 1.00 0.00 H new ATOM 389 N ASN A 27 9.610 11.557 -9.260 1.00 0.00 N ATOM 390 CA ASN A 27 9.844 12.768 -8.482 1.00 0.00 C ATOM 391 C ASN A 27 8.717 12.998 -7.480 1.00 0.00 C ATOM 392 O ASN A 27 8.447 14.131 -7.082 1.00 0.00 O ATOM 393 CB ASN A 27 9.973 13.978 -9.409 1.00 0.00 C ATOM 394 CG ASN A 27 11.399 14.200 -9.875 1.00 0.00 C ATOM 395 OD1 ASN A 27 11.750 13.878 -11.010 1.00 0.00 O ATOM 396 ND2 ASN A 27 12.229 14.753 -8.997 1.00 0.00 N ATOM 0 H ASN A 27 8.872 11.641 -9.959 1.00 0.00 H new ATOM 0 HA ASN A 27 10.775 12.641 -7.930 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.328 13.838 -10.276 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.620 14.869 -8.890 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.201 14.927 -9.253 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.894 15.004 -8.067 1.00 0.00 H new ATOM 403 N HIS A 28 8.060 11.914 -7.077 1.00 0.00 N ATOM 404 CA HIS A 28 6.962 11.998 -6.121 1.00 0.00 C ATOM 405 C HIS A 28 7.373 12.799 -4.889 1.00 0.00 C ATOM 406 O HIS A 28 8.484 13.325 -4.822 1.00 0.00 O ATOM 407 CB HIS A 28 6.512 10.597 -5.705 1.00 0.00 C ATOM 408 CG HIS A 28 5.077 10.529 -5.283 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.645 9.793 -4.200 1.00 0.00 N ATOM 410 CD2 HIS A 28 3.972 11.113 -5.803 1.00 0.00 C ATOM 411 CE1 HIS A 28 3.337 9.925 -4.073 1.00 0.00 C ATOM 412 NE2 HIS A 28 2.904 10.722 -5.034 1.00 0.00 N ATOM 0 H HIS A 28 8.269 10.969 -7.398 1.00 0.00 H new ATOM 0 HA HIS A 28 6.131 12.511 -6.605 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.670 9.912 -6.538 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.140 10.251 -4.884 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.937 11.765 -6.663 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.726 9.461 -3.313 1.00 0.00 H new ATOM 0 HE2 HIS A 28 1.934 11.001 -5.181 1.00 0.00 H new ATOM 421 N ARG A 29 6.470 12.887 -3.918 1.00 0.00 N ATOM 422 CA ARG A 29 6.739 13.626 -2.690 1.00 0.00 C ATOM 423 C ARG A 29 7.291 12.701 -1.609 1.00 0.00 C ATOM 424 O ARG A 29 7.892 13.155 -0.636 1.00 0.00 O ATOM 425 CB ARG A 29 5.464 14.307 -2.190 1.00 0.00 C ATOM 426 CG ARG A 29 4.295 13.353 -2.006 1.00 0.00 C ATOM 427 CD ARG A 29 3.422 13.295 -3.250 1.00 0.00 C ATOM 428 NE ARG A 29 2.337 14.272 -3.203 1.00 0.00 N ATOM 429 CZ ARG A 29 1.193 14.069 -2.558 1.00 0.00 C ATOM 430 NH1 ARG A 29 0.986 12.931 -1.910 1.00 0.00 N ATOM 431 NH2 ARG A 29 0.254 15.006 -2.561 1.00 0.00 N ATOM 0 H ARG A 29 5.546 12.456 -3.958 1.00 0.00 H new ATOM 0 HA ARG A 29 7.487 14.387 -2.910 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.674 14.799 -1.240 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.178 15.087 -2.896 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.670 12.356 -1.777 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.695 13.671 -1.154 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.036 13.477 -4.132 1.00 0.00 H new ATOM 0 HD3 ARG A 29 3.004 12.294 -3.353 1.00 0.00 H new ATOM 0 HE ARG A 29 2.464 15.158 -3.692 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.706 12.208 -1.906 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.107 12.778 -1.416 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.410 15.883 -3.059 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.624 14.850 -2.066 1.00 0.00 H new ATOM 445 N VAL A 30 7.083 11.400 -1.787 1.00 0.00 N ATOM 446 CA VAL A 30 7.560 10.411 -0.828 1.00 0.00 C ATOM 447 C VAL A 30 9.065 10.205 -0.954 1.00 0.00 C ATOM 448 O VAL A 30 9.750 9.931 0.032 1.00 0.00 O ATOM 449 CB VAL A 30 6.849 9.057 -1.018 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.351 9.206 -0.804 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.146 8.490 -2.398 1.00 0.00 C ATOM 0 H VAL A 30 6.587 11.007 -2.587 1.00 0.00 H new ATOM 0 HA VAL A 30 7.331 10.797 0.165 1.00 0.00 H new ATOM 0 HB VAL A 30 7.229 8.358 -0.273 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.866 8.240 -0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.162 9.565 0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.950 9.920 -1.524 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.636 7.534 -2.516 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.794 9.185 -3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.221 8.344 -2.508 1.00 0.00 H new ATOM 461 N THR A 31 9.575 10.338 -2.174 1.00 0.00 N ATOM 462 CA THR A 31 11.000 10.166 -2.430 1.00 0.00 C ATOM 463 C THR A 31 11.816 11.261 -1.753 1.00 0.00 C ATOM 464 O THR A 31 12.911 11.010 -1.249 1.00 0.00 O ATOM 465 CB THR A 31 11.304 10.174 -3.940 1.00 0.00 C ATOM 466 OG1 THR A 31 10.935 11.436 -4.508 1.00 0.00 O ATOM 467 CG2 THR A 31 10.556 9.055 -4.649 1.00 0.00 C ATOM 0 H THR A 31 9.022 10.564 -3.001 1.00 0.00 H new ATOM 0 HA THR A 31 11.281 9.198 -2.015 1.00 0.00 H new ATOM 0 HB THR A 31 12.374 10.015 -4.073 1.00 0.00 H new ATOM 0 HG1 THR A 31 11.133 11.433 -5.468 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.787 9.081 -5.714 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.861 8.094 -4.235 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.483 9.187 -4.507 1.00 0.00 H new ATOM 475 N TRP A 32 11.277 12.475 -1.745 1.00 0.00 N ATOM 476 CA TRP A 32 11.957 13.608 -1.128 1.00 0.00 C ATOM 477 C TRP A 32 12.378 13.280 0.300 1.00 0.00 C ATOM 478 O TRP A 32 11.600 12.720 1.073 1.00 0.00 O ATOM 479 CB TRP A 32 11.048 14.839 -1.135 1.00 0.00 C ATOM 480 CG TRP A 32 10.863 15.433 -2.499 1.00 0.00 C ATOM 481 CD1 TRP A 32 10.698 14.754 -3.672 1.00 0.00 C ATOM 482 CD2 TRP A 32 10.824 16.825 -2.829 1.00 0.00 C ATOM 483 NE1 TRP A 32 10.560 15.641 -4.713 1.00 0.00 N ATOM 484 CE2 TRP A 32 10.633 16.918 -4.222 1.00 0.00 C ATOM 485 CE3 TRP A 32 10.930 18.003 -2.084 1.00 0.00 C ATOM 486 CZ2 TRP A 32 10.547 18.141 -4.881 1.00 0.00 C ATOM 487 CZ3 TRP A 32 10.846 19.216 -2.740 1.00 0.00 C ATOM 488 CH2 TRP A 32 10.655 19.278 -4.127 1.00 0.00 C ATOM 0 H TRP A 32 10.372 12.700 -2.158 1.00 0.00 H new ATOM 0 HA TRP A 32 12.853 13.822 -1.710 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.074 14.565 -0.731 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.467 15.595 -0.471 1.00 0.00 H new ATOM 0 HD1 TRP A 32 10.679 13.678 -3.768 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.425 15.389 -5.692 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.075 17.966 -1.014 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 10.400 18.191 -5.950 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 10.929 20.132 -2.174 1.00 0.00 H new ATOM 0 HH2 TRP A 32 10.592 20.242 -4.610 1.00 0.00 H new ATOM 499 N ASP A 33 13.612 13.631 0.644 1.00 0.00 N ATOM 500 CA ASP A 33 14.135 13.374 1.981 1.00 0.00 C ATOM 501 C ASP A 33 13.183 13.903 3.048 1.00 0.00 C ATOM 502 O ASP A 33 12.999 13.281 4.094 1.00 0.00 O ATOM 503 CB ASP A 33 15.513 14.017 2.144 1.00 0.00 C ATOM 504 CG ASP A 33 16.159 13.671 3.471 1.00 0.00 C ATOM 505 OD1 ASP A 33 15.886 12.571 3.996 1.00 0.00 O ATOM 506 OD2 ASP A 33 16.939 14.501 3.985 1.00 0.00 O ATOM 0 H ASP A 33 14.269 14.094 0.016 1.00 0.00 H new ATOM 0 HA ASP A 33 14.229 12.295 2.107 1.00 0.00 H new ATOM 0 HB2 ASP A 33 16.162 13.690 1.331 1.00 0.00 H new ATOM 0 HB3 ASP A 33 15.418 15.100 2.061 1.00 0.00 H new ATOM 511 N SER A 34 12.581 15.057 2.777 1.00 0.00 N ATOM 512 CA SER A 34 11.651 15.673 3.717 1.00 0.00 C ATOM 513 C SER A 34 10.487 14.736 4.022 1.00 0.00 C ATOM 514 O SER A 34 10.076 14.594 5.173 1.00 0.00 O ATOM 515 CB SER A 34 11.123 16.994 3.152 1.00 0.00 C ATOM 516 OG SER A 34 11.989 18.069 3.475 1.00 0.00 O ATOM 0 H SER A 34 12.720 15.584 1.915 1.00 0.00 H new ATOM 0 HA SER A 34 12.188 15.871 4.645 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.023 16.916 2.069 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.128 17.192 3.551 1.00 0.00 H new ATOM 0 HG SER A 34 11.631 18.901 3.102 1.00 0.00 H new ATOM 522 N ALA A 35 9.959 14.099 2.982 1.00 0.00 N ATOM 523 CA ALA A 35 8.844 13.174 3.138 1.00 0.00 C ATOM 524 C ALA A 35 9.052 12.261 4.341 1.00 0.00 C ATOM 525 O ALA A 35 10.168 12.123 4.840 1.00 0.00 O ATOM 526 CB ALA A 35 8.661 12.350 1.872 1.00 0.00 C ATOM 0 H ALA A 35 10.286 14.207 2.022 1.00 0.00 H new ATOM 0 HA ALA A 35 7.941 13.759 3.311 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.825 11.663 2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.457 13.014 1.032 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.570 11.782 1.673 1.00 0.00 H new ATOM 532 N GLN A 36 7.971 11.641 4.802 1.00 0.00 N ATOM 533 CA GLN A 36 8.036 10.742 5.948 1.00 0.00 C ATOM 534 C GLN A 36 6.945 9.679 5.869 1.00 0.00 C ATOM 535 O GLN A 36 5.962 9.837 5.145 1.00 0.00 O ATOM 536 CB GLN A 36 7.902 11.532 7.251 1.00 0.00 C ATOM 537 CG GLN A 36 9.044 12.507 7.492 1.00 0.00 C ATOM 538 CD GLN A 36 8.770 13.454 8.643 1.00 0.00 C ATOM 539 OE1 GLN A 36 7.713 14.083 8.707 1.00 0.00 O ATOM 540 NE2 GLN A 36 9.722 13.561 9.562 1.00 0.00 N ATOM 0 H GLN A 36 7.039 11.745 4.400 1.00 0.00 H new ATOM 0 HA GLN A 36 9.005 10.243 5.932 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.962 12.083 7.237 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.850 10.833 8.086 1.00 0.00 H new ATOM 0 HG2 GLN A 36 9.957 11.948 7.696 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.220 13.085 6.585 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.583 13.021 9.470 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.593 14.183 10.360 1.00 0.00 H new ATOM 549 N VAL A 37 7.125 8.597 6.619 1.00 0.00 N ATOM 550 CA VAL A 37 6.156 7.508 6.635 1.00 0.00 C ATOM 551 C VAL A 37 4.736 8.033 6.457 1.00 0.00 C ATOM 552 O VAL A 37 3.978 7.536 5.624 1.00 0.00 O ATOM 553 CB VAL A 37 6.233 6.706 7.948 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.367 5.694 7.890 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.404 7.643 9.134 1.00 0.00 C ATOM 0 H VAL A 37 7.933 8.451 7.224 1.00 0.00 H new ATOM 0 HA VAL A 37 6.405 6.851 5.801 1.00 0.00 H new ATOM 0 HB VAL A 37 5.298 6.161 8.076 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.406 5.137 8.826 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.197 5.004 7.064 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.312 6.215 7.738 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.457 7.060 10.054 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.323 8.217 9.015 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.555 8.325 9.185 1.00 0.00 H new ATOM 565 N PHE A 38 4.381 9.044 7.244 1.00 0.00 N ATOM 566 CA PHE A 38 3.051 9.638 7.174 1.00 0.00 C ATOM 567 C PHE A 38 2.675 9.959 5.730 1.00 0.00 C ATOM 568 O PHE A 38 1.675 9.460 5.213 1.00 0.00 O ATOM 569 CB PHE A 38 2.992 10.909 8.023 1.00 0.00 C ATOM 570 CG PHE A 38 1.628 11.191 8.585 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.488 10.814 7.894 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.486 11.833 9.805 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.768 11.074 8.409 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.233 12.095 10.325 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.896 11.713 9.626 1.00 0.00 C ATOM 0 H PHE A 38 4.996 9.469 7.938 1.00 0.00 H new ATOM 0 HA PHE A 38 2.336 8.915 7.565 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.704 10.821 8.844 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.309 11.757 7.416 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.582 10.312 6.943 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.365 12.132 10.356 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.649 10.777 7.859 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.136 12.597 11.276 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.877 11.914 10.031 1.00 0.00 H new ATOM 585 N ASP A 39 3.482 10.794 5.086 1.00 0.00 N ATOM 586 CA ASP A 39 3.235 11.182 3.703 1.00 0.00 C ATOM 587 C ASP A 39 2.807 9.978 2.869 1.00 0.00 C ATOM 588 O ASP A 39 1.718 9.964 2.294 1.00 0.00 O ATOM 589 CB ASP A 39 4.488 11.818 3.097 1.00 0.00 C ATOM 590 CG ASP A 39 4.600 13.295 3.419 1.00 0.00 C ATOM 591 OD1 ASP A 39 3.580 14.007 3.303 1.00 0.00 O ATOM 592 OD2 ASP A 39 5.707 13.739 3.788 1.00 0.00 O ATOM 0 H ASP A 39 4.313 11.215 5.500 1.00 0.00 H new ATOM 0 HA ASP A 39 2.426 11.913 3.696 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.372 11.300 3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.473 11.685 2.015 1.00 0.00 H new ATOM 597 N LEU A 40 3.671 8.971 2.807 1.00 0.00 N ATOM 598 CA LEU A 40 3.383 7.762 2.042 1.00 0.00 C ATOM 599 C LEU A 40 2.160 7.043 2.601 1.00 0.00 C ATOM 600 O LEU A 40 1.480 6.308 1.886 1.00 0.00 O ATOM 601 CB LEU A 40 4.592 6.825 2.059 1.00 0.00 C ATOM 602 CG LEU A 40 4.363 5.424 1.491 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.027 5.496 0.010 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.586 4.548 1.721 1.00 0.00 C ATOM 0 H LEU A 40 4.576 8.967 3.277 1.00 0.00 H new ATOM 0 HA LEU A 40 3.171 8.054 1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.399 7.296 1.497 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.936 6.726 3.089 1.00 0.00 H new ATOM 0 HG LEU A 40 3.517 4.976 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.868 4.489 -0.376 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.121 6.086 -0.129 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.851 5.965 -0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.405 3.555 1.310 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.450 4.993 1.227 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.780 4.468 2.791 1.00 0.00 H new ATOM 616 N ALA A 41 1.885 7.262 3.883 1.00 0.00 N ATOM 617 CA ALA A 41 0.741 6.638 4.536 1.00 0.00 C ATOM 618 C ALA A 41 -0.548 7.391 4.222 1.00 0.00 C ATOM 619 O ALA A 41 -1.643 6.843 4.348 1.00 0.00 O ATOM 620 CB ALA A 41 0.963 6.572 6.040 1.00 0.00 C ATOM 0 H ALA A 41 2.439 7.867 4.490 1.00 0.00 H new ATOM 0 HA ALA A 41 0.642 5.624 4.150 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.101 6.104 6.515 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.857 5.985 6.250 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.091 7.580 6.434 1.00 0.00 H new ATOM 626 N GLN A 42 -0.409 8.648 3.815 1.00 0.00 N ATOM 627 CA GLN A 42 -1.564 9.475 3.486 1.00 0.00 C ATOM 628 C GLN A 42 -2.056 9.184 2.072 1.00 0.00 C ATOM 629 O GLN A 42 -3.233 8.888 1.861 1.00 0.00 O ATOM 630 CB GLN A 42 -1.211 10.958 3.620 1.00 0.00 C ATOM 631 CG GLN A 42 -0.717 11.342 5.005 1.00 0.00 C ATOM 632 CD GLN A 42 -1.052 12.776 5.367 1.00 0.00 C ATOM 633 OE1 GLN A 42 -2.163 13.248 5.120 1.00 0.00 O ATOM 634 NE2 GLN A 42 -0.091 13.478 5.956 1.00 0.00 N ATOM 0 H GLN A 42 0.491 9.116 3.705 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.363 9.234 4.187 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.444 11.208 2.887 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -2.090 11.556 3.378 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.159 10.672 5.743 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.363 11.202 5.053 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.815 13.047 6.142 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -0.258 14.448 6.223 1.00 0.00 H new ATOM 643 N THR A 43 -1.148 9.271 1.104 1.00 0.00 N ATOM 644 CA THR A 43 -1.490 9.018 -0.290 1.00 0.00 C ATOM 645 C THR A 43 -2.238 7.698 -0.442 1.00 0.00 C ATOM 646 O THR A 43 -2.996 7.508 -1.394 1.00 0.00 O ATOM 647 CB THR A 43 -0.234 8.989 -1.180 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.591 9.254 -2.541 1.00 0.00 O ATOM 649 CG2 THR A 43 0.464 7.641 -1.087 1.00 0.00 C ATOM 0 H THR A 43 -0.170 9.515 1.261 1.00 0.00 H new ATOM 0 HA THR A 43 -2.135 9.836 -0.611 1.00 0.00 H new ATOM 0 HB THR A 43 0.451 9.760 -0.828 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.214 9.235 -3.100 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.348 7.644 -1.724 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.761 7.456 -0.055 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.217 6.855 -1.415 1.00 0.00 H new ATOM 657 N LEU A 44 -2.020 6.788 0.501 1.00 0.00 N ATOM 658 CA LEU A 44 -2.674 5.485 0.472 1.00 0.00 C ATOM 659 C LEU A 44 -3.846 5.442 1.448 1.00 0.00 C ATOM 660 O LEU A 44 -4.839 4.754 1.211 1.00 0.00 O ATOM 661 CB LEU A 44 -1.671 4.381 0.813 1.00 0.00 C ATOM 662 CG LEU A 44 -0.389 4.359 -0.020 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.618 3.388 0.577 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.697 3.990 -1.464 1.00 0.00 C ATOM 0 H LEU A 44 -1.395 6.929 1.295 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.057 5.321 -0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.397 4.479 1.863 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.169 3.418 0.702 1.00 0.00 H new ATOM 0 HG LEU A 44 0.048 5.358 -0.007 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.524 3.385 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.862 3.696 1.594 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.190 2.386 0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.227 3.979 -2.042 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.157 3.002 -1.497 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.382 4.724 -1.889 1.00 0.00 H new ATOM 676 N ARG A 45 -3.723 6.182 2.545 1.00 0.00 N ATOM 677 CA ARG A 45 -4.772 6.229 3.556 1.00 0.00 C ATOM 678 C ARG A 45 -6.154 6.194 2.908 1.00 0.00 C ATOM 679 O ARG A 45 -7.036 5.453 3.344 1.00 0.00 O ATOM 680 CB ARG A 45 -4.630 7.490 4.411 1.00 0.00 C ATOM 681 CG ARG A 45 -5.720 7.641 5.459 1.00 0.00 C ATOM 682 CD ARG A 45 -6.007 9.104 5.758 1.00 0.00 C ATOM 683 NE ARG A 45 -7.320 9.290 6.370 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.982 10.442 6.352 1.00 0.00 C ATOM 685 NH1 ARG A 45 -7.457 11.504 5.757 1.00 0.00 N ATOM 686 NH2 ARG A 45 -9.173 10.533 6.931 1.00 0.00 N ATOM 0 H ARG A 45 -2.907 6.757 2.756 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.666 5.352 4.194 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.660 7.475 4.908 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.641 8.364 3.759 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.631 7.154 5.111 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.418 7.134 6.375 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.238 9.496 6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.953 9.680 4.834 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.752 8.492 6.836 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -6.542 11.438 5.311 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.968 12.387 5.745 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.580 9.718 7.390 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.681 11.418 6.917 1.00 0.00 H new ATOM 700 N ASP A 46 -6.334 6.998 1.867 1.00 0.00 N ATOM 701 CA ASP A 46 -7.607 7.059 1.159 1.00 0.00 C ATOM 702 C ASP A 46 -8.044 5.669 0.707 1.00 0.00 C ATOM 703 O ASP A 46 -9.178 5.256 0.945 1.00 0.00 O ATOM 704 CB ASP A 46 -7.499 7.991 -0.049 1.00 0.00 C ATOM 705 CG ASP A 46 -6.225 7.769 -0.840 1.00 0.00 C ATOM 706 OD1 ASP A 46 -5.172 8.297 -0.428 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.282 7.067 -1.872 1.00 0.00 O ATOM 0 H ASP A 46 -5.614 7.617 1.494 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.358 7.452 1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.359 7.837 -0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.537 9.026 0.290 1.00 0.00 H new ATOM 712 N GLY A 47 -7.136 4.952 0.052 1.00 0.00 N ATOM 713 CA GLY A 47 -7.447 3.617 -0.424 1.00 0.00 C ATOM 714 C GLY A 47 -7.769 3.590 -1.905 1.00 0.00 C ATOM 715 O GLY A 47 -8.502 2.718 -2.373 1.00 0.00 O ATOM 0 H GLY A 47 -6.190 5.272 -0.157 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.601 2.958 -0.227 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.295 3.223 0.136 1.00 0.00 H new ATOM 719 N VAL A 48 -7.222 4.549 -2.646 1.00 0.00 N ATOM 720 CA VAL A 48 -7.456 4.632 -4.083 1.00 0.00 C ATOM 721 C VAL A 48 -6.262 4.098 -4.866 1.00 0.00 C ATOM 722 O VAL A 48 -6.423 3.477 -5.917 1.00 0.00 O ATOM 723 CB VAL A 48 -7.738 6.081 -4.522 1.00 0.00 C ATOM 724 CG1 VAL A 48 -7.939 6.153 -6.028 1.00 0.00 C ATOM 725 CG2 VAL A 48 -8.950 6.634 -3.788 1.00 0.00 C ATOM 0 H VAL A 48 -6.614 5.279 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.331 4.018 -4.298 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.875 6.694 -4.264 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.137 7.184 -6.320 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.040 5.800 -6.532 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.784 5.527 -6.313 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.134 7.659 -4.111 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.822 6.020 -4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.763 6.620 -2.714 1.00 0.00 H new ATOM 735 N LEU A 49 -5.064 4.344 -4.347 1.00 0.00 N ATOM 736 CA LEU A 49 -3.841 3.887 -4.997 1.00 0.00 C ATOM 737 C LEU A 49 -3.553 2.429 -4.653 1.00 0.00 C ATOM 738 O LEU A 49 -3.300 1.610 -5.538 1.00 0.00 O ATOM 739 CB LEU A 49 -2.659 4.764 -4.579 1.00 0.00 C ATOM 740 CG LEU A 49 -1.330 4.479 -5.279 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.441 4.760 -6.770 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.213 5.307 -4.661 1.00 0.00 C ATOM 0 H LEU A 49 -4.914 4.857 -3.478 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.981 3.966 -6.075 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.925 5.806 -4.758 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.512 4.652 -3.505 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.090 3.424 -5.145 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.486 4.552 -7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.212 4.124 -7.204 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.705 5.806 -6.924 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.725 5.091 -5.172 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.446 6.367 -4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.117 5.057 -3.604 1.00 0.00 H new ATOM 754 N LEU A 50 -3.595 2.111 -3.364 1.00 0.00 N ATOM 755 CA LEU A 50 -3.341 0.751 -2.903 1.00 0.00 C ATOM 756 C LEU A 50 -3.926 -0.271 -3.872 1.00 0.00 C ATOM 757 O LEU A 50 -3.229 -1.176 -4.332 1.00 0.00 O ATOM 758 CB LEU A 50 -3.934 0.545 -1.508 1.00 0.00 C ATOM 759 CG LEU A 50 -3.014 0.877 -0.332 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.808 0.945 0.963 1.00 0.00 C ATOM 761 CD2 LEU A 50 -1.897 -0.151 -0.222 1.00 0.00 C ATOM 0 H LEU A 50 -3.803 2.777 -2.620 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.262 0.605 -2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.833 1.155 -1.424 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.245 -0.496 -1.417 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.565 1.854 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.137 1.182 1.789 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.571 1.719 0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.285 -0.017 1.148 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.252 0.101 0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.327 -1.140 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.311 -0.151 -1.141 1.00 0.00 H new ATOM 773 N CYS A 51 -5.209 -0.119 -4.181 1.00 0.00 N ATOM 774 CA CYS A 51 -5.889 -1.028 -5.097 1.00 0.00 C ATOM 775 C CYS A 51 -5.157 -1.100 -6.433 1.00 0.00 C ATOM 776 O CYS A 51 -4.992 -2.178 -7.004 1.00 0.00 O ATOM 777 CB CYS A 51 -7.334 -0.578 -5.317 1.00 0.00 C ATOM 778 SG CYS A 51 -8.492 -1.179 -4.065 1.00 0.00 S ATOM 0 H CYS A 51 -5.800 0.626 -3.810 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.890 -2.022 -4.649 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.366 0.511 -5.333 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.665 -0.921 -6.297 1.00 0.00 H new ATOM 0 HG CYS A 51 -8.258 -0.581 -2.935 1.00 0.00 H new ATOM 784 N GLN A 52 -4.722 0.055 -6.927 1.00 0.00 N ATOM 785 CA GLN A 52 -4.010 0.123 -8.198 1.00 0.00 C ATOM 786 C GLN A 52 -2.815 -0.824 -8.203 1.00 0.00 C ATOM 787 O GLN A 52 -2.642 -1.617 -9.129 1.00 0.00 O ATOM 788 CB GLN A 52 -3.544 1.554 -8.469 1.00 0.00 C ATOM 789 CG GLN A 52 -4.677 2.566 -8.512 1.00 0.00 C ATOM 790 CD GLN A 52 -4.319 3.811 -9.299 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.563 4.661 -8.828 1.00 0.00 O ATOM 792 NE2 GLN A 52 -4.861 3.925 -10.506 1.00 0.00 N ATOM 0 H GLN A 52 -4.850 0.956 -6.467 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.696 -0.183 -8.988 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.834 1.848 -7.696 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.009 1.579 -9.419 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.557 2.101 -8.956 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.945 2.849 -7.494 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.482 3.196 -10.857 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.656 4.741 -11.082 1.00 0.00 H new ATOM 801 N LEU A 53 -1.992 -0.736 -7.164 1.00 0.00 N ATOM 802 CA LEU A 53 -0.812 -1.585 -7.048 1.00 0.00 C ATOM 803 C LEU A 53 -1.089 -2.981 -7.596 1.00 0.00 C ATOM 804 O LEU A 53 -0.505 -3.393 -8.600 1.00 0.00 O ATOM 805 CB LEU A 53 -0.367 -1.677 -5.587 1.00 0.00 C ATOM 806 CG LEU A 53 0.712 -2.716 -5.279 1.00 0.00 C ATOM 807 CD1 LEU A 53 2.003 -2.377 -6.008 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.952 -2.806 -3.779 1.00 0.00 C ATOM 0 H LEU A 53 -2.120 -0.085 -6.389 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.013 -1.136 -7.637 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.000 -0.698 -5.277 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.241 -1.898 -4.975 1.00 0.00 H new ATOM 0 HG LEU A 53 0.365 -3.688 -5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.759 -3.127 -5.777 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.821 -2.364 -7.083 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.355 -1.396 -5.688 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.723 -3.550 -3.578 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.278 -1.836 -3.404 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.028 -3.097 -3.279 1.00 0.00 H new ATOM 820 N LEU A 54 -1.985 -3.704 -6.933 1.00 0.00 N ATOM 821 CA LEU A 54 -2.342 -5.054 -7.356 1.00 0.00 C ATOM 822 C LEU A 54 -2.732 -5.078 -8.830 1.00 0.00 C ATOM 823 O LEU A 54 -2.289 -5.942 -9.585 1.00 0.00 O ATOM 824 CB LEU A 54 -3.494 -5.588 -6.503 1.00 0.00 C ATOM 825 CG LEU A 54 -3.318 -5.472 -4.988 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.551 -5.994 -4.266 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.075 -6.224 -4.537 1.00 0.00 C ATOM 0 H LEU A 54 -2.477 -3.378 -6.101 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.470 -5.694 -7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.404 -5.058 -6.784 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.647 -6.638 -6.751 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.193 -4.419 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.408 -5.904 -3.189 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.422 -5.412 -4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.708 -7.041 -4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.965 -6.131 -3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.170 -7.277 -4.803 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.197 -5.804 -5.028 1.00 0.00 H new ATOM 839 N ASN A 55 -3.562 -4.122 -9.233 1.00 0.00 N ATOM 840 CA ASN A 55 -4.011 -4.032 -10.618 1.00 0.00 C ATOM 841 C ASN A 55 -2.822 -3.945 -11.570 1.00 0.00 C ATOM 842 O ASN A 55 -2.891 -4.405 -12.709 1.00 0.00 O ATOM 843 CB ASN A 55 -4.918 -2.814 -10.804 1.00 0.00 C ATOM 844 CG ASN A 55 -6.146 -2.867 -9.916 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.409 -3.875 -9.260 1.00 0.00 O ATOM 846 ND2 ASN A 55 -6.905 -1.777 -9.891 1.00 0.00 N ATOM 0 H ASN A 55 -3.938 -3.398 -8.620 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.575 -4.935 -10.851 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.354 -1.907 -10.585 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.229 -2.752 -11.847 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.744 -1.753 -9.312 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.649 -0.964 -10.451 1.00 0.00 H new ATOM 853 N ASN A 56 -1.732 -3.352 -11.094 1.00 0.00 N ATOM 854 CA ASN A 56 -0.527 -3.204 -11.903 1.00 0.00 C ATOM 855 C ASN A 56 0.219 -4.530 -12.015 1.00 0.00 C ATOM 856 O ASN A 56 0.678 -4.908 -13.094 1.00 0.00 O ATOM 857 CB ASN A 56 0.391 -2.139 -11.299 1.00 0.00 C ATOM 858 CG ASN A 56 0.100 -0.752 -11.838 1.00 0.00 C ATOM 859 OD1 ASN A 56 0.156 -0.519 -13.045 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.212 0.177 -10.942 1.00 0.00 N ATOM 0 H ASN A 56 -1.658 -2.966 -10.153 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.827 -2.890 -12.903 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.276 -2.136 -10.215 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.429 -2.397 -11.508 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.417 1.129 -11.245 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.246 -0.062 -9.951 1.00 0.00 H new ATOM 867 N LEU A 57 0.335 -5.234 -10.894 1.00 0.00 N ATOM 868 CA LEU A 57 1.024 -6.519 -10.865 1.00 0.00 C ATOM 869 C LEU A 57 0.237 -7.577 -11.633 1.00 0.00 C ATOM 870 O LEU A 57 0.757 -8.203 -12.556 1.00 0.00 O ATOM 871 CB LEU A 57 1.237 -6.974 -9.420 1.00 0.00 C ATOM 872 CG LEU A 57 1.766 -5.914 -8.454 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.834 -6.467 -7.039 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.134 -5.419 -8.901 1.00 0.00 C ATOM 0 H LEU A 57 -0.039 -4.936 -9.993 1.00 0.00 H new ATOM 0 HA LEU A 57 1.994 -6.394 -11.346 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.288 -7.347 -9.034 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.932 -7.813 -9.423 1.00 0.00 H new ATOM 0 HG LEU A 57 1.077 -5.070 -8.460 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.213 -5.698 -6.366 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.837 -6.771 -6.719 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.501 -7.329 -7.017 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.495 -4.665 -8.201 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.833 -6.255 -8.926 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.055 -4.982 -9.897 1.00 0.00 H new ATOM 886 N ARG A 58 -1.020 -7.768 -11.246 1.00 0.00 N ATOM 887 CA ARG A 58 -1.879 -8.749 -11.898 1.00 0.00 C ATOM 888 C ARG A 58 -3.051 -8.065 -12.597 1.00 0.00 C ATOM 889 O ARG A 58 -3.423 -6.944 -12.253 1.00 0.00 O ATOM 890 CB ARG A 58 -2.402 -9.760 -10.876 1.00 0.00 C ATOM 891 CG ARG A 58 -2.661 -11.139 -11.461 1.00 0.00 C ATOM 892 CD ARG A 58 -3.738 -11.880 -10.685 1.00 0.00 C ATOM 893 NE ARG A 58 -4.253 -13.030 -11.424 1.00 0.00 N ATOM 894 CZ ARG A 58 -3.635 -14.204 -11.478 1.00 0.00 C ATOM 895 NH1 ARG A 58 -2.487 -14.384 -10.840 1.00 0.00 N ATOM 896 NH2 ARG A 58 -4.167 -15.203 -12.172 1.00 0.00 N ATOM 0 H ARG A 58 -1.466 -7.257 -10.484 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.286 -9.273 -12.647 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.681 -9.849 -10.064 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.326 -9.380 -10.441 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.964 -11.042 -12.504 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.738 -11.719 -11.450 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.331 -12.215 -9.731 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.557 -11.197 -10.460 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.135 -12.926 -11.926 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -2.075 -13.619 -10.305 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -2.015 -15.287 -10.884 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -5.050 -15.069 -12.664 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -3.692 -16.105 -12.213 1.00 0.00 H new ATOM 910 N ALA A 59 -3.626 -8.748 -13.581 1.00 0.00 N ATOM 911 CA ALA A 59 -4.755 -8.208 -14.328 1.00 0.00 C ATOM 912 C ALA A 59 -6.079 -8.613 -13.690 1.00 0.00 C ATOM 913 O ALA A 59 -6.209 -9.712 -13.148 1.00 0.00 O ATOM 914 CB ALA A 59 -4.701 -8.673 -15.776 1.00 0.00 C ATOM 0 H ALA A 59 -3.328 -9.677 -13.880 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.688 -7.120 -14.304 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.550 -8.262 -16.322 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.774 -8.329 -16.234 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.740 -9.762 -15.810 1.00 0.00 H new ATOM 920 N HIS A 60 -7.061 -7.719 -13.756 1.00 0.00 N ATOM 921 CA HIS A 60 -8.376 -7.984 -13.184 1.00 0.00 C ATOM 922 C HIS A 60 -8.281 -8.193 -11.676 1.00 0.00 C ATOM 923 O HIS A 60 -9.033 -8.978 -11.099 1.00 0.00 O ATOM 924 CB HIS A 60 -9.004 -9.214 -13.842 1.00 0.00 C ATOM 925 CG HIS A 60 -9.573 -8.942 -15.200 1.00 0.00 C ATOM 926 ND1 HIS A 60 -10.777 -8.299 -15.396 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.095 -9.228 -16.434 1.00 0.00 C ATOM 928 CE1 HIS A 60 -11.016 -8.203 -16.692 1.00 0.00 C ATOM 929 NE2 HIS A 60 -10.010 -8.759 -17.344 1.00 0.00 N ATOM 0 H HIS A 60 -6.971 -6.805 -14.200 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.008 -7.117 -13.374 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.250 -9.997 -13.923 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -9.794 -9.598 -13.196 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -8.167 -9.731 -16.660 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -11.886 -7.748 -17.142 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -9.927 -8.828 -18.358 1.00 0.00 H new ATOM 938 N SER A 61 -7.351 -7.484 -11.043 1.00 0.00 N ATOM 939 CA SER A 61 -7.154 -7.595 -9.602 1.00 0.00 C ATOM 940 C SER A 61 -8.216 -6.802 -8.846 1.00 0.00 C ATOM 941 O SER A 61 -8.784 -7.283 -7.865 1.00 0.00 O ATOM 942 CB SER A 61 -5.759 -7.098 -9.217 1.00 0.00 C ATOM 943 OG SER A 61 -4.768 -7.654 -10.064 1.00 0.00 O ATOM 0 H SER A 61 -6.722 -6.827 -11.505 1.00 0.00 H new ATOM 0 HA SER A 61 -7.246 -8.646 -9.327 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.727 -6.010 -9.280 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.548 -7.364 -8.181 1.00 0.00 H new ATOM 0 HG SER A 61 -4.615 -7.056 -10.825 1.00 0.00 H new ATOM 949 N ILE A 62 -8.477 -5.585 -9.310 1.00 0.00 N ATOM 950 CA ILE A 62 -9.471 -4.725 -8.679 1.00 0.00 C ATOM 951 C ILE A 62 -10.155 -3.829 -9.706 1.00 0.00 C ATOM 952 O ILE A 62 -9.530 -3.378 -10.665 1.00 0.00 O ATOM 953 CB ILE A 62 -8.839 -3.843 -7.586 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.115 -4.711 -6.555 1.00 0.00 C ATOM 955 CG2 ILE A 62 -9.904 -2.989 -6.913 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.410 -3.913 -5.480 1.00 0.00 C ATOM 0 H ILE A 62 -8.015 -5.172 -10.120 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.212 -5.382 -8.223 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.110 -3.180 -8.051 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.836 -5.380 -6.085 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.386 -5.338 -7.068 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.442 -2.371 -6.143 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.379 -2.348 -7.656 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.655 -3.635 -6.458 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.919 -4.594 -4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.665 -3.263 -5.939 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.138 -3.306 -4.941 1.00 0.00 H new ATOM 968 N ASN A 63 -11.442 -3.575 -9.498 1.00 0.00 N ATOM 969 CA ASN A 63 -12.212 -2.731 -10.406 1.00 0.00 C ATOM 970 C ASN A 63 -12.260 -1.292 -9.902 1.00 0.00 C ATOM 971 O ASN A 63 -12.894 -0.999 -8.887 1.00 0.00 O ATOM 972 CB ASN A 63 -13.633 -3.277 -10.561 1.00 0.00 C ATOM 973 CG ASN A 63 -14.557 -2.295 -11.254 1.00 0.00 C ATOM 974 OD1 ASN A 63 -14.137 -1.210 -11.658 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.822 -2.671 -11.395 1.00 0.00 N ATOM 0 H ASN A 63 -11.975 -3.941 -8.709 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.718 -2.740 -11.378 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.602 -4.206 -11.130 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.036 -3.519 -9.577 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.490 -2.052 -11.854 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.126 -3.579 -11.045 1.00 0.00 H new ATOM 982 N LEU A 64 -11.586 -0.398 -10.617 1.00 0.00 N ATOM 983 CA LEU A 64 -11.552 1.012 -10.244 1.00 0.00 C ATOM 984 C LEU A 64 -12.957 1.534 -9.958 1.00 0.00 C ATOM 985 O LEU A 64 -13.179 2.248 -8.981 1.00 0.00 O ATOM 986 CB LEU A 64 -10.905 1.839 -11.356 1.00 0.00 C ATOM 987 CG LEU A 64 -9.439 1.525 -11.660 1.00 0.00 C ATOM 988 CD1 LEU A 64 -8.972 2.293 -12.886 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.564 1.851 -10.458 1.00 0.00 C ATOM 0 H LEU A 64 -11.056 -0.624 -11.458 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.957 1.108 -9.336 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.483 1.698 -12.269 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.982 2.893 -11.089 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.351 0.459 -11.870 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.927 2.057 -13.087 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.580 2.010 -13.746 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.074 3.363 -12.706 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.524 1.622 -10.692 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.657 2.910 -10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.884 1.255 -9.603 1.00 0.00 H new ATOM 1001 N LYS A 65 -13.903 1.170 -10.817 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.288 1.598 -10.657 1.00 0.00 C ATOM 1003 C LYS A 65 -15.815 1.226 -9.274 1.00 0.00 C ATOM 1004 O LYS A 65 -16.537 2.001 -8.647 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.167 0.964 -11.737 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.614 1.122 -13.142 1.00 0.00 C ATOM 1007 CD LYS A 65 -15.479 2.586 -13.527 1.00 0.00 C ATOM 1008 CE LYS A 65 -14.096 3.125 -13.195 1.00 0.00 C ATOM 1009 NZ LYS A 65 -13.032 2.448 -13.987 1.00 0.00 N ATOM 0 H LYS A 65 -13.736 0.579 -11.632 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.322 2.683 -10.760 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.286 -0.097 -11.520 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.160 1.411 -11.694 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.640 0.636 -13.207 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.270 0.617 -13.851 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -15.669 2.702 -14.594 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -16.234 3.172 -13.003 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -14.068 4.197 -13.390 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -13.899 2.989 -12.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.148 2.990 -13.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.881 1.488 -13.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -13.324 2.392 -14.984 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.449 0.037 -8.806 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.886 -0.435 -7.497 1.00 0.00 C ATOM 1025 C GLU A 66 -15.298 0.428 -6.384 1.00 0.00 C ATOM 1026 O GLU A 66 -15.854 0.508 -5.288 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.478 -1.896 -7.295 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.315 -2.878 -8.098 1.00 0.00 C ATOM 1029 CD GLU A 66 -16.354 -4.258 -7.472 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -15.290 -4.906 -7.395 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -17.451 -4.690 -7.059 1.00 0.00 O ATOM 0 H GLU A 66 -14.852 -0.616 -9.313 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.973 -0.360 -7.456 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.430 -2.013 -7.572 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.558 -2.144 -6.237 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -17.331 -2.495 -8.188 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.912 -2.952 -9.108 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.171 1.069 -6.673 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.508 1.925 -5.697 1.00 0.00 C ATOM 1040 C ILE A 67 -13.699 3.399 -6.040 1.00 0.00 C ATOM 1041 O ILE A 67 -13.551 3.803 -7.192 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.001 1.620 -5.613 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.387 1.579 -7.014 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.767 0.303 -4.887 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -9.894 1.336 -7.012 1.00 0.00 C ATOM 0 H ILE A 67 -13.698 1.012 -7.575 1.00 0.00 H new ATOM 0 HA ILE A 67 -13.967 1.717 -4.730 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.515 2.416 -5.048 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.874 0.794 -7.593 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.593 2.522 -7.520 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.697 0.101 -4.836 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.173 0.367 -3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.263 -0.503 -5.427 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.527 1.319 -8.038 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.396 2.134 -6.461 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.682 0.379 -6.535 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.026 4.198 -5.029 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.235 5.628 -5.223 1.00 0.00 C ATOM 1059 C ASN A 68 -12.909 6.346 -5.453 1.00 0.00 C ATOM 1060 O ASN A 68 -12.294 6.854 -4.515 1.00 0.00 O ATOM 1061 CB ASN A 68 -14.949 6.229 -4.010 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.204 5.462 -3.640 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.146 5.373 -4.427 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -16.222 4.904 -2.435 1.00 0.00 N ATOM 0 H ASN A 68 -14.152 3.880 -4.068 1.00 0.00 H new ATOM 0 HA ASN A 68 -14.858 5.762 -6.107 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.268 6.239 -3.159 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.209 7.266 -4.222 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.040 4.376 -2.130 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.418 5.003 -1.815 1.00 0.00 H new ATOM 1071 N LEU A 69 -12.474 6.385 -6.708 1.00 0.00 N ATOM 1072 CA LEU A 69 -11.220 7.041 -7.063 1.00 0.00 C ATOM 1073 C LEU A 69 -11.101 8.397 -6.374 1.00 0.00 C ATOM 1074 O LEU A 69 -10.017 8.794 -5.947 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.126 7.217 -8.580 1.00 0.00 C ATOM 1076 CG LEU A 69 -10.779 5.961 -9.380 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -11.324 6.065 -10.797 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -9.274 5.740 -9.400 1.00 0.00 C ATOM 0 H LEU A 69 -12.971 5.970 -7.496 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.399 6.409 -6.725 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.080 7.602 -8.941 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.375 7.978 -8.792 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.245 5.103 -8.895 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.068 5.163 -11.352 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.408 6.175 -10.763 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.887 6.932 -11.292 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.046 4.842 -9.974 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.786 6.599 -9.861 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.910 5.621 -8.379 1.00 0.00 H new ATOM 1090 N ARG A 70 -12.223 9.101 -6.267 1.00 0.00 N ATOM 1091 CA ARG A 70 -12.245 10.412 -5.629 1.00 0.00 C ATOM 1092 C ARG A 70 -13.176 10.413 -4.421 1.00 0.00 C ATOM 1093 O ARG A 70 -14.337 10.817 -4.501 1.00 0.00 O ATOM 1094 CB ARG A 70 -12.687 11.482 -6.629 1.00 0.00 C ATOM 1095 CG ARG A 70 -12.916 12.846 -5.999 1.00 0.00 C ATOM 1096 CD ARG A 70 -13.925 13.663 -6.791 1.00 0.00 C ATOM 1097 NE ARG A 70 -13.392 14.086 -8.083 1.00 0.00 N ATOM 1098 CZ ARG A 70 -12.599 15.140 -8.242 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -12.248 15.873 -7.195 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -12.155 15.462 -9.450 1.00 0.00 N ATOM 0 H ARG A 70 -13.129 8.786 -6.614 1.00 0.00 H new ATOM 0 HA ARG A 70 -11.235 10.639 -5.287 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.931 11.573 -7.409 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -13.607 11.156 -7.114 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -13.271 12.721 -4.976 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -11.971 13.386 -5.945 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -14.828 13.072 -6.947 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -14.214 14.541 -6.213 1.00 0.00 H new ATOM 0 HE ARG A 70 -13.642 13.542 -8.909 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.587 15.628 -6.265 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -11.639 16.682 -7.320 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.422 14.900 -10.258 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -11.546 16.271 -9.571 1.00 0.00 H new ATOM 1114 N PRO A 71 -12.659 9.950 -3.274 1.00 0.00 N ATOM 1115 CA PRO A 71 -13.427 9.887 -2.027 1.00 0.00 C ATOM 1116 C PRO A 71 -13.715 11.270 -1.453 1.00 0.00 C ATOM 1117 O PRO A 71 -14.624 11.437 -0.641 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.514 9.097 -1.086 1.00 0.00 C ATOM 1119 CG PRO A 71 -11.139 9.325 -1.614 1.00 0.00 C ATOM 1120 CD PRO A 71 -11.283 9.452 -3.105 1.00 0.00 C ATOM 0 HA PRO A 71 -14.406 9.431 -2.175 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.607 9.447 -0.058 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.767 8.037 -1.086 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.701 10.227 -1.186 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.479 8.497 -1.355 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -10.551 10.144 -3.522 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.138 8.495 -3.606 1.00 0.00 H new ATOM 1128 N GLN A 72 -12.933 12.257 -1.880 1.00 0.00 N ATOM 1129 CA GLN A 72 -13.105 13.625 -1.407 1.00 0.00 C ATOM 1130 C GLN A 72 -12.925 13.705 0.106 1.00 0.00 C ATOM 1131 O GLN A 72 -13.648 14.430 0.789 1.00 0.00 O ATOM 1132 CB GLN A 72 -14.487 14.152 -1.797 1.00 0.00 C ATOM 1133 CG GLN A 72 -14.697 14.258 -3.298 1.00 0.00 C ATOM 1134 CD GLN A 72 -15.918 15.079 -3.661 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -16.235 16.067 -2.997 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -16.611 14.676 -4.720 1.00 0.00 N ATOM 0 H GLN A 72 -12.175 12.135 -2.552 1.00 0.00 H new ATOM 0 HA GLN A 72 -12.342 14.244 -1.878 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -15.249 13.495 -1.378 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -14.632 15.135 -1.348 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -13.814 14.706 -3.754 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -14.799 13.257 -3.718 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -16.312 13.852 -5.241 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -17.442 15.191 -5.012 1.00 0.00 H new ATOM 1145 N MET A 73 -11.957 12.955 0.622 1.00 0.00 N ATOM 1146 CA MET A 73 -11.683 12.942 2.054 1.00 0.00 C ATOM 1147 C MET A 73 -12.902 12.466 2.837 1.00 0.00 C ATOM 1148 O MET A 73 -13.234 13.021 3.885 1.00 0.00 O ATOM 1149 CB MET A 73 -11.270 14.337 2.529 1.00 0.00 C ATOM 1150 CG MET A 73 -10.014 14.862 1.852 1.00 0.00 C ATOM 1151 SD MET A 73 -8.506 14.156 2.544 1.00 0.00 S ATOM 1152 CE MET A 73 -8.290 12.723 1.491 1.00 0.00 C ATOM 0 H MET A 73 -11.350 12.349 0.070 1.00 0.00 H new ATOM 0 HA MET A 73 -10.863 12.247 2.235 1.00 0.00 H new ATOM 0 HB2 MET A 73 -12.089 15.032 2.345 1.00 0.00 H new ATOM 0 HB3 MET A 73 -11.109 14.312 3.607 1.00 0.00 H new ATOM 0 HG2 MET A 73 -10.060 14.638 0.786 1.00 0.00 H new ATOM 0 HG3 MET A 73 -9.980 15.947 1.949 1.00 0.00 H new ATOM 0 HE1 MET A 73 -8.290 11.820 2.101 1.00 0.00 H new ATOM 0 HE2 MET A 73 -9.107 12.674 0.771 1.00 0.00 H new ATOM 0 HE3 MET A 73 -7.342 12.802 0.959 1.00 0.00 H new ATOM 1162 N SER A 74 -13.565 11.435 2.323 1.00 0.00 N ATOM 1163 CA SER A 74 -14.750 10.888 2.972 1.00 0.00 C ATOM 1164 C SER A 74 -14.389 9.681 3.833 1.00 0.00 C ATOM 1165 O SER A 74 -13.865 8.685 3.334 1.00 0.00 O ATOM 1166 CB SER A 74 -15.793 10.489 1.926 1.00 0.00 C ATOM 1167 OG SER A 74 -16.622 11.587 1.588 1.00 0.00 O ATOM 0 H SER A 74 -13.301 10.962 1.459 1.00 0.00 H new ATOM 0 HA SER A 74 -15.170 11.660 3.617 1.00 0.00 H new ATOM 0 HB2 SER A 74 -15.292 10.118 1.032 1.00 0.00 H new ATOM 0 HB3 SER A 74 -16.404 9.673 2.310 1.00 0.00 H new ATOM 0 HG SER A 74 -16.317 11.980 0.744 1.00 0.00 H new ATOM 1173 N GLN A 75 -14.674 9.778 5.127 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.379 8.695 6.058 1.00 0.00 C ATOM 1175 C GLN A 75 -15.073 7.406 5.631 1.00 0.00 C ATOM 1176 O GLN A 75 -14.497 6.321 5.715 1.00 0.00 O ATOM 1177 CB GLN A 75 -14.814 9.078 7.473 1.00 0.00 C ATOM 1178 CG GLN A 75 -14.608 7.970 8.494 1.00 0.00 C ATOM 1179 CD GLN A 75 -14.666 8.474 9.922 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -13.956 9.410 10.292 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -15.514 7.855 10.735 1.00 0.00 N ATOM 0 H GLN A 75 -15.109 10.595 5.555 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.302 8.526 6.050 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -14.257 9.960 7.789 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -15.868 9.355 7.458 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.370 7.204 8.352 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.643 7.495 8.319 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -16.084 7.084 10.387 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -15.596 8.151 11.708 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.314 7.532 5.172 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.088 6.377 4.733 1.00 0.00 C ATOM 1192 C PHE A 76 -16.468 5.749 3.488 1.00 0.00 C ATOM 1193 O PHE A 76 -16.107 4.571 3.487 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.535 6.785 4.446 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.386 6.883 5.680 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.392 8.039 6.443 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -20.180 5.819 6.076 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -20.173 8.131 7.579 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -20.964 5.906 7.211 1.00 0.00 C ATOM 1200 CZ PHE A 76 -20.961 7.064 7.963 1.00 0.00 C ATOM 0 H PHE A 76 -16.805 8.423 5.094 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.079 5.638 5.534 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -18.538 7.748 3.935 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -18.980 6.060 3.764 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -18.779 8.878 6.147 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -20.186 4.911 5.491 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -20.167 9.037 8.167 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -21.578 5.069 7.509 1.00 0.00 H new ATOM 0 HZ PHE A 76 -21.574 7.135 8.850 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.350 6.542 2.429 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.774 6.065 1.176 1.00 0.00 C ATOM 1212 C LEU A 77 -14.377 5.497 1.400 1.00 0.00 C ATOM 1213 O LEU A 77 -14.058 4.403 0.932 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.718 7.200 0.153 1.00 0.00 C ATOM 1215 CG LEU A 77 -17.031 7.940 -0.102 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -16.800 9.142 -1.004 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -18.062 7.002 -0.713 1.00 0.00 C ATOM 0 H LEU A 77 -16.645 7.518 2.413 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.412 5.269 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.974 7.925 0.485 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -15.365 6.792 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 77 -17.416 8.298 0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -17.746 9.656 -1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -16.097 9.825 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -16.392 8.808 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -18.990 7.546 -0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -17.685 6.614 -1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -18.250 6.173 -0.030 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.548 6.245 2.121 1.00 0.00 N ATOM 1230 CA CYS A 78 -12.184 5.815 2.408 1.00 0.00 C ATOM 1231 C CYS A 78 -12.176 4.441 3.071 1.00 0.00 C ATOM 1232 O CYS A 78 -11.636 3.479 2.522 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.486 6.834 3.310 1.00 0.00 C ATOM 1234 SG CYS A 78 -10.997 8.355 2.465 1.00 0.00 S ATOM 0 H CYS A 78 -13.797 7.151 2.517 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.644 5.746 1.464 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -12.151 7.088 4.136 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -10.600 6.372 3.745 1.00 0.00 H new ATOM 0 HG CYS A 78 -11.961 9.224 2.542 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.775 4.356 4.253 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.836 3.100 4.992 1.00 0.00 C ATOM 1242 C LEU A 79 -13.263 1.953 4.082 1.00 0.00 C ATOM 1243 O LEU A 79 -12.669 0.875 4.103 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.807 3.223 6.167 1.00 0.00 C ATOM 1245 CG LEU A 79 -13.284 3.970 7.395 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.386 4.133 8.430 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -12.090 3.241 7.994 1.00 0.00 C ATOM 0 H LEU A 79 -13.226 5.142 4.721 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.839 2.884 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.708 3.727 5.817 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.102 2.220 6.475 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.959 4.962 7.082 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -13.995 4.667 9.296 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.211 4.699 7.997 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.743 3.151 8.739 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.731 3.787 8.867 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.389 2.236 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.293 3.177 7.253 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.297 2.193 3.282 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.803 1.182 2.361 1.00 0.00 C ATOM 1261 C LYS A 80 -13.734 0.785 1.348 1.00 0.00 C ATOM 1262 O LYS A 80 -13.424 -0.394 1.189 1.00 0.00 O ATOM 1263 CB LYS A 80 -16.044 1.703 1.632 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.784 0.632 0.849 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.067 0.294 -0.447 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.998 -0.387 -1.438 1.00 0.00 C ATOM 1267 NZ LYS A 80 -17.898 0.589 -2.113 1.00 0.00 N ATOM 0 H LYS A 80 -14.801 3.079 3.253 1.00 0.00 H new ATOM 0 HA LYS A 80 -15.073 0.300 2.941 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.724 2.144 2.360 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.747 2.500 0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.878 -0.266 1.459 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.795 0.975 0.628 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.666 1.205 -0.890 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.219 -0.358 -0.236 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.408 -0.915 -2.187 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.597 -1.135 -0.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.470 0.097 -2.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.526 1.026 -1.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.327 1.327 -2.573 1.00 0.00 H new ATOM 1281 N ASN A 81 -13.174 1.779 0.666 1.00 0.00 N ATOM 1282 CA ASN A 81 -12.138 1.533 -0.331 1.00 0.00 C ATOM 1283 C ASN A 81 -11.080 0.576 0.208 1.00 0.00 C ATOM 1284 O ASN A 81 -10.838 -0.486 -0.366 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.484 2.850 -0.754 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.500 3.882 -1.202 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.663 3.560 -1.445 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -12.064 5.131 -1.315 1.00 0.00 N ATOM 0 H ASN A 81 -13.420 2.762 0.785 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.608 1.073 -1.201 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.907 3.250 0.080 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.782 2.660 -1.565 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.702 5.869 -1.614 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -11.091 5.353 -1.103 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.453 0.959 1.315 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.422 0.135 1.933 1.00 0.00 C ATOM 1297 C ILE A 82 -9.842 -1.330 1.976 1.00 0.00 C ATOM 1298 O ILE A 82 -9.091 -2.214 1.563 1.00 0.00 O ATOM 1299 CB ILE A 82 -9.105 0.609 3.364 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.564 2.040 3.343 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -8.107 -0.331 4.024 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.568 2.707 4.700 1.00 0.00 C ATOM 0 H ILE A 82 -10.641 1.835 1.802 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.527 0.236 1.319 1.00 0.00 H new ATOM 0 HB ILE A 82 -10.026 0.598 3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.545 2.029 2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.161 2.636 2.653 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.893 0.017 5.035 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.527 -1.336 4.068 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.185 -0.349 3.443 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.171 3.718 4.610 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.588 2.750 5.081 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.947 2.134 5.389 1.00 0.00 H new ATOM 1314 N ARG A 83 -11.047 -1.580 2.477 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.568 -2.939 2.573 1.00 0.00 C ATOM 1316 C ARG A 83 -11.465 -3.656 1.230 1.00 0.00 C ATOM 1317 O ARG A 83 -11.058 -4.817 1.163 1.00 0.00 O ATOM 1318 CB ARG A 83 -13.024 -2.917 3.042 1.00 0.00 C ATOM 1319 CG ARG A 83 -13.178 -2.979 4.552 1.00 0.00 C ATOM 1320 CD ARG A 83 -14.530 -2.443 4.997 1.00 0.00 C ATOM 1321 NE ARG A 83 -15.551 -3.487 5.022 1.00 0.00 N ATOM 1322 CZ ARG A 83 -16.239 -3.869 3.952 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -16.016 -3.296 2.778 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -17.151 -4.827 4.056 1.00 0.00 N ATOM 0 H ARG A 83 -11.681 -0.860 2.823 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.967 -3.482 3.302 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.502 -2.009 2.673 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.553 -3.759 2.596 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.066 -4.010 4.888 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.383 -2.401 5.024 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.437 -2.003 5.990 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.843 -1.645 4.323 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.747 -3.948 5.910 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.315 -2.560 2.695 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -16.546 -3.591 1.958 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -17.324 -5.271 4.958 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -17.679 -5.120 3.234 1.00 0.00 H new ATOM 1338 N THR A 84 -11.838 -2.959 0.162 1.00 0.00 N ATOM 1339 CA THR A 84 -11.789 -3.529 -1.179 1.00 0.00 C ATOM 1340 C THR A 84 -10.418 -4.126 -1.473 1.00 0.00 C ATOM 1341 O THR A 84 -10.310 -5.270 -1.917 1.00 0.00 O ATOM 1342 CB THR A 84 -12.117 -2.473 -2.251 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.386 -1.870 -1.973 1.00 0.00 O ATOM 1344 CG2 THR A 84 -12.141 -3.098 -3.637 1.00 0.00 C ATOM 0 H THR A 84 -12.178 -1.998 0.199 1.00 0.00 H new ATOM 0 HA THR A 84 -12.541 -4.317 -1.214 1.00 0.00 H new ATOM 0 HB THR A 84 -11.339 -1.710 -2.227 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.586 -1.199 -2.658 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.375 -2.333 -4.377 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.165 -3.531 -3.858 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.900 -3.879 -3.671 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.372 -3.346 -1.223 1.00 0.00 N ATOM 1353 CA PHE A 85 -8.006 -3.799 -1.461 1.00 0.00 C ATOM 1354 C PHE A 85 -7.700 -5.054 -0.650 1.00 0.00 C ATOM 1355 O PHE A 85 -7.500 -6.134 -1.207 1.00 0.00 O ATOM 1356 CB PHE A 85 -7.011 -2.692 -1.106 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.612 -3.193 -0.884 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.787 -3.483 -1.959 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -5.123 -3.374 0.400 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.500 -3.945 -1.757 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.836 -3.835 0.608 1.00 0.00 C ATOM 1362 CZ PHE A 85 -3.024 -4.120 -0.472 1.00 0.00 C ATOM 0 H PHE A 85 -9.444 -2.397 -0.856 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.908 -4.040 -2.519 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.001 -1.953 -1.907 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.353 -2.182 -0.206 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -5.154 -3.347 -2.966 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -5.754 -3.152 1.248 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -2.867 -4.169 -2.603 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -3.466 -3.972 1.614 1.00 0.00 H new ATOM 0 HZ PHE A 85 -2.018 -4.479 -0.312 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.663 -4.904 0.670 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.381 -6.024 1.560 1.00 0.00 C ATOM 1374 C LEU A 86 -8.037 -7.304 1.050 1.00 0.00 C ATOM 1375 O LEU A 86 -7.465 -8.390 1.150 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.873 -5.714 2.975 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.319 -4.441 3.614 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -8.141 -4.055 4.834 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.856 -4.626 3.990 1.00 0.00 C ATOM 0 H LEU A 86 -7.825 -4.017 1.147 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.302 -6.175 1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.960 -5.642 2.952 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.623 -6.558 3.618 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.386 -3.633 2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.732 -3.146 5.276 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.175 -3.880 4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.106 -4.862 5.566 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.478 -3.710 4.444 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.764 -5.447 4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.276 -4.854 3.095 1.00 0.00 H new ATOM 1391 N THR A 87 -9.239 -7.168 0.500 1.00 0.00 N ATOM 1392 CA THR A 87 -9.973 -8.312 -0.027 1.00 0.00 C ATOM 1393 C THR A 87 -9.230 -8.950 -1.195 1.00 0.00 C ATOM 1394 O THR A 87 -8.959 -10.150 -1.190 1.00 0.00 O ATOM 1395 CB THR A 87 -11.386 -7.908 -0.489 1.00 0.00 C ATOM 1396 OG1 THR A 87 -12.115 -7.340 0.604 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.139 -9.111 -1.038 1.00 0.00 C ATOM 0 H THR A 87 -9.726 -6.276 0.408 1.00 0.00 H new ATOM 0 HA THR A 87 -10.058 -9.035 0.784 1.00 0.00 H new ATOM 0 HB THR A 87 -11.288 -7.167 -1.283 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.743 -6.460 0.823 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.134 -8.802 -1.358 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.596 -9.523 -1.888 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.227 -9.871 -0.261 1.00 0.00 H new ATOM 1405 N ALA A 88 -8.904 -8.139 -2.196 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.190 -8.624 -3.371 1.00 0.00 C ATOM 1407 C ALA A 88 -6.945 -9.409 -2.971 1.00 0.00 C ATOM 1408 O ALA A 88 -6.646 -10.455 -3.550 1.00 0.00 O ATOM 1409 CB ALA A 88 -7.815 -7.462 -4.278 1.00 0.00 C ATOM 0 H ALA A 88 -9.123 -7.143 -2.217 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.852 -9.296 -3.916 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.282 -7.839 -5.151 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.719 -6.945 -4.600 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.174 -6.768 -3.734 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.223 -8.899 -1.980 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.009 -9.553 -1.504 1.00 0.00 C ATOM 1417 C CYS A 89 -5.251 -11.038 -1.259 1.00 0.00 C ATOM 1418 O CYS A 89 -4.313 -11.836 -1.244 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.516 -8.885 -0.219 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.813 -7.238 -0.466 1.00 0.00 S ATOM 0 H CYS A 89 -6.457 -8.035 -1.490 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.245 -9.451 -2.275 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.348 -8.812 0.482 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.764 -9.524 0.244 1.00 0.00 H new ATOM 0 HG CYS A 89 -4.371 -6.400 0.356 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.514 -11.402 -1.066 1.00 0.00 N ATOM 1427 CA CYS A 90 -6.879 -12.793 -0.819 1.00 0.00 C ATOM 1428 C CYS A 90 -7.699 -13.353 -1.976 1.00 0.00 C ATOM 1429 O CYS A 90 -7.693 -14.558 -2.227 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.669 -12.910 0.485 1.00 0.00 C ATOM 1431 SG CYS A 90 -7.777 -14.594 1.135 1.00 0.00 S ATOM 0 H CYS A 90 -7.302 -10.754 -1.076 1.00 0.00 H new ATOM 0 HA CYS A 90 -5.961 -13.374 -0.733 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -7.205 -12.271 1.237 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.677 -12.530 0.322 1.00 0.00 H new ATOM 0 HG CYS A 90 -8.462 -14.590 2.240 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.405 -12.471 -2.677 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.232 -12.879 -3.806 1.00 0.00 C ATOM 1439 C GLU A 91 -8.395 -13.006 -5.076 1.00 0.00 C ATOM 1440 O GLU A 91 -8.398 -14.047 -5.735 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.364 -11.874 -4.028 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.239 -11.663 -2.803 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.662 -11.281 -3.161 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.848 -10.240 -3.825 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -13.589 -12.023 -2.777 1.00 0.00 O ATOM 0 H GLU A 91 -8.421 -11.470 -2.483 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.661 -13.854 -3.575 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.936 -10.917 -4.328 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -10.987 -12.217 -4.854 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -11.251 -12.576 -2.208 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -10.803 -10.882 -2.180 1.00 0.00 H new ATOM 1452 N THR A 92 -7.678 -11.939 -5.414 1.00 0.00 N ATOM 1453 CA THR A 92 -6.837 -11.929 -6.605 1.00 0.00 C ATOM 1454 C THR A 92 -5.596 -12.792 -6.409 1.00 0.00 C ATOM 1455 O THR A 92 -5.259 -13.615 -7.261 1.00 0.00 O ATOM 1456 CB THR A 92 -6.401 -10.498 -6.973 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.545 -9.711 -7.320 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.418 -10.514 -8.134 1.00 0.00 C ATOM 0 H THR A 92 -7.663 -11.070 -4.880 1.00 0.00 H new ATOM 0 HA THR A 92 -7.436 -12.339 -7.418 1.00 0.00 H new ATOM 0 HB THR A 92 -5.908 -10.058 -6.106 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.993 -9.408 -6.503 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.124 -9.493 -8.376 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.535 -11.089 -7.855 1.00 0.00 H new ATOM 0 HG23 THR A 92 -5.889 -10.972 -9.004 1.00 0.00 H new ATOM 1466 N PHE A 93 -4.920 -12.600 -5.282 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.715 -13.362 -4.974 1.00 0.00 C ATOM 1468 C PHE A 93 -4.046 -14.581 -4.118 1.00 0.00 C ATOM 1469 O PHE A 93 -3.952 -15.719 -4.575 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.697 -12.477 -4.250 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.114 -11.401 -5.120 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -2.900 -10.350 -5.566 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.780 -11.439 -5.491 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.366 -9.358 -6.366 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.240 -10.449 -6.290 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.034 -9.408 -6.730 1.00 0.00 C ATOM 0 H PHE A 93 -5.186 -11.923 -4.566 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.283 -13.706 -5.914 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.177 -12.015 -3.387 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.890 -13.102 -3.869 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.942 -10.306 -5.285 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.155 -12.252 -5.152 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -2.989 -8.544 -6.706 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.802 -10.489 -6.570 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.615 -8.635 -7.357 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.433 -14.333 -2.870 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.772 -15.419 -1.968 1.00 0.00 C ATOM 1488 C GLY A 94 -3.725 -15.626 -0.892 1.00 0.00 C ATOM 1489 O GLY A 94 -3.184 -16.721 -0.746 1.00 0.00 O ATOM 0 H GLY A 94 -4.518 -13.400 -2.468 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.734 -15.211 -1.500 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.888 -16.340 -2.540 1.00 0.00 H new ATOM 1493 N MET A 95 -3.438 -14.570 -0.137 1.00 0.00 N ATOM 1494 CA MET A 95 -2.449 -14.642 0.932 1.00 0.00 C ATOM 1495 C MET A 95 -3.126 -14.694 2.298 1.00 0.00 C ATOM 1496 O MET A 95 -4.343 -14.541 2.403 1.00 0.00 O ATOM 1497 CB MET A 95 -1.505 -13.439 0.864 1.00 0.00 C ATOM 1498 CG MET A 95 -2.193 -12.111 1.133 1.00 0.00 C ATOM 1499 SD MET A 95 -1.322 -10.715 0.395 1.00 0.00 S ATOM 1500 CE MET A 95 0.263 -10.831 1.220 1.00 0.00 C ATOM 0 H MET A 95 -3.876 -13.655 -0.246 1.00 0.00 H new ATOM 0 HA MET A 95 -1.872 -15.557 0.797 1.00 0.00 H new ATOM 0 HB2 MET A 95 -0.702 -13.576 1.588 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.042 -13.406 -0.122 1.00 0.00 H new ATOM 0 HG2 MET A 95 -3.210 -12.147 0.742 1.00 0.00 H new ATOM 0 HG3 MET A 95 -2.270 -11.958 2.209 1.00 0.00 H new ATOM 0 HE1 MET A 95 0.754 -9.858 1.203 1.00 0.00 H new ATOM 0 HE2 MET A 95 0.113 -11.144 2.253 1.00 0.00 H new ATOM 0 HE3 MET A 95 0.888 -11.562 0.707 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.331 -14.911 3.340 1.00 0.00 N ATOM 1511 CA ARG A 96 -2.855 -14.985 4.699 1.00 0.00 C ATOM 1512 C ARG A 96 -3.435 -13.642 5.131 1.00 0.00 C ATOM 1513 O ARG A 96 -2.719 -12.646 5.226 1.00 0.00 O ATOM 1514 CB ARG A 96 -1.754 -15.414 5.670 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.494 -16.912 5.673 1.00 0.00 C ATOM 1516 CD ARG A 96 -0.185 -17.249 6.370 1.00 0.00 C ATOM 1517 NE ARG A 96 0.129 -18.672 6.287 1.00 0.00 N ATOM 1518 CZ ARG A 96 1.333 -19.175 6.535 1.00 0.00 C ATOM 1519 NH1 ARG A 96 2.332 -18.374 6.879 1.00 0.00 N ATOM 1520 NH2 ARG A 96 1.540 -20.482 6.439 1.00 0.00 N ATOM 0 H ARG A 96 -1.321 -15.039 3.270 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.653 -15.728 4.715 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -0.831 -14.894 5.412 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.027 -15.099 6.677 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -2.316 -17.424 6.173 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -1.466 -17.280 4.647 1.00 0.00 H new ATOM 0 HD2 ARG A 96 0.624 -16.673 5.921 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -0.245 -16.952 7.417 1.00 0.00 H new ATOM 0 HE ARG A 96 -0.617 -19.316 6.024 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.177 -17.369 6.954 1.00 0.00 H new ATOM 0 HH12 ARG A 96 3.256 -18.763 7.069 1.00 0.00 H new ATOM 0 HH21 ARG A 96 0.774 -21.102 6.174 1.00 0.00 H new ATOM 0 HH22 ARG A 96 2.465 -20.867 6.630 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.738 -13.623 5.392 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.416 -12.403 5.816 1.00 0.00 C ATOM 1536 C LYS A 97 -4.796 -11.853 7.096 1.00 0.00 C ATOM 1537 O LYS A 97 -4.572 -10.649 7.221 1.00 0.00 O ATOM 1538 CB LYS A 97 -6.906 -12.673 6.033 1.00 0.00 C ATOM 1539 CG LYS A 97 -7.719 -12.666 4.750 1.00 0.00 C ATOM 1540 CD LYS A 97 -9.147 -12.208 4.997 1.00 0.00 C ATOM 1541 CE LYS A 97 -9.235 -10.694 5.106 1.00 0.00 C ATOM 1542 NZ LYS A 97 -10.606 -10.195 4.805 1.00 0.00 N ATOM 0 H LYS A 97 -5.346 -14.439 5.317 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.299 -11.659 5.028 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.024 -13.640 6.523 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.308 -11.921 6.712 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.246 -12.007 4.022 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.726 -13.666 4.317 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.787 -12.553 4.185 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.523 -12.662 5.914 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.949 -10.385 6.111 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.523 -10.238 4.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.625 -9.159 4.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.870 -10.468 3.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.282 -10.610 5.478 1.00 0.00 H new ATOM 1556 N SER A 98 -4.520 -12.743 8.045 1.00 0.00 N ATOM 1557 CA SER A 98 -3.928 -12.345 9.317 1.00 0.00 C ATOM 1558 C SER A 98 -2.730 -11.427 9.095 1.00 0.00 C ATOM 1559 O SER A 98 -2.481 -10.513 9.881 1.00 0.00 O ATOM 1560 CB SER A 98 -3.498 -13.580 10.111 1.00 0.00 C ATOM 1561 OG SER A 98 -2.534 -14.335 9.397 1.00 0.00 O ATOM 0 H SER A 98 -4.697 -13.744 7.957 1.00 0.00 H new ATOM 0 HA SER A 98 -4.681 -11.800 9.886 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.085 -13.273 11.072 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.368 -14.202 10.322 1.00 0.00 H new ATOM 0 HG SER A 98 -2.274 -15.118 9.926 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.992 -11.676 8.018 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.819 -10.872 7.692 1.00 0.00 C ATOM 1569 C GLU A 99 -1.222 -9.446 7.331 1.00 0.00 C ATOM 1570 O GLU A 99 -0.582 -8.482 7.754 1.00 0.00 O ATOM 1571 CB GLU A 99 -0.045 -11.505 6.534 1.00 0.00 C ATOM 1572 CG GLU A 99 0.434 -12.918 6.822 1.00 0.00 C ATOM 1573 CD GLU A 99 1.128 -13.552 5.633 1.00 0.00 C ATOM 1574 OE1 GLU A 99 0.603 -13.434 4.506 1.00 0.00 O ATOM 1575 OE2 GLU A 99 2.198 -14.167 5.830 1.00 0.00 O ATOM 0 H GLU A 99 -2.185 -12.428 7.356 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.177 -10.838 8.572 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.680 -11.519 5.648 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.816 -10.879 6.299 1.00 0.00 H new ATOM 0 HG2 GLU A 99 1.118 -12.900 7.670 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -0.417 -13.534 7.112 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.285 -9.318 6.544 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.773 -8.010 6.124 1.00 0.00 C ATOM 1584 C LEU A 100 -2.882 -7.061 7.313 1.00 0.00 C ATOM 1585 O LEU A 100 -2.777 -7.480 8.466 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.135 -8.147 5.440 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.234 -9.216 4.352 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.661 -9.324 3.838 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.276 -8.906 3.210 1.00 0.00 C ATOM 0 H LEU A 100 -2.825 -10.105 6.184 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.057 -7.594 5.415 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.882 -8.363 6.203 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.397 -7.184 5.001 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.952 -10.175 4.786 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.712 -10.090 3.064 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.324 -9.594 4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.971 -8.366 3.421 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.360 -9.678 2.445 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.527 -7.937 2.778 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.254 -8.881 3.589 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.096 -5.782 7.026 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.221 -4.773 8.072 1.00 0.00 C ATOM 1603 C PHE A 101 -4.688 -4.497 8.389 1.00 0.00 C ATOM 1604 O PHE A 101 -5.585 -5.050 7.753 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.527 -3.478 7.646 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.980 -2.966 6.309 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -4.100 -2.157 6.204 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -2.286 -3.295 5.156 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -4.519 -1.685 4.975 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -2.700 -2.825 3.924 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.818 -2.020 3.833 1.00 0.00 C ATOM 0 H PHE A 101 -3.187 -5.419 6.077 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.739 -5.156 8.971 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.710 -2.712 8.400 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.450 -3.645 7.616 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.652 -1.892 7.094 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.412 -3.926 5.221 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -5.394 -1.055 4.907 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -2.149 -3.087 3.033 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.144 -1.653 2.871 1.00 0.00 H new ATOM 1621 N GLU A 102 -4.923 -3.639 9.376 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.280 -3.290 9.778 1.00 0.00 C ATOM 1623 C GLU A 102 -6.762 -2.042 9.044 1.00 0.00 C ATOM 1624 O GLU A 102 -5.991 -1.112 8.808 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.346 -3.064 11.290 1.00 0.00 C ATOM 1626 CG GLU A 102 -6.204 -4.339 12.103 1.00 0.00 C ATOM 1627 CD GLU A 102 -4.974 -5.140 11.722 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -3.865 -4.566 11.732 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -5.121 -6.341 11.414 1.00 0.00 O ATOM 0 H GLU A 102 -4.191 -3.173 9.912 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.934 -4.121 9.513 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.558 -2.369 11.580 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.296 -2.590 11.537 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -6.155 -4.086 13.162 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -7.092 -4.955 11.963 1.00 0.00 H new ATOM 1636 N ALA A 103 -8.042 -2.030 8.686 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.627 -0.896 7.981 1.00 0.00 C ATOM 1638 C ALA A 103 -8.319 0.414 8.697 1.00 0.00 C ATOM 1639 O ALA A 103 -7.748 1.334 8.112 1.00 0.00 O ATOM 1640 CB ALA A 103 -10.130 -1.082 7.839 1.00 0.00 C ATOM 0 H ALA A 103 -8.693 -2.792 8.873 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.182 -0.849 6.987 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.554 -0.228 7.311 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.332 -1.993 7.277 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.582 -1.158 8.828 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.703 0.493 9.967 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.470 1.693 10.763 1.00 0.00 C ATOM 1648 C PHE A 104 -6.980 2.014 10.839 1.00 0.00 C ATOM 1649 O PHE A 104 -6.556 3.124 10.517 1.00 0.00 O ATOM 1650 CB PHE A 104 -9.036 1.513 12.173 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.409 2.807 12.839 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.538 3.505 12.442 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.630 3.325 13.860 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.884 4.696 13.053 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -8.971 4.515 14.475 1.00 0.00 C ATOM 1656 CZ PHE A 104 -10.099 5.202 14.070 1.00 0.00 C ATOM 0 H PHE A 104 -9.177 -0.259 10.467 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.979 2.525 10.278 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -9.916 0.872 12.123 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -8.300 0.996 12.788 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -11.155 3.114 11.646 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.746 2.793 14.179 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.767 5.230 12.735 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.356 4.907 15.271 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.366 6.133 14.548 1.00 0.00 H new ATOM 1666 N ASP A 105 -6.191 1.035 11.267 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.748 1.211 11.385 1.00 0.00 C ATOM 1668 C ASP A 105 -4.220 2.121 10.280 1.00 0.00 C ATOM 1669 O ASP A 105 -3.392 2.999 10.527 1.00 0.00 O ATOM 1670 CB ASP A 105 -4.041 -0.143 11.329 1.00 0.00 C ATOM 1671 CG ASP A 105 -2.633 -0.039 10.775 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -2.488 0.325 9.589 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -1.677 -0.321 11.527 1.00 0.00 O ATOM 0 H ASP A 105 -6.526 0.111 11.538 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.541 1.680 12.347 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.003 -0.572 12.330 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -4.622 -0.828 10.711 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.703 1.905 9.062 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.279 2.705 7.918 1.00 0.00 C ATOM 1680 C LEU A 106 -5.027 4.033 7.875 1.00 0.00 C ATOM 1681 O LEU A 106 -4.431 5.086 7.645 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.512 1.934 6.617 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.061 2.631 5.333 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.543 2.665 5.249 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -4.650 1.937 4.114 1.00 0.00 C ATOM 0 H LEU A 106 -5.388 1.183 8.841 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.214 2.912 8.026 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.995 0.977 6.688 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.577 1.716 6.533 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.426 3.658 5.352 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.241 3.165 4.329 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.143 3.208 6.105 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.155 1.646 5.253 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.318 2.447 3.209 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.316 0.900 4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.738 1.967 4.169 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.336 3.978 8.101 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.165 5.177 8.089 1.00 0.00 C ATOM 1699 C PHE A 107 -6.614 6.229 9.047 1.00 0.00 C ATOM 1700 O PHE A 107 -6.331 7.359 8.649 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.606 4.830 8.470 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.574 5.955 8.241 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.655 6.577 7.006 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.403 6.391 9.262 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.545 7.613 6.793 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.295 7.427 9.056 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.366 8.038 7.819 1.00 0.00 C ATOM 0 H PHE A 107 -6.845 3.115 8.295 1.00 0.00 H new ATOM 0 HA PHE A 107 -7.152 5.587 7.079 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.927 3.962 7.894 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.636 4.543 9.521 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -9.015 6.249 6.200 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.352 5.916 10.230 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.598 8.090 5.825 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -11.935 7.758 9.861 1.00 0.00 H new ATOM 0 HZ PHE A 107 -12.063 8.847 7.655 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.463 5.848 10.311 1.00 0.00 N ATOM 1718 CA ASP A 108 -5.945 6.758 11.327 1.00 0.00 C ATOM 1719 C ASP A 108 -4.423 6.686 11.395 1.00 0.00 C ATOM 1720 O ASP A 108 -3.815 7.095 12.384 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.546 6.425 12.694 1.00 0.00 C ATOM 1722 CG ASP A 108 -7.873 7.119 12.927 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -8.710 7.126 12.001 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -8.074 7.657 14.037 1.00 0.00 O ATOM 0 H ASP A 108 -6.692 4.916 10.657 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.231 7.773 11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.684 5.347 12.774 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.845 6.716 13.476 1.00 0.00 H new ATOM 1729 N VAL A 109 -3.812 6.161 10.337 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.361 6.035 10.277 1.00 0.00 C ATOM 1731 C VAL A 109 -1.788 5.626 11.629 1.00 0.00 C ATOM 1732 O VAL A 109 -0.711 6.076 12.020 1.00 0.00 O ATOM 1733 CB VAL A 109 -1.701 7.353 9.830 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.242 7.124 9.468 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.461 7.958 8.658 1.00 0.00 C ATOM 0 H VAL A 109 -4.300 5.816 9.510 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.141 5.260 9.543 1.00 0.00 H new ATOM 0 HB VAL A 109 -1.738 8.058 10.661 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.207 8.066 9.155 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.292 6.738 10.336 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.178 6.403 8.653 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.981 8.889 8.355 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.457 7.259 7.822 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.489 8.161 8.957 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.515 4.770 12.339 1.00 0.00 N ATOM 1746 CA ARG A 110 -2.080 4.300 13.649 1.00 0.00 C ATOM 1747 C ARG A 110 -0.699 3.656 13.564 1.00 0.00 C ATOM 1748 O ARG A 110 0.267 4.158 14.138 1.00 0.00 O ATOM 1749 CB ARG A 110 -3.088 3.299 14.216 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.500 3.851 14.325 1.00 0.00 C ATOM 1751 CD ARG A 110 -5.260 3.213 15.477 1.00 0.00 C ATOM 1752 NE ARG A 110 -4.754 3.649 16.776 1.00 0.00 N ATOM 1753 CZ ARG A 110 -5.113 4.787 17.360 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -5.976 5.598 16.764 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -4.608 5.115 18.543 1.00 0.00 N ATOM 0 H ARG A 110 -3.408 4.388 12.029 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.020 5.161 14.315 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -3.102 2.412 13.583 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.754 2.980 15.204 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.460 4.931 14.468 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.035 3.673 13.392 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.317 3.465 15.397 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -5.184 2.128 15.404 1.00 0.00 H new ATOM 0 HE ARG A 110 -4.089 3.047 17.261 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -6.366 5.349 15.855 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -6.250 6.471 17.214 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.944 4.493 19.004 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.884 5.989 18.991 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.615 2.542 12.846 1.00 0.00 N ATOM 1770 CA ASP A 111 0.647 1.829 12.685 1.00 0.00 C ATOM 1771 C ASP A 111 0.902 1.500 11.217 1.00 0.00 C ATOM 1772 O ASP A 111 0.517 0.435 10.733 1.00 0.00 O ATOM 1773 CB ASP A 111 0.640 0.544 13.515 1.00 0.00 C ATOM 1774 CG ASP A 111 0.399 0.808 14.988 1.00 0.00 C ATOM 1775 OD1 ASP A 111 -0.714 1.255 15.336 1.00 0.00 O ATOM 1776 OD2 ASP A 111 1.324 0.569 15.794 1.00 0.00 O ATOM 0 H ASP A 111 -1.406 2.113 12.366 1.00 0.00 H new ATOM 0 HA ASP A 111 1.450 2.476 13.038 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.133 -0.125 13.137 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.593 0.030 13.392 1.00 0.00 H new ATOM 1781 N PHE A 112 1.552 2.421 10.514 1.00 0.00 N ATOM 1782 CA PHE A 112 1.857 2.229 9.101 1.00 0.00 C ATOM 1783 C PHE A 112 2.767 1.021 8.900 1.00 0.00 C ATOM 1784 O PHE A 112 2.604 0.259 7.948 1.00 0.00 O ATOM 1785 CB PHE A 112 2.521 3.483 8.527 1.00 0.00 C ATOM 1786 CG PHE A 112 2.648 3.461 7.030 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.534 3.266 6.230 1.00 0.00 C ATOM 1788 CD2 PHE A 112 3.881 3.637 6.424 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.649 3.245 4.852 1.00 0.00 C ATOM 1790 CE2 PHE A 112 4.002 3.617 5.047 1.00 0.00 C ATOM 1791 CZ PHE A 112 2.884 3.422 4.260 1.00 0.00 C ATOM 0 H PHE A 112 1.878 3.307 10.899 1.00 0.00 H new ATOM 0 HA PHE A 112 0.920 2.047 8.574 1.00 0.00 H new ATOM 0 HB2 PHE A 112 1.942 4.358 8.822 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.512 3.593 8.966 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.565 3.129 6.687 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.758 3.792 7.035 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.773 3.090 4.239 1.00 0.00 H new ATOM 0 HE2 PHE A 112 4.970 3.754 4.587 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.975 3.408 3.184 1.00 0.00 H new ATOM 1801 N GLY A 113 3.728 0.854 9.804 1.00 0.00 N ATOM 1802 CA GLY A 113 4.651 -0.262 9.708 1.00 0.00 C ATOM 1803 C GLY A 113 3.953 -1.564 9.369 1.00 0.00 C ATOM 1804 O GLY A 113 4.484 -2.386 8.622 1.00 0.00 O ATOM 0 H GLY A 113 3.884 1.472 10.601 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.400 -0.046 8.946 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.181 -0.373 10.654 1.00 0.00 H new ATOM 1808 N LYS A 114 2.759 -1.754 9.920 1.00 0.00 N ATOM 1809 CA LYS A 114 1.986 -2.965 9.674 1.00 0.00 C ATOM 1810 C LYS A 114 1.597 -3.073 8.202 1.00 0.00 C ATOM 1811 O LYS A 114 1.583 -4.164 7.632 1.00 0.00 O ATOM 1812 CB LYS A 114 0.728 -2.979 10.546 1.00 0.00 C ATOM 1813 CG LYS A 114 1.022 -2.974 12.036 1.00 0.00 C ATOM 1814 CD LYS A 114 -0.131 -3.559 12.834 1.00 0.00 C ATOM 1815 CE LYS A 114 0.338 -4.100 14.176 1.00 0.00 C ATOM 1816 NZ LYS A 114 0.444 -3.025 15.201 1.00 0.00 N ATOM 0 H LYS A 114 2.305 -1.084 10.541 1.00 0.00 H new ATOM 0 HA LYS A 114 2.609 -3.821 9.932 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.117 -2.110 10.302 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.138 -3.863 10.303 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.928 -3.547 12.231 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.213 -1.953 12.367 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.890 -2.793 12.994 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.602 -4.359 12.262 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -0.357 -4.865 14.522 1.00 0.00 H new ATOM 0 HE3 LYS A 114 1.308 -4.583 14.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.766 -3.434 16.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 1.126 -2.308 14.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.487 -2.581 15.336 1.00 0.00 H new ATOM 1830 N VAL A 115 1.285 -1.934 7.593 1.00 0.00 N ATOM 1831 CA VAL A 115 0.899 -1.900 6.187 1.00 0.00 C ATOM 1832 C VAL A 115 2.095 -2.176 5.282 1.00 0.00 C ATOM 1833 O VAL A 115 1.979 -2.885 4.283 1.00 0.00 O ATOM 1834 CB VAL A 115 0.284 -0.540 5.806 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.236 -0.571 4.377 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.825 -0.167 6.779 1.00 0.00 C ATOM 0 H VAL A 115 1.292 -1.023 8.051 1.00 0.00 H new ATOM 0 HA VAL A 115 0.152 -2.681 6.045 1.00 0.00 H new ATOM 0 HB VAL A 115 1.061 0.222 5.867 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.667 0.398 4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.586 -0.791 3.695 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.000 -1.343 4.285 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.249 0.796 6.496 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.604 -0.929 6.752 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.417 -0.101 7.788 1.00 0.00 H new ATOM 1846 N ILE A 116 3.243 -1.611 5.640 1.00 0.00 N ATOM 1847 CA ILE A 116 4.461 -1.797 4.861 1.00 0.00 C ATOM 1848 C ILE A 116 4.824 -3.274 4.753 1.00 0.00 C ATOM 1849 O ILE A 116 5.102 -3.777 3.665 1.00 0.00 O ATOM 1850 CB ILE A 116 5.647 -1.033 5.479 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.287 0.442 5.670 1.00 0.00 C ATOM 1852 CG2 ILE A 116 6.882 -1.173 4.602 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.355 1.236 6.389 1.00 0.00 C ATOM 0 H ILE A 116 3.355 -1.021 6.464 1.00 0.00 H new ATOM 0 HA ILE A 116 4.262 -1.400 3.866 1.00 0.00 H new ATOM 0 HB ILE A 116 5.868 -1.463 6.456 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.106 0.893 4.694 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.355 0.511 6.231 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.712 -0.628 5.052 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.147 -2.227 4.512 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.674 -0.765 3.613 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.032 2.272 6.489 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.521 0.810 7.379 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.283 1.198 5.818 1.00 0.00 H new ATOM 1865 N GLU A 117 4.817 -3.964 5.889 1.00 0.00 N ATOM 1866 CA GLU A 117 5.144 -5.385 5.921 1.00 0.00 C ATOM 1867 C GLU A 117 4.308 -6.159 4.906 1.00 0.00 C ATOM 1868 O GLU A 117 4.836 -6.943 4.117 1.00 0.00 O ATOM 1869 CB GLU A 117 4.917 -5.952 7.324 1.00 0.00 C ATOM 1870 CG GLU A 117 5.551 -7.316 7.539 1.00 0.00 C ATOM 1871 CD GLU A 117 5.883 -7.582 8.995 1.00 0.00 C ATOM 1872 OE1 GLU A 117 4.944 -7.793 9.790 1.00 0.00 O ATOM 1873 OE2 GLU A 117 7.084 -7.578 9.339 1.00 0.00 O ATOM 0 H GLU A 117 4.589 -3.563 6.799 1.00 0.00 H new ATOM 0 HA GLU A 117 6.196 -5.495 5.658 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.319 -5.254 8.058 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.845 -6.026 7.508 1.00 0.00 H new ATOM 0 HG2 GLU A 117 4.873 -8.089 7.178 1.00 0.00 H new ATOM 0 HG3 GLU A 117 6.461 -7.387 6.944 1.00 0.00 H new ATOM 1880 N THR A 118 2.998 -5.934 4.933 1.00 0.00 N ATOM 1881 CA THR A 118 2.087 -6.611 4.018 1.00 0.00 C ATOM 1882 C THR A 118 2.677 -6.692 2.615 1.00 0.00 C ATOM 1883 O THR A 118 2.710 -7.761 2.005 1.00 0.00 O ATOM 1884 CB THR A 118 0.725 -5.895 3.950 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.120 -5.867 5.247 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.204 -6.591 2.967 1.00 0.00 C ATOM 0 H THR A 118 2.544 -5.288 5.579 1.00 0.00 H new ATOM 0 HA THR A 118 1.940 -7.619 4.406 1.00 0.00 H new ATOM 0 HB THR A 118 0.894 -4.874 3.606 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.266 -4.989 5.657 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.159 -6.067 2.936 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.246 -6.584 1.974 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.365 -7.621 3.285 1.00 0.00 H new ATOM 1894 N LEU A 119 3.142 -5.555 2.108 1.00 0.00 N ATOM 1895 CA LEU A 119 3.733 -5.498 0.775 1.00 0.00 C ATOM 1896 C LEU A 119 4.958 -6.402 0.683 1.00 0.00 C ATOM 1897 O LEU A 119 5.130 -7.133 -0.293 1.00 0.00 O ATOM 1898 CB LEU A 119 4.120 -4.059 0.429 1.00 0.00 C ATOM 1899 CG LEU A 119 3.043 -2.999 0.665 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.620 -1.603 0.488 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.867 -3.215 -0.276 1.00 0.00 C ATOM 0 H LEU A 119 3.121 -4.661 2.599 1.00 0.00 H new ATOM 0 HA LEU A 119 2.990 -5.850 0.060 1.00 0.00 H new ATOM 0 HB2 LEU A 119 5.000 -3.790 1.013 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.411 -4.025 -0.621 1.00 0.00 H new ATOM 0 HG LEU A 119 2.685 -3.095 1.690 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.839 -0.862 0.660 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.429 -1.450 1.203 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.006 -1.495 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 119 1.110 -2.452 -0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.210 -3.147 -1.308 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.437 -4.201 -0.101 1.00 0.00 H new ATOM 1913 N SER A 120 5.805 -6.349 1.706 1.00 0.00 N ATOM 1914 CA SER A 120 7.015 -7.162 1.739 1.00 0.00 C ATOM 1915 C SER A 120 6.697 -8.622 1.433 1.00 0.00 C ATOM 1916 O SER A 120 7.425 -9.286 0.696 1.00 0.00 O ATOM 1917 CB SER A 120 7.692 -7.051 3.107 1.00 0.00 C ATOM 1918 OG SER A 120 8.993 -7.610 3.079 1.00 0.00 O ATOM 0 H SER A 120 5.676 -5.752 2.523 1.00 0.00 H new ATOM 0 HA SER A 120 7.695 -6.789 0.974 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.749 -6.004 3.404 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.089 -7.563 3.857 1.00 0.00 H new ATOM 0 HG SER A 120 9.560 -7.090 2.472 1.00 0.00 H new ATOM 1924 N ARG A 121 5.603 -9.115 2.006 1.00 0.00 N ATOM 1925 CA ARG A 121 5.188 -10.497 1.796 1.00 0.00 C ATOM 1926 C ARG A 121 4.507 -10.661 0.441 1.00 0.00 C ATOM 1927 O ARG A 121 4.730 -11.647 -0.263 1.00 0.00 O ATOM 1928 CB ARG A 121 4.241 -10.942 2.912 1.00 0.00 C ATOM 1929 CG ARG A 121 4.869 -10.903 4.296 1.00 0.00 C ATOM 1930 CD ARG A 121 3.823 -11.071 5.387 1.00 0.00 C ATOM 1931 NE ARG A 121 4.363 -10.779 6.712 1.00 0.00 N ATOM 1932 CZ ARG A 121 5.058 -11.653 7.431 1.00 0.00 C ATOM 1933 NH1 ARG A 121 5.297 -12.867 6.956 1.00 0.00 N ATOM 1934 NH2 ARG A 121 5.517 -11.313 8.629 1.00 0.00 N ATOM 0 H ARG A 121 4.989 -8.578 2.619 1.00 0.00 H new ATOM 0 HA ARG A 121 6.079 -11.124 1.813 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.359 -10.302 2.905 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.901 -11.957 2.705 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.615 -11.693 4.381 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.391 -9.956 4.433 1.00 0.00 H new ATOM 0 HD2 ARG A 121 2.980 -10.410 5.186 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.440 -12.091 5.368 1.00 0.00 H new ATOM 0 HE ARG A 121 4.197 -9.853 7.107 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.947 -13.133 6.036 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.831 -13.536 7.511 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.336 -10.380 8.998 1.00 0.00 H new ATOM 0 HH22 ARG A 121 6.051 -11.985 9.180 1.00 0.00 H new ATOM 1948 N LEU A 122 3.676 -9.689 0.081 1.00 0.00 N ATOM 1949 CA LEU A 122 2.961 -9.725 -1.190 1.00 0.00 C ATOM 1950 C LEU A 122 3.936 -9.818 -2.360 1.00 0.00 C ATOM 1951 O LEU A 122 3.646 -10.454 -3.373 1.00 0.00 O ATOM 1952 CB LEU A 122 2.084 -8.480 -1.340 1.00 0.00 C ATOM 1953 CG LEU A 122 1.596 -8.170 -2.755 1.00 0.00 C ATOM 1954 CD1 LEU A 122 0.538 -9.173 -3.187 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.050 -6.751 -2.832 1.00 0.00 C ATOM 0 H LEU A 122 3.481 -8.866 0.651 1.00 0.00 H new ATOM 0 HA LEU A 122 2.327 -10.612 -1.197 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.214 -8.593 -0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.644 -7.619 -0.973 1.00 0.00 H new ATOM 0 HG LEU A 122 2.443 -8.250 -3.436 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.203 -8.936 -4.197 1.00 0.00 H new ATOM 0 HD12 LEU A 122 0.961 -10.177 -3.171 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.309 -9.125 -2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.707 -6.548 -3.846 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.216 -6.644 -2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.836 -6.044 -2.566 1.00 0.00 H new ATOM 1967 N SER A 123 5.093 -9.180 -2.212 1.00 0.00 N ATOM 1968 CA SER A 123 6.109 -9.189 -3.257 1.00 0.00 C ATOM 1969 C SER A 123 6.555 -10.615 -3.569 1.00 0.00 C ATOM 1970 O SER A 123 6.948 -10.922 -4.695 1.00 0.00 O ATOM 1971 CB SER A 123 7.315 -8.348 -2.833 1.00 0.00 C ATOM 1972 OG SER A 123 8.132 -9.053 -1.915 1.00 0.00 O ATOM 0 H SER A 123 5.350 -8.651 -1.379 1.00 0.00 H new ATOM 0 HA SER A 123 5.672 -8.757 -4.157 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.900 -8.077 -3.712 1.00 0.00 H new ATOM 0 HB3 SER A 123 6.972 -7.418 -2.379 1.00 0.00 H new ATOM 0 HG SER A 123 7.656 -9.155 -1.065 1.00 0.00 H new ATOM 1978 N ARG A 124 6.491 -11.481 -2.563 1.00 0.00 N ATOM 1979 CA ARG A 124 6.889 -12.874 -2.728 1.00 0.00 C ATOM 1980 C ARG A 124 6.039 -13.560 -3.795 1.00 0.00 C ATOM 1981 O ARG A 124 6.544 -14.346 -4.597 1.00 0.00 O ATOM 1982 CB ARG A 124 6.762 -13.624 -1.401 1.00 0.00 C ATOM 1983 CG ARG A 124 7.799 -13.212 -0.368 1.00 0.00 C ATOM 1984 CD ARG A 124 9.121 -13.929 -0.590 1.00 0.00 C ATOM 1985 NE ARG A 124 8.982 -15.380 -0.486 1.00 0.00 N ATOM 1986 CZ ARG A 124 8.730 -16.170 -1.523 1.00 0.00 C ATOM 1987 NH1 ARG A 124 8.591 -15.653 -2.736 1.00 0.00 N ATOM 1988 NH2 ARG A 124 8.617 -17.480 -1.348 1.00 0.00 N ATOM 0 H ARG A 124 6.167 -11.243 -1.625 1.00 0.00 H new ATOM 0 HA ARG A 124 7.930 -12.892 -3.050 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.766 -13.455 -0.991 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.852 -14.694 -1.588 1.00 0.00 H new ATOM 0 HG2 ARG A 124 7.955 -12.134 -0.418 1.00 0.00 H new ATOM 0 HG3 ARG A 124 7.427 -13.434 0.632 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.512 -13.672 -1.575 1.00 0.00 H new ATOM 0 HD3 ARG A 124 9.849 -13.581 0.143 1.00 0.00 H new ATOM 0 HE ARG A 124 9.084 -15.809 0.434 1.00 0.00 H new ATOM 0 HH11 ARG A 124 8.678 -14.646 -2.874 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.397 -16.262 -3.531 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.724 -17.881 -0.416 1.00 0.00 H new ATOM 0 HH22 ARG A 124 8.423 -18.086 -2.145 1.00 0.00 H new ATOM 2002 N THR A 125 4.744 -13.257 -3.797 1.00 0.00 N ATOM 2003 CA THR A 125 3.824 -13.844 -4.763 1.00 0.00 C ATOM 2004 C THR A 125 4.475 -13.971 -6.136 1.00 0.00 C ATOM 2005 O THR A 125 5.337 -13.179 -6.516 1.00 0.00 O ATOM 2006 CB THR A 125 2.537 -13.008 -4.893 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.856 -11.686 -5.342 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.803 -12.934 -3.563 1.00 0.00 C ATOM 0 H THR A 125 4.309 -12.609 -3.140 1.00 0.00 H new ATOM 0 HA THR A 125 3.568 -14.837 -4.392 1.00 0.00 H new ATOM 0 HB THR A 125 1.887 -13.492 -5.622 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.804 -11.063 -4.588 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.898 -12.339 -3.680 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.537 -13.940 -3.238 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.448 -12.471 -2.817 1.00 0.00 H new ATOM 2016 N PRO A 126 4.054 -14.991 -6.898 1.00 0.00 N ATOM 2017 CA PRO A 126 4.583 -15.245 -8.242 1.00 0.00 C ATOM 2018 C PRO A 126 4.146 -14.185 -9.247 1.00 0.00 C ATOM 2019 O PRO A 126 4.479 -14.263 -10.430 1.00 0.00 O ATOM 2020 CB PRO A 126 3.985 -16.607 -8.607 1.00 0.00 C ATOM 2021 CG PRO A 126 2.742 -16.705 -7.791 1.00 0.00 C ATOM 2022 CD PRO A 126 3.030 -15.974 -6.508 1.00 0.00 C ATOM 0 HA PRO A 126 5.673 -15.223 -8.262 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.765 -16.670 -9.673 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.676 -17.418 -8.375 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.896 -16.258 -8.313 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.483 -17.746 -7.597 1.00 0.00 H new ATOM 0 HD2 PRO A 126 2.137 -15.489 -6.113 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.395 -16.649 -5.734 1.00 0.00 H new ATOM 2030 N ILE A 127 3.400 -13.195 -8.769 1.00 0.00 N ATOM 2031 CA ILE A 127 2.919 -12.119 -9.626 1.00 0.00 C ATOM 2032 C ILE A 127 3.821 -10.893 -9.528 1.00 0.00 C ATOM 2033 O ILE A 127 4.137 -10.260 -10.535 1.00 0.00 O ATOM 2034 CB ILE A 127 1.478 -11.712 -9.264 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.553 -12.929 -9.315 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.983 -10.624 -10.206 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.451 -13.665 -7.997 1.00 0.00 C ATOM 0 H ILE A 127 3.116 -13.116 -7.793 1.00 0.00 H new ATOM 0 HA ILE A 127 2.935 -12.499 -10.648 1.00 0.00 H new ATOM 0 HB ILE A 127 1.472 -11.317 -8.248 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.442 -12.606 -9.620 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.913 -13.617 -10.080 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.036 -10.347 -9.938 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.630 -9.750 -10.125 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.001 -10.994 -11.231 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.221 -14.516 -8.107 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.439 -14.018 -7.700 1.00 0.00 H new ATOM 0 HD13 ILE A 127 0.062 -12.992 -7.233 1.00 0.00 H new ATOM 2049 N ALA A 128 4.235 -10.566 -8.308 1.00 0.00 N ATOM 2050 CA ALA A 128 5.105 -9.419 -8.078 1.00 0.00 C ATOM 2051 C ALA A 128 6.495 -9.660 -8.656 1.00 0.00 C ATOM 2052 O ALA A 128 7.107 -8.756 -9.227 1.00 0.00 O ATOM 2053 CB ALA A 128 5.195 -9.115 -6.590 1.00 0.00 C ATOM 0 H ALA A 128 3.982 -11.079 -7.464 1.00 0.00 H new ATOM 0 HA ALA A 128 4.673 -8.558 -8.588 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.848 -8.256 -6.433 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.201 -8.890 -6.204 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.601 -9.980 -6.066 1.00 0.00 H new ATOM 2059 N LEU A 129 6.990 -10.884 -8.504 1.00 0.00 N ATOM 2060 CA LEU A 129 8.310 -11.243 -9.011 1.00 0.00 C ATOM 2061 C LEU A 129 8.281 -11.424 -10.525 1.00 0.00 C ATOM 2062 O LEU A 129 9.236 -11.078 -11.220 1.00 0.00 O ATOM 2063 CB LEU A 129 8.802 -12.528 -8.342 1.00 0.00 C ATOM 2064 CG LEU A 129 8.754 -12.550 -6.814 1.00 0.00 C ATOM 2065 CD1 LEU A 129 9.181 -13.911 -6.286 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.634 -11.451 -6.237 1.00 0.00 C ATOM 0 H LEU A 129 6.498 -11.644 -8.034 1.00 0.00 H new ATOM 0 HA LEU A 129 8.997 -10.430 -8.774 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.206 -13.360 -8.716 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.830 -12.706 -8.656 1.00 0.00 H new ATOM 0 HG LEU A 129 7.727 -12.368 -6.499 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.141 -13.908 -5.197 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.509 -14.678 -6.672 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.200 -14.124 -6.611 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.588 -11.482 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.664 -11.602 -6.561 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.282 -10.481 -6.588 1.00 0.00 H new ATOM 2078 N ALA A 130 7.178 -11.967 -11.031 1.00 0.00 N ATOM 2079 CA ALA A 130 7.024 -12.189 -12.463 1.00 0.00 C ATOM 2080 C ALA A 130 7.445 -10.958 -13.258 1.00 0.00 C ATOM 2081 O ALA A 130 8.137 -11.067 -14.271 1.00 0.00 O ATOM 2082 CB ALA A 130 5.584 -12.562 -12.786 1.00 0.00 C ATOM 0 H ALA A 130 6.378 -12.261 -10.470 1.00 0.00 H new ATOM 0 HA ALA A 130 7.675 -13.014 -12.751 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.482 -12.725 -13.859 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.316 -13.474 -12.253 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.921 -11.754 -12.477 1.00 0.00 H new ATOM 2088 N THR A 131 7.023 -9.786 -12.794 1.00 0.00 N ATOM 2089 CA THR A 131 7.355 -8.535 -13.463 1.00 0.00 C ATOM 2090 C THR A 131 8.858 -8.281 -13.440 1.00 0.00 C ATOM 2091 O THR A 131 9.426 -7.771 -14.405 1.00 0.00 O ATOM 2092 CB THR A 131 6.635 -7.340 -12.810 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.162 -7.107 -11.499 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.138 -7.593 -12.722 1.00 0.00 C ATOM 0 H THR A 131 6.450 -9.677 -11.957 1.00 0.00 H new ATOM 0 HA THR A 131 7.021 -8.631 -14.496 1.00 0.00 H new ATOM 0 HB THR A 131 6.803 -6.460 -13.430 1.00 0.00 H new ATOM 0 HG1 THR A 131 6.990 -7.889 -10.934 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.651 -6.736 -12.258 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.735 -7.741 -13.724 1.00 0.00 H new ATOM 0 HG23 THR A 131 4.954 -8.484 -12.122 1.00 0.00 H new ATOM 2102 N GLY A 132 9.498 -8.642 -12.332 1.00 0.00 N ATOM 2103 CA GLY A 132 10.931 -8.446 -12.205 1.00 0.00 C ATOM 2104 C GLY A 132 11.279 -7.144 -11.510 1.00 0.00 C ATOM 2105 O GLY A 132 12.346 -6.576 -11.741 1.00 0.00 O ATOM 0 H GLY A 132 9.050 -9.067 -11.520 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.360 -9.278 -11.647 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.385 -8.458 -13.196 1.00 0.00 H new ATOM 2109 N ILE A 133 10.376 -6.671 -10.658 1.00 0.00 N ATOM 2110 CA ILE A 133 10.593 -5.428 -9.928 1.00 0.00 C ATOM 2111 C ILE A 133 11.390 -5.673 -8.651 1.00 0.00 C ATOM 2112 O ILE A 133 11.202 -6.684 -7.974 1.00 0.00 O ATOM 2113 CB ILE A 133 9.259 -4.749 -9.564 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.459 -4.435 -10.830 1.00 0.00 C ATOM 2115 CG2 ILE A 133 9.513 -3.480 -8.763 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.001 -4.135 -10.564 1.00 0.00 C ATOM 0 H ILE A 133 9.487 -7.129 -10.456 1.00 0.00 H new ATOM 0 HA ILE A 133 11.159 -4.770 -10.587 1.00 0.00 H new ATOM 0 HB ILE A 133 8.675 -5.434 -8.949 1.00 0.00 H new ATOM 0 HG12 ILE A 133 8.911 -3.581 -11.333 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.529 -5.281 -11.513 1.00 0.00 H new ATOM 0 HG21 ILE A 133 8.561 -3.011 -8.513 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.047 -3.729 -7.846 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.113 -2.790 -9.356 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.496 -3.922 -11.506 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.533 -4.997 -10.088 1.00 0.00 H new ATOM 0 HD13 ILE A 133 6.922 -3.270 -9.906 1.00 0.00 H new ATOM 2128 N ARG A 134 12.280 -4.740 -8.328 1.00 0.00 N ATOM 2129 CA ARG A 134 13.107 -4.854 -7.133 1.00 0.00 C ATOM 2130 C ARG A 134 12.341 -5.543 -6.006 1.00 0.00 C ATOM 2131 O ARG A 134 11.567 -4.922 -5.278 1.00 0.00 O ATOM 2132 CB ARG A 134 13.573 -3.471 -6.675 1.00 0.00 C ATOM 2133 CG ARG A 134 14.649 -2.867 -7.562 1.00 0.00 C ATOM 2134 CD ARG A 134 15.098 -1.508 -7.046 1.00 0.00 C ATOM 2135 NE ARG A 134 16.054 -1.627 -5.949 1.00 0.00 N ATOM 2136 CZ ARG A 134 16.306 -0.651 -5.085 1.00 0.00 C ATOM 2137 NH1 ARG A 134 15.676 0.511 -5.189 1.00 0.00 N ATOM 2138 NH2 ARG A 134 17.190 -0.836 -4.113 1.00 0.00 N ATOM 0 H ARG A 134 12.447 -3.897 -8.877 1.00 0.00 H new ATOM 0 HA ARG A 134 13.979 -5.460 -7.381 1.00 0.00 H new ATOM 0 HB2 ARG A 134 12.716 -2.798 -6.649 1.00 0.00 H new ATOM 0 HB3 ARG A 134 13.953 -3.544 -5.656 1.00 0.00 H new ATOM 0 HG2 ARG A 134 15.505 -3.541 -7.608 1.00 0.00 H new ATOM 0 HG3 ARG A 134 14.269 -2.764 -8.578 1.00 0.00 H new ATOM 0 HD2 ARG A 134 15.550 -0.942 -7.861 1.00 0.00 H new ATOM 0 HD3 ARG A 134 14.229 -0.943 -6.709 1.00 0.00 H new ATOM 0 HE ARG A 134 16.556 -2.508 -5.840 1.00 0.00 H new ATOM 0 HH11 ARG A 134 14.995 0.657 -5.934 1.00 0.00 H new ATOM 0 HH12 ARG A 134 15.872 1.259 -4.523 1.00 0.00 H new ATOM 0 HH21 ARG A 134 17.677 -1.729 -4.029 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.383 -0.086 -3.450 1.00 0.00 H new ATOM 2152 N PRO A 135 12.562 -6.858 -5.859 1.00 0.00 N ATOM 2153 CA PRO A 135 11.902 -7.660 -4.824 1.00 0.00 C ATOM 2154 C PRO A 135 12.399 -7.320 -3.423 1.00 0.00 C ATOM 2155 O PRO A 135 13.511 -6.818 -3.252 1.00 0.00 O ATOM 2156 CB PRO A 135 12.282 -9.096 -5.192 1.00 0.00 C ATOM 2157 CG PRO A 135 13.559 -8.968 -5.949 1.00 0.00 C ATOM 2158 CD PRO A 135 13.472 -7.663 -6.691 1.00 0.00 C ATOM 0 HA PRO A 135 10.827 -7.483 -4.795 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.409 -9.712 -4.302 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.508 -9.567 -5.798 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.415 -8.977 -5.274 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.689 -9.801 -6.639 1.00 0.00 H new ATOM 0 HD2 PRO A 135 14.449 -7.191 -6.790 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.080 -7.799 -7.699 1.00 0.00 H new ATOM 2166 N PHE A 136 11.570 -7.596 -2.422 1.00 0.00 N ATOM 2167 CA PHE A 136 11.925 -7.319 -1.035 1.00 0.00 C ATOM 2168 C PHE A 136 13.071 -8.216 -0.578 1.00 0.00 C ATOM 2169 O PHE A 136 13.280 -9.313 -1.096 1.00 0.00 O ATOM 2170 CB PHE A 136 10.711 -7.520 -0.126 1.00 0.00 C ATOM 2171 CG PHE A 136 9.860 -6.291 0.017 1.00 0.00 C ATOM 2172 CD1 PHE A 136 8.902 -5.980 -0.934 1.00 0.00 C ATOM 2173 CD2 PHE A 136 10.018 -5.445 1.104 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.117 -4.850 -0.806 1.00 0.00 C ATOM 2175 CE2 PHE A 136 9.235 -4.314 1.239 1.00 0.00 C ATOM 2176 CZ PHE A 136 8.284 -4.016 0.282 1.00 0.00 C ATOM 0 H PHE A 136 10.647 -8.012 -2.546 1.00 0.00 H new ATOM 0 HA PHE A 136 12.251 -6.281 -0.970 1.00 0.00 H new ATOM 0 HB2 PHE A 136 10.100 -8.331 -0.523 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.053 -7.832 0.861 1.00 0.00 H new ATOM 0 HD1 PHE A 136 8.767 -6.629 -1.787 1.00 0.00 H new ATOM 0 HD2 PHE A 136 10.761 -5.672 1.854 1.00 0.00 H new ATOM 0 HE1 PHE A 136 7.374 -4.619 -1.555 1.00 0.00 H new ATOM 0 HE2 PHE A 136 9.366 -3.664 2.091 1.00 0.00 H new ATOM 0 HZ PHE A 136 7.672 -3.132 0.385 1.00 0.00 H new ATOM 2186 N PRO A 137 13.834 -7.740 0.417 1.00 0.00 N ATOM 2187 CA PRO A 137 14.973 -8.482 0.967 1.00 0.00 C ATOM 2188 C PRO A 137 14.536 -9.710 1.758 1.00 0.00 C ATOM 2189 O PRO A 137 13.511 -9.689 2.440 1.00 0.00 O ATOM 2190 CB PRO A 137 15.648 -7.463 1.889 1.00 0.00 C ATOM 2191 CG PRO A 137 14.560 -6.519 2.272 1.00 0.00 C ATOM 2192 CD PRO A 137 13.644 -6.440 1.082 1.00 0.00 C ATOM 0 HA PRO A 137 15.626 -8.866 0.184 1.00 0.00 H new ATOM 0 HB2 PRO A 137 16.079 -7.947 2.765 1.00 0.00 H new ATOM 0 HB3 PRO A 137 16.460 -6.945 1.379 1.00 0.00 H new ATOM 0 HG2 PRO A 137 14.026 -6.875 3.153 1.00 0.00 H new ATOM 0 HG3 PRO A 137 14.964 -5.537 2.520 1.00 0.00 H new ATOM 0 HD2 PRO A 137 12.607 -6.290 1.383 1.00 0.00 H new ATOM 0 HD3 PRO A 137 13.908 -5.611 0.426 1.00 0.00 H new ATOM 2200 N SER A 138 15.321 -10.779 1.664 1.00 0.00 N ATOM 2201 CA SER A 138 15.013 -12.017 2.369 1.00 0.00 C ATOM 2202 C SER A 138 15.480 -11.947 3.820 1.00 0.00 C ATOM 2203 O SER A 138 14.707 -12.191 4.745 1.00 0.00 O ATOM 2204 CB SER A 138 15.671 -13.206 1.666 1.00 0.00 C ATOM 2205 OG SER A 138 17.080 -13.056 1.621 1.00 0.00 O ATOM 0 H SER A 138 16.175 -10.812 1.107 1.00 0.00 H new ATOM 0 HA SER A 138 13.931 -12.152 2.360 1.00 0.00 H new ATOM 0 HB2 SER A 138 15.417 -14.128 2.189 1.00 0.00 H new ATOM 0 HB3 SER A 138 15.279 -13.296 0.653 1.00 0.00 H new ATOM 0 HG SER A 138 17.477 -13.829 1.169 1.00 0.00 H new ATOM 2211 N GLY A 139 16.753 -11.613 4.009 1.00 0.00 N ATOM 2212 CA GLY A 139 17.303 -11.517 5.349 1.00 0.00 C ATOM 2213 C GLY A 139 18.066 -12.763 5.753 1.00 0.00 C ATOM 2214 O GLY A 139 17.837 -13.853 5.230 1.00 0.00 O ATOM 0 H GLY A 139 17.413 -11.407 3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 139 17.967 -10.654 5.405 1.00 0.00 H new ATOM 0 HA3 GLY A 139 16.494 -11.344 6.059 1.00 0.00 H new ATOM 2218 N PRO A 140 18.997 -12.608 6.706 1.00 0.00 N ATOM 2219 CA PRO A 140 19.816 -13.719 7.201 1.00 0.00 C ATOM 2220 C PRO A 140 19.004 -14.717 8.019 1.00 0.00 C ATOM 2221 O PRO A 140 19.521 -15.750 8.446 1.00 0.00 O ATOM 2222 CB PRO A 140 20.858 -13.027 8.083 1.00 0.00 C ATOM 2223 CG PRO A 140 20.205 -11.759 8.516 1.00 0.00 C ATOM 2224 CD PRO A 140 19.322 -11.337 7.374 1.00 0.00 C ATOM 0 HA PRO A 140 20.247 -14.302 6.387 1.00 0.00 H new ATOM 0 HB2 PRO A 140 21.127 -13.646 8.939 1.00 0.00 H new ATOM 0 HB3 PRO A 140 21.777 -12.831 7.531 1.00 0.00 H new ATOM 0 HG2 PRO A 140 19.622 -11.911 9.425 1.00 0.00 H new ATOM 0 HG3 PRO A 140 20.948 -10.993 8.738 1.00 0.00 H new ATOM 0 HD2 PRO A 140 18.425 -10.828 7.727 1.00 0.00 H new ATOM 0 HD3 PRO A 140 19.836 -10.650 6.702 1.00 0.00 H new ATOM 2232 N SER A 141 17.730 -14.403 8.233 1.00 0.00 N ATOM 2233 CA SER A 141 16.848 -15.272 9.004 1.00 0.00 C ATOM 2234 C SER A 141 16.195 -16.318 8.105 1.00 0.00 C ATOM 2235 O SER A 141 15.968 -16.078 6.919 1.00 0.00 O ATOM 2236 CB SER A 141 15.771 -14.445 9.708 1.00 0.00 C ATOM 2237 OG SER A 141 15.221 -15.153 10.805 1.00 0.00 O ATOM 0 H SER A 141 17.286 -13.554 7.884 1.00 0.00 H new ATOM 0 HA SER A 141 17.449 -15.786 9.754 1.00 0.00 H new ATOM 0 HB2 SER A 141 16.199 -13.505 10.056 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.981 -14.193 9.001 1.00 0.00 H new ATOM 0 HG SER A 141 14.536 -14.603 11.239 1.00 0.00 H new ATOM 2243 N SER A 142 15.896 -17.479 8.679 1.00 0.00 N ATOM 2244 CA SER A 142 15.273 -18.564 7.930 1.00 0.00 C ATOM 2245 C SER A 142 13.758 -18.551 8.113 1.00 0.00 C ATOM 2246 O SER A 142 13.258 -18.368 9.222 1.00 0.00 O ATOM 2247 CB SER A 142 15.840 -19.912 8.377 1.00 0.00 C ATOM 2248 OG SER A 142 15.200 -20.983 7.706 1.00 0.00 O ATOM 0 H SER A 142 16.075 -17.692 9.660 1.00 0.00 H new ATOM 0 HA SER A 142 15.495 -18.417 6.873 1.00 0.00 H new ATOM 0 HB2 SER A 142 16.911 -19.943 8.179 1.00 0.00 H new ATOM 0 HB3 SER A 142 15.712 -20.025 9.454 1.00 0.00 H new ATOM 0 HG SER A 142 15.582 -21.833 8.008 1.00 0.00 H new ATOM 2254 N GLY A 143 13.034 -18.746 7.016 1.00 0.00 N ATOM 2255 CA GLY A 143 11.584 -18.752 7.076 1.00 0.00 C ATOM 2256 C GLY A 143 10.965 -19.666 6.037 1.00 0.00 C ATOM 2257 O GLY A 143 10.340 -20.670 6.377 1.00 0.00 O ATOM 0 H GLY A 143 13.425 -18.900 6.087 1.00 0.00 H new ATOM 0 HA2 GLY A 143 11.266 -19.068 8.069 1.00 0.00 H new ATOM 0 HA3 GLY A 143 11.213 -17.737 6.930 1.00 0.00 H new TER 2261 GLY A 143