USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1035 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 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 128 TYR OH : rot 150:sc= 0.393 USER MOD Set 2.1: A 19 TYR OH : rot 180:sc= 1.04 USER MOD Set 2.2: A 102 THR OG1 : rot 163:sc= 1.47 USER MOD Set 3.1: A 82 SER OG : rot 76:sc= 1.58 USER MOD Set 3.2: A 95 GLN : amide:sc= 0.339 K(o=1.9,f=1) USER MOD Set 4.1: A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 63 SER OG : rot 28:sc= 0.765 USER MOD Set 5.1: A 36 THR OG1 : rot 116:sc= 1.07 USER MOD Set 5.2: A 55 SER OG : rot 75:sc= 1.07 USER MOD Set 6.1: A 11 THR OG1 : rot -27:sc= 1.22 USER MOD Set 6.2: A 112 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.3) USER MOD Single : A 1 VAL N :NH3+ -166:sc= -0.0023 (180deg=-0.269) USER MOD Single : A 5 CYS SG : rot 27:sc= 0.00372 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 36:sc= 0.873 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 15 ASN : amide:sc= 0.571 K(o=0.57,f=-0.86) USER MOD Single : A 20 MET CE :methyl 178:sc= -0.167 (180deg=-0.189) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -116:sc= 1.28 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 1.08 K(o=1.1,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ 175:sc= 0.617 (180deg=0.613) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -16:sc= 1.24 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -47:sc= 0.876 USER MOD Single : A 58 LYS NZ :NH3+ 163:sc= 0.0477 (180deg=-0.0225) USER MOD Single : A 59 ASN : amide:sc= 0.518 K(o=0.52,f=-6.9!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -74:sc= 0.568 USER MOD Single : A 79 ASN : amide:sc= -0.683 K(o=-0.68,f=-4!) USER MOD Single : A 80 CYS SG : rot -108:sc= 0.5 USER MOD Single : A 81 LYS NZ :NH3+ 173:sc= 0.431 (180deg=0.41) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HD1:sc= -0.11 K(o=-0.11,f=-0.67) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl -171:sc= 0 (180deg=-0.156) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 LYS NZ :NH3+ -126:sc= 0.105 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 0.462 -1.930 -3.028 1.00 0.00 N ATOM 2 CA VAL A 1 1.098 -0.700 -3.594 1.00 0.00 C ATOM 3 C VAL A 1 0.314 0.563 -3.094 1.00 0.00 C ATOM 4 O VAL A 1 -0.356 1.253 -3.866 1.00 0.00 O ATOM 5 CB VAL A 1 1.252 -0.852 -5.152 1.00 0.00 C ATOM 6 CG1 VAL A 1 1.861 0.380 -5.855 1.00 0.00 C ATOM 7 CG2 VAL A 1 2.125 -2.057 -5.581 1.00 0.00 C ATOM 0 H1 VAL A 1 1.101 -2.741 -3.154 1.00 0.00 H new ATOM 0 H2 VAL A 1 0.276 -1.790 -2.014 1.00 0.00 H new ATOM 0 H3 VAL A 1 -0.434 -2.116 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 1 2.117 -0.560 -3.233 1.00 0.00 H new ATOM 0 HB VAL A 1 0.217 -0.992 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 1 1.931 0.190 -6.926 1.00 0.00 H new ATOM 0 HG12 VAL A 1 1.226 1.249 -5.682 1.00 0.00 H new ATOM 0 HG13 VAL A 1 2.856 0.572 -5.454 1.00 0.00 H new ATOM 0 HG21 VAL A 1 2.184 -2.095 -6.669 1.00 0.00 H new ATOM 0 HG22 VAL A 1 3.127 -1.946 -5.167 1.00 0.00 H new ATOM 0 HG23 VAL A 1 1.679 -2.980 -5.209 1.00 0.00 H new ATOM 18 N GLU A 2 0.418 0.881 -1.788 1.00 0.00 N ATOM 19 CA GLU A 2 -0.351 1.995 -1.158 1.00 0.00 C ATOM 20 C GLU A 2 0.471 3.316 -1.039 1.00 0.00 C ATOM 21 O GLU A 2 0.069 4.321 -1.630 1.00 0.00 O ATOM 22 CB GLU A 2 -0.958 1.461 0.169 1.00 0.00 C ATOM 23 CG GLU A 2 -1.977 2.416 0.835 1.00 0.00 C ATOM 24 CD GLU A 2 -2.585 1.864 2.122 1.00 0.00 C ATOM 25 OE1 GLU A 2 -2.127 2.092 3.238 1.00 0.00 O ATOM 26 OE2 GLU A 2 -3.688 1.094 1.881 1.00 0.00 O ATOM 0 H GLU A 2 1.028 0.384 -1.139 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.175 2.303 -1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -1.447 0.507 -0.027 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -0.148 1.265 0.872 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -1.484 3.363 1.054 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.778 2.629 0.127 1.00 0.00 H new ATOM 34 N ALA A 3 1.629 3.326 -0.344 1.00 0.00 N ATOM 35 CA ALA A 3 2.555 4.498 -0.331 1.00 0.00 C ATOM 36 C ALA A 3 3.109 5.023 -1.706 1.00 0.00 C ATOM 37 O ALA A 3 3.480 6.196 -1.801 1.00 0.00 O ATOM 38 CB ALA A 3 3.696 4.137 0.638 1.00 0.00 C ATOM 0 H ALA A 3 1.952 2.539 0.218 1.00 0.00 H new ATOM 0 HA ALA A 3 1.962 5.356 -0.013 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.406 4.962 0.687 1.00 0.00 H new ATOM 0 HB2 ALA A 3 3.286 3.952 1.631 1.00 0.00 H new ATOM 0 HB3 ALA A 3 4.205 3.241 0.283 1.00 0.00 H new ATOM 44 N PHE A 4 3.124 4.186 -2.761 1.00 0.00 N ATOM 45 CA PHE A 4 3.380 4.641 -4.159 1.00 0.00 C ATOM 46 C PHE A 4 2.143 5.223 -4.930 1.00 0.00 C ATOM 47 O PHE A 4 2.379 5.895 -5.932 1.00 0.00 O ATOM 48 CB PHE A 4 3.996 3.481 -4.997 1.00 0.00 C ATOM 49 CG PHE A 4 5.353 2.913 -4.551 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.544 3.578 -4.867 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.405 1.725 -3.813 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.759 3.096 -4.390 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.622 1.242 -3.344 1.00 0.00 C ATOM 54 CZ PHE A 4 7.794 1.935 -3.623 1.00 0.00 C ATOM 0 H PHE A 4 2.962 3.182 -2.680 1.00 0.00 H new ATOM 0 HA PHE A 4 4.073 5.475 -4.046 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.278 2.661 -5.011 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.101 3.830 -6.024 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.520 4.466 -5.481 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.495 1.181 -3.607 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.675 3.623 -4.615 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.656 0.331 -2.765 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.737 1.571 -3.243 1.00 0.00 H new ATOM 64 N CYS A 5 0.866 4.969 -4.560 1.00 0.00 N ATOM 65 CA CYS A 5 -0.314 5.387 -5.371 1.00 0.00 C ATOM 66 C CYS A 5 -0.600 6.928 -5.314 1.00 0.00 C ATOM 67 O CYS A 5 -1.210 7.435 -4.368 1.00 0.00 O ATOM 68 CB CYS A 5 -1.501 4.514 -4.913 1.00 0.00 C ATOM 69 SG CYS A 5 -2.955 4.794 -5.982 1.00 0.00 S ATOM 0 H CYS A 5 0.620 4.475 -3.702 1.00 0.00 H new ATOM 0 HA CYS A 5 -0.120 5.222 -6.431 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.218 3.462 -4.943 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -1.753 4.747 -3.879 1.00 0.00 H new ATOM 0 HG CYS A 5 -2.560 5.176 -7.160 1.00 0.00 H new ATOM 75 N ALA A 6 -0.102 7.663 -6.326 1.00 0.00 N ATOM 76 CA ALA A 6 -0.037 9.156 -6.342 1.00 0.00 C ATOM 77 C ALA A 6 0.480 9.694 -7.724 1.00 0.00 C ATOM 78 O ALA A 6 0.963 8.945 -8.586 1.00 0.00 O ATOM 79 CB ALA A 6 0.858 9.670 -5.180 1.00 0.00 C ATOM 0 H ALA A 6 0.275 7.240 -7.174 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.048 9.538 -6.199 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.896 10.759 -5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.441 9.343 -4.228 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.865 9.269 -5.292 1.00 0.00 H new ATOM 85 N THR A 7 0.407 11.024 -7.928 1.00 0.00 N ATOM 86 CA THR A 7 1.184 11.718 -9.000 1.00 0.00 C ATOM 87 C THR A 7 2.635 12.040 -8.490 1.00 0.00 C ATOM 88 O THR A 7 2.851 12.359 -7.317 1.00 0.00 O ATOM 89 CB THR A 7 0.364 12.960 -9.467 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.898 12.536 -9.974 1.00 0.00 O ATOM 91 CG2 THR A 7 1.005 13.781 -10.593 1.00 0.00 C ATOM 0 H THR A 7 -0.178 11.647 -7.371 1.00 0.00 H new ATOM 0 HA THR A 7 1.328 11.085 -9.875 1.00 0.00 H new ATOM 0 HB THR A 7 0.299 13.588 -8.578 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.413 13.317 -10.265 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.358 14.621 -10.845 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.974 14.156 -10.264 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.139 13.150 -11.472 1.00 0.00 H new ATOM 99 N TRP A 8 3.648 11.907 -9.363 1.00 0.00 N ATOM 100 CA TRP A 8 5.079 11.981 -8.948 1.00 0.00 C ATOM 101 C TRP A 8 5.889 12.901 -9.911 1.00 0.00 C ATOM 102 O TRP A 8 5.990 12.653 -11.117 1.00 0.00 O ATOM 103 CB TRP A 8 5.671 10.548 -8.892 1.00 0.00 C ATOM 104 CG TRP A 8 5.204 9.697 -7.710 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.256 8.661 -7.790 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.561 9.777 -6.375 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.030 8.069 -6.539 1.00 0.00 N ATOM 108 CE2 TRP A 8 4.842 8.776 -5.676 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.432 10.654 -5.678 1.00 0.00 C ATOM 110 CZ2 TRP A 8 4.989 8.639 -4.279 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.563 10.498 -4.297 1.00 0.00 C ATOM 112 CH2 TRP A 8 5.848 9.509 -3.607 1.00 0.00 C ATOM 0 H TRP A 8 3.513 11.748 -10.361 1.00 0.00 H new ATOM 0 HA TRP A 8 5.146 12.424 -7.954 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.415 10.030 -9.816 1.00 0.00 H new ATOM 0 HB3 TRP A 8 6.758 10.622 -8.859 1.00 0.00 H new ATOM 0 HD1 TRP A 8 3.763 8.359 -8.702 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.407 7.292 -6.317 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.980 11.423 -6.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.447 7.876 -3.741 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.227 11.151 -3.750 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.964 9.419 -2.537 1.00 0.00 H new ATOM 123 N LYS A 9 6.488 13.960 -9.350 1.00 0.00 N ATOM 124 CA LYS A 9 7.101 15.072 -10.127 1.00 0.00 C ATOM 125 C LYS A 9 8.655 14.993 -10.026 1.00 0.00 C ATOM 126 O LYS A 9 9.217 15.098 -8.929 1.00 0.00 O ATOM 127 CB LYS A 9 6.555 16.406 -9.541 1.00 0.00 C ATOM 128 CG LYS A 9 5.041 16.672 -9.764 1.00 0.00 C ATOM 129 CD LYS A 9 4.457 17.803 -8.891 1.00 0.00 C ATOM 130 CE LYS A 9 4.948 19.212 -9.264 1.00 0.00 C ATOM 131 NZ LYS A 9 4.310 20.207 -8.381 1.00 0.00 N ATOM 0 H LYS A 9 6.567 14.080 -8.340 1.00 0.00 H new ATOM 0 HA LYS A 9 6.844 15.006 -11.184 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.753 16.418 -8.469 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.118 17.231 -9.978 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.879 16.919 -10.813 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.490 15.753 -9.564 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.370 17.779 -8.966 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.709 17.608 -7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.032 19.268 -9.168 1.00 0.00 H new ATOM 0 HE3 LYS A 9 4.709 19.428 -10.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 4.643 21.159 -8.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.277 20.160 -8.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.560 20.004 -7.392 1.00 0.00 H new ATOM 144 N LEU A 10 9.359 14.802 -11.161 1.00 0.00 N ATOM 145 CA LEU A 10 10.837 14.580 -11.161 1.00 0.00 C ATOM 146 C LEU A 10 11.646 15.868 -10.782 1.00 0.00 C ATOM 147 O LEU A 10 11.633 16.873 -11.497 1.00 0.00 O ATOM 148 CB LEU A 10 11.273 13.986 -12.534 1.00 0.00 C ATOM 149 CG LEU A 10 12.512 13.043 -12.533 1.00 0.00 C ATOM 150 CD1 LEU A 10 12.733 12.489 -13.945 1.00 0.00 C ATOM 151 CD2 LEU A 10 13.830 13.687 -12.077 1.00 0.00 C ATOM 0 H LEU A 10 8.938 14.795 -12.090 1.00 0.00 H new ATOM 0 HA LEU A 10 11.073 13.859 -10.378 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.428 13.436 -12.949 1.00 0.00 H new ATOM 0 HB3 LEU A 10 11.478 14.814 -13.212 1.00 0.00 H new ATOM 0 HG LEU A 10 12.271 12.269 -11.804 1.00 0.00 H new ATOM 0 HD11 LEU A 10 13.600 11.829 -13.945 1.00 0.00 H new ATOM 0 HD12 LEU A 10 11.851 11.930 -14.259 1.00 0.00 H new ATOM 0 HD13 LEU A 10 12.905 13.314 -14.637 1.00 0.00 H new ATOM 0 HD21 LEU A 10 14.629 12.946 -12.113 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.076 14.518 -12.737 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.722 14.054 -11.056 1.00 0.00 H new ATOM 163 N THR A 11 12.357 15.805 -9.648 1.00 0.00 N ATOM 164 CA THR A 11 13.201 16.924 -9.125 1.00 0.00 C ATOM 165 C THR A 11 14.684 16.902 -9.623 1.00 0.00 C ATOM 166 O THR A 11 15.201 17.935 -10.052 1.00 0.00 O ATOM 167 CB THR A 11 13.130 16.997 -7.564 1.00 0.00 C ATOM 168 OG1 THR A 11 13.670 15.830 -6.944 1.00 0.00 O ATOM 169 CG2 THR A 11 11.727 17.215 -6.978 1.00 0.00 C ATOM 0 H THR A 11 12.373 14.977 -9.053 1.00 0.00 H new ATOM 0 HA THR A 11 12.771 17.833 -9.544 1.00 0.00 H new ATOM 0 HB THR A 11 13.729 17.880 -7.341 1.00 0.00 H new ATOM 0 HG1 THR A 11 13.575 15.065 -7.549 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.788 17.250 -5.890 1.00 0.00 H new ATOM 0 HG22 THR A 11 11.320 18.155 -7.349 1.00 0.00 H new ATOM 0 HG23 THR A 11 11.076 16.394 -7.278 1.00 0.00 H new ATOM 177 N ASN A 12 15.373 15.749 -9.526 1.00 0.00 N ATOM 178 CA ASN A 12 16.818 15.615 -9.853 1.00 0.00 C ATOM 179 C ASN A 12 17.069 14.256 -10.579 1.00 0.00 C ATOM 180 O ASN A 12 16.680 13.194 -10.080 1.00 0.00 O ATOM 181 CB ASN A 12 17.625 15.750 -8.529 1.00 0.00 C ATOM 182 CG ASN A 12 19.150 15.732 -8.694 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.725 16.468 -9.487 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.858 14.894 -7.974 1.00 0.00 N ATOM 0 H ASN A 12 14.946 14.875 -9.217 1.00 0.00 H new ATOM 0 HA ASN A 12 17.148 16.398 -10.536 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.339 16.681 -8.040 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.337 14.938 -7.861 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.872 14.862 -8.079 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.394 14.275 -7.309 1.00 0.00 H new ATOM 191 N SER A 13 17.760 14.291 -11.730 1.00 0.00 N ATOM 192 CA SER A 13 18.252 13.068 -12.419 1.00 0.00 C ATOM 193 C SER A 13 19.797 12.925 -12.247 1.00 0.00 C ATOM 194 O SER A 13 20.578 13.471 -13.035 1.00 0.00 O ATOM 195 CB SER A 13 17.811 13.114 -13.902 1.00 0.00 C ATOM 196 OG SER A 13 18.517 14.116 -14.637 1.00 0.00 O ATOM 0 H SER A 13 17.997 15.158 -12.213 1.00 0.00 H new ATOM 0 HA SER A 13 17.814 12.177 -11.968 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.980 12.140 -14.361 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.740 13.311 -13.956 1.00 0.00 H new ATOM 0 HG SER A 13 19.438 14.175 -14.308 1.00 0.00 H new ATOM 202 N GLN A 14 20.223 12.172 -11.222 1.00 0.00 N ATOM 203 CA GLN A 14 21.658 11.876 -10.954 1.00 0.00 C ATOM 204 C GLN A 14 22.254 10.878 -11.995 1.00 0.00 C ATOM 205 O GLN A 14 21.722 9.780 -12.169 1.00 0.00 O ATOM 206 CB GLN A 14 21.715 11.303 -9.509 1.00 0.00 C ATOM 207 CG GLN A 14 23.086 10.803 -8.981 1.00 0.00 C ATOM 208 CD GLN A 14 24.151 11.888 -8.826 1.00 0.00 C ATOM 209 OE1 GLN A 14 24.785 12.324 -9.781 1.00 0.00 O ATOM 210 NE2 GLN A 14 24.366 12.349 -7.620 1.00 0.00 N ATOM 0 H GLN A 14 19.588 11.745 -10.547 1.00 0.00 H new ATOM 0 HA GLN A 14 22.265 12.777 -11.045 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.356 12.075 -8.828 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.011 10.473 -9.450 1.00 0.00 H new ATOM 0 HG2 GLN A 14 22.933 10.323 -8.014 1.00 0.00 H new ATOM 0 HG3 GLN A 14 23.463 10.038 -9.660 1.00 0.00 H new ATOM 0 HE21 GLN A 14 23.834 11.981 -6.831 1.00 0.00 H new ATOM 0 HE22 GLN A 14 25.065 13.076 -7.469 1.00 0.00 H new ATOM 219 N ASN A 15 23.357 11.256 -12.668 1.00 0.00 N ATOM 220 CA ASN A 15 24.084 10.382 -13.650 1.00 0.00 C ATOM 221 C ASN A 15 23.262 9.706 -14.819 1.00 0.00 C ATOM 222 O ASN A 15 23.653 8.667 -15.361 1.00 0.00 O ATOM 223 CB ASN A 15 25.015 9.425 -12.837 1.00 0.00 C ATOM 224 CG ASN A 15 26.200 8.819 -13.595 1.00 0.00 C ATOM 225 OD1 ASN A 15 26.264 7.624 -13.861 1.00 0.00 O ATOM 226 ND2 ASN A 15 27.175 9.614 -13.970 1.00 0.00 N ATOM 0 H ASN A 15 23.782 12.176 -12.556 1.00 0.00 H new ATOM 0 HA ASN A 15 24.676 11.046 -14.280 1.00 0.00 H new ATOM 0 HB2 ASN A 15 25.403 9.974 -11.979 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.407 8.609 -12.445 1.00 0.00 H new ATOM 0 HD21 ASN A 15 27.975 9.236 -14.477 1.00 0.00 H new ATOM 0 HD22 ASN A 15 27.133 10.610 -13.754 1.00 0.00 H new ATOM 233 N PHE A 16 22.150 10.329 -15.255 1.00 0.00 N ATOM 234 CA PHE A 16 21.223 9.734 -16.259 1.00 0.00 C ATOM 235 C PHE A 16 21.785 9.648 -17.717 1.00 0.00 C ATOM 236 O PHE A 16 21.675 8.586 -18.329 1.00 0.00 O ATOM 237 CB PHE A 16 19.847 10.440 -16.092 1.00 0.00 C ATOM 238 CG PHE A 16 18.669 9.885 -16.918 1.00 0.00 C ATOM 239 CD1 PHE A 16 18.352 8.519 -16.908 1.00 0.00 C ATOM 240 CD2 PHE A 16 17.898 10.758 -17.694 1.00 0.00 C ATOM 241 CE1 PHE A 16 17.317 8.030 -17.702 1.00 0.00 C ATOM 242 CE2 PHE A 16 16.850 10.270 -18.470 1.00 0.00 C ATOM 243 CZ PHE A 16 16.571 8.906 -18.486 1.00 0.00 C ATOM 0 H PHE A 16 21.863 11.252 -14.929 1.00 0.00 H new ATOM 0 HA PHE A 16 21.094 8.670 -16.058 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.571 10.398 -15.038 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.973 11.492 -16.347 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.913 7.842 -16.281 1.00 0.00 H new ATOM 0 HD2 PHE A 16 18.117 11.816 -17.691 1.00 0.00 H new ATOM 0 HE1 PHE A 16 17.094 6.973 -17.709 1.00 0.00 H new ATOM 0 HE2 PHE A 16 16.253 10.950 -19.060 1.00 0.00 H new ATOM 0 HZ PHE A 16 15.774 8.527 -19.108 1.00 0.00 H new ATOM 253 N ASP A 17 22.444 10.697 -18.244 1.00 0.00 N ATOM 254 CA ASP A 17 23.231 10.631 -19.514 1.00 0.00 C ATOM 255 C ASP A 17 24.257 9.450 -19.660 1.00 0.00 C ATOM 256 O ASP A 17 24.254 8.761 -20.683 1.00 0.00 O ATOM 257 CB ASP A 17 23.929 12.008 -19.682 1.00 0.00 C ATOM 258 CG ASP A 17 24.271 12.348 -21.134 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.416 12.503 -22.002 1.00 0.00 O ATOM 260 OD2 ASP A 17 25.617 12.440 -21.351 1.00 0.00 O ATOM 0 H ASP A 17 22.453 11.620 -17.810 1.00 0.00 H new ATOM 0 HA ASP A 17 22.522 10.410 -20.312 1.00 0.00 H new ATOM 0 HB2 ASP A 17 23.281 12.786 -19.278 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.844 12.017 -19.090 1.00 0.00 H new ATOM 266 N GLU A 18 25.103 9.217 -18.639 1.00 0.00 N ATOM 267 CA GLU A 18 25.989 8.011 -18.567 1.00 0.00 C ATOM 268 C GLU A 18 25.248 6.630 -18.571 1.00 0.00 C ATOM 269 O GLU A 18 25.579 5.768 -19.391 1.00 0.00 O ATOM 270 CB GLU A 18 26.910 8.161 -17.329 1.00 0.00 C ATOM 271 CG GLU A 18 28.131 7.204 -17.297 1.00 0.00 C ATOM 272 CD GLU A 18 28.887 7.235 -15.969 1.00 0.00 C ATOM 273 OE1 GLU A 18 29.375 8.251 -15.483 1.00 0.00 O ATOM 274 OE2 GLU A 18 28.942 6.012 -15.372 1.00 0.00 O ATOM 0 H GLU A 18 25.201 9.845 -17.841 1.00 0.00 H new ATOM 0 HA GLU A 18 26.569 7.986 -19.490 1.00 0.00 H new ATOM 0 HB2 GLU A 18 27.272 9.188 -17.287 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.315 7.996 -16.431 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.792 6.186 -17.491 1.00 0.00 H new ATOM 0 HG3 GLU A 18 28.815 7.471 -18.103 1.00 0.00 H new ATOM 282 N TYR A 19 24.229 6.441 -17.706 1.00 0.00 N ATOM 283 CA TYR A 19 23.247 5.322 -17.830 1.00 0.00 C ATOM 284 C TYR A 19 22.616 5.149 -19.255 1.00 0.00 C ATOM 285 O TYR A 19 22.629 4.043 -19.790 1.00 0.00 O ATOM 286 CB TYR A 19 22.215 5.488 -16.674 1.00 0.00 C ATOM 287 CG TYR A 19 21.025 4.509 -16.680 1.00 0.00 C ATOM 288 CD1 TYR A 19 21.146 3.227 -16.141 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.831 4.880 -17.314 1.00 0.00 C ATOM 290 CE1 TYR A 19 20.093 2.320 -16.249 1.00 0.00 C ATOM 291 CE2 TYR A 19 18.784 3.970 -17.423 1.00 0.00 C ATOM 292 CZ TYR A 19 18.918 2.689 -16.899 1.00 0.00 C ATOM 293 OH TYR A 19 17.874 1.803 -16.977 1.00 0.00 O ATOM 0 H TYR A 19 24.057 7.049 -16.906 1.00 0.00 H new ATOM 0 HA TYR A 19 23.767 4.370 -17.723 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.742 5.381 -15.726 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.823 6.504 -16.708 1.00 0.00 H new ATOM 0 HD1 TYR A 19 22.057 2.937 -15.639 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.723 5.875 -17.719 1.00 0.00 H new ATOM 0 HE1 TYR A 19 20.189 1.330 -15.828 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.867 4.259 -17.915 1.00 0.00 H new ATOM 0 HH TYR A 19 17.129 2.217 -17.462 1.00 0.00 H new ATOM 303 N MET A 20 22.108 6.227 -19.868 1.00 0.00 N ATOM 304 CA MET A 20 21.579 6.217 -21.260 1.00 0.00 C ATOM 305 C MET A 20 22.602 5.813 -22.370 1.00 0.00 C ATOM 306 O MET A 20 22.278 4.955 -23.198 1.00 0.00 O ATOM 307 CB MET A 20 20.929 7.602 -21.515 1.00 0.00 C ATOM 308 CG MET A 20 19.612 7.851 -20.755 1.00 0.00 C ATOM 309 SD MET A 20 19.130 9.575 -20.952 1.00 0.00 S ATOM 310 CE MET A 20 17.682 9.366 -21.990 1.00 0.00 C ATOM 0 H MET A 20 22.047 7.141 -19.419 1.00 0.00 H new ATOM 0 HA MET A 20 20.842 5.417 -21.335 1.00 0.00 H new ATOM 0 HB2 MET A 20 21.643 8.378 -21.239 1.00 0.00 H new ATOM 0 HB3 MET A 20 20.740 7.707 -22.583 1.00 0.00 H new ATOM 0 HG2 MET A 20 18.829 7.196 -21.137 1.00 0.00 H new ATOM 0 HG3 MET A 20 19.738 7.615 -19.698 1.00 0.00 H new ATOM 0 HE1 MET A 20 17.230 10.339 -22.184 1.00 0.00 H new ATOM 0 HE2 MET A 20 17.974 8.907 -22.934 1.00 0.00 H new ATOM 0 HE3 MET A 20 16.960 8.725 -21.483 1.00 0.00 H new ATOM 320 N LYS A 21 23.835 6.357 -22.371 1.00 0.00 N ATOM 321 CA LYS A 21 24.947 5.830 -23.221 1.00 0.00 C ATOM 322 C LYS A 21 25.279 4.306 -23.038 1.00 0.00 C ATOM 323 O LYS A 21 25.373 3.589 -24.037 1.00 0.00 O ATOM 324 CB LYS A 21 26.220 6.704 -23.056 1.00 0.00 C ATOM 325 CG LYS A 21 26.119 8.158 -23.590 1.00 0.00 C ATOM 326 CD LYS A 21 27.430 8.685 -24.211 1.00 0.00 C ATOM 327 CE LYS A 21 27.671 8.138 -25.630 1.00 0.00 C ATOM 328 NZ LYS A 21 28.923 8.682 -26.189 1.00 0.00 N ATOM 0 H LYS A 21 24.096 7.159 -21.798 1.00 0.00 H new ATOM 0 HA LYS A 21 24.575 5.901 -24.243 1.00 0.00 H new ATOM 0 HB2 LYS A 21 26.475 6.744 -21.997 1.00 0.00 H new ATOM 0 HB3 LYS A 21 27.046 6.207 -23.565 1.00 0.00 H new ATOM 0 HG2 LYS A 21 25.328 8.206 -24.338 1.00 0.00 H new ATOM 0 HG3 LYS A 21 25.825 8.816 -22.772 1.00 0.00 H new ATOM 0 HD2 LYS A 21 27.400 9.774 -24.245 1.00 0.00 H new ATOM 0 HD3 LYS A 21 28.268 8.409 -23.571 1.00 0.00 H new ATOM 0 HE2 LYS A 21 27.721 7.049 -25.603 1.00 0.00 H new ATOM 0 HE3 LYS A 21 26.833 8.402 -26.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 29.070 8.303 -27.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 28.861 9.719 -26.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 29.722 8.408 -25.582 1.00 0.00 H new ATOM 341 N ALA A 22 25.397 3.806 -21.793 1.00 0.00 N ATOM 342 CA ALA A 22 25.495 2.344 -21.515 1.00 0.00 C ATOM 343 C ALA A 22 24.255 1.459 -21.898 1.00 0.00 C ATOM 344 O ALA A 22 24.428 0.341 -22.388 1.00 0.00 O ATOM 345 CB ALA A 22 25.858 2.227 -20.023 1.00 0.00 C ATOM 0 H ALA A 22 25.428 4.388 -20.956 1.00 0.00 H new ATOM 0 HA ALA A 22 26.255 1.926 -22.176 1.00 0.00 H new ATOM 0 HB1 ALA A 22 25.946 1.175 -19.751 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.807 2.730 -19.839 1.00 0.00 H new ATOM 0 HB3 ALA A 22 25.078 2.693 -19.421 1.00 0.00 H new ATOM 351 N LEU A 23 23.021 1.963 -21.717 1.00 0.00 N ATOM 352 CA LEU A 23 21.760 1.282 -22.132 1.00 0.00 C ATOM 353 C LEU A 23 21.514 1.124 -23.678 1.00 0.00 C ATOM 354 O LEU A 23 20.700 0.287 -24.083 1.00 0.00 O ATOM 355 CB LEU A 23 20.631 2.122 -21.453 1.00 0.00 C ATOM 356 CG LEU A 23 19.208 1.513 -21.408 1.00 0.00 C ATOM 357 CD1 LEU A 23 19.114 0.395 -20.366 1.00 0.00 C ATOM 358 CD2 LEU A 23 18.164 2.589 -21.066 1.00 0.00 C ATOM 0 H LEU A 23 22.859 2.867 -21.273 1.00 0.00 H new ATOM 0 HA LEU A 23 21.799 0.239 -21.817 1.00 0.00 H new ATOM 0 HB2 LEU A 23 20.939 2.331 -20.428 1.00 0.00 H new ATOM 0 HB3 LEU A 23 20.569 3.080 -21.969 1.00 0.00 H new ATOM 0 HG LEU A 23 19.006 1.102 -22.397 1.00 0.00 H new ATOM 0 HD11 LEU A 23 18.103 -0.012 -20.359 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.821 -0.396 -20.616 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.351 0.796 -19.380 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.172 2.138 -21.040 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.392 3.021 -20.091 1.00 0.00 H new ATOM 0 HD23 LEU A 23 18.187 3.372 -21.824 1.00 0.00 H new ATOM 370 N GLY A 24 22.157 1.947 -24.530 1.00 0.00 N ATOM 371 CA GLY A 24 21.903 1.970 -25.990 1.00 0.00 C ATOM 372 C GLY A 24 20.785 2.944 -26.399 1.00 0.00 C ATOM 373 O GLY A 24 19.699 2.505 -26.788 1.00 0.00 O ATOM 0 H GLY A 24 22.867 2.615 -24.229 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.822 2.245 -26.507 1.00 0.00 H new ATOM 0 HA3 GLY A 24 21.639 0.966 -26.322 1.00 0.00 H new ATOM 377 N VAL A 25 21.052 4.255 -26.295 1.00 0.00 N ATOM 378 CA VAL A 25 20.130 5.317 -26.810 1.00 0.00 C ATOM 379 C VAL A 25 20.540 5.836 -28.231 1.00 0.00 C ATOM 380 O VAL A 25 21.721 6.077 -28.503 1.00 0.00 O ATOM 381 CB VAL A 25 19.949 6.509 -25.807 1.00 0.00 C ATOM 382 CG1 VAL A 25 19.276 6.093 -24.481 1.00 0.00 C ATOM 383 CG2 VAL A 25 21.236 7.315 -25.511 1.00 0.00 C ATOM 0 H VAL A 25 21.899 4.621 -25.859 1.00 0.00 H new ATOM 0 HA VAL A 25 19.160 4.830 -26.908 1.00 0.00 H new ATOM 0 HB VAL A 25 19.277 7.177 -26.346 1.00 0.00 H new ATOM 0 HG11 VAL A 25 19.181 6.964 -23.832 1.00 0.00 H new ATOM 0 HG12 VAL A 25 18.287 5.684 -24.688 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.885 5.337 -23.986 1.00 0.00 H new ATOM 0 HG21 VAL A 25 21.010 8.117 -24.808 1.00 0.00 H new ATOM 0 HG22 VAL A 25 21.988 6.655 -25.078 1.00 0.00 H new ATOM 0 HG23 VAL A 25 21.619 7.742 -26.438 1.00 0.00 H new ATOM 393 N GLY A 26 19.555 6.115 -29.109 1.00 0.00 N ATOM 394 CA GLY A 26 19.827 6.762 -30.430 1.00 0.00 C ATOM 395 C GLY A 26 19.915 8.304 -30.474 1.00 0.00 C ATOM 396 O GLY A 26 19.314 8.915 -31.358 1.00 0.00 O ATOM 0 H GLY A 26 18.571 5.909 -28.939 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.767 6.362 -30.811 1.00 0.00 H new ATOM 0 HA3 GLY A 26 19.044 6.452 -31.122 1.00 0.00 H new ATOM 400 N PHE A 27 20.687 8.917 -29.555 1.00 0.00 N ATOM 401 CA PHE A 27 20.931 10.392 -29.471 1.00 0.00 C ATOM 402 C PHE A 27 19.695 11.334 -29.246 1.00 0.00 C ATOM 403 O PHE A 27 19.679 12.088 -28.270 1.00 0.00 O ATOM 404 CB PHE A 27 21.931 10.868 -30.566 1.00 0.00 C ATOM 405 CG PHE A 27 22.630 12.205 -30.249 1.00 0.00 C ATOM 406 CD1 PHE A 27 23.723 12.238 -29.374 1.00 0.00 C ATOM 407 CD2 PHE A 27 22.159 13.400 -30.803 1.00 0.00 C ATOM 408 CE1 PHE A 27 24.329 13.451 -29.054 1.00 0.00 C ATOM 409 CE2 PHE A 27 22.771 14.610 -30.486 1.00 0.00 C ATOM 410 CZ PHE A 27 23.853 14.635 -29.609 1.00 0.00 C ATOM 0 H PHE A 27 21.176 8.397 -28.827 1.00 0.00 H new ATOM 0 HA PHE A 27 21.415 10.517 -28.503 1.00 0.00 H new ATOM 0 HB2 PHE A 27 22.690 10.099 -30.707 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.397 10.966 -31.511 1.00 0.00 H new ATOM 0 HD1 PHE A 27 24.097 11.320 -28.946 1.00 0.00 H new ATOM 0 HD2 PHE A 27 21.317 13.384 -31.479 1.00 0.00 H new ATOM 0 HE1 PHE A 27 25.169 13.472 -28.375 1.00 0.00 H new ATOM 0 HE2 PHE A 27 22.407 15.529 -30.920 1.00 0.00 H new ATOM 0 HZ PHE A 27 24.323 15.575 -29.359 1.00 0.00 H new ATOM 420 N ALA A 28 18.666 11.298 -30.106 1.00 0.00 N ATOM 421 CA ALA A 28 17.394 12.053 -29.894 1.00 0.00 C ATOM 422 C ALA A 28 16.681 11.855 -28.511 1.00 0.00 C ATOM 423 O ALA A 28 16.302 12.840 -27.871 1.00 0.00 O ATOM 424 CB ALA A 28 16.472 11.722 -31.082 1.00 0.00 C ATOM 0 H ALA A 28 18.679 10.752 -30.967 1.00 0.00 H new ATOM 0 HA ALA A 28 17.647 13.112 -29.854 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.527 12.254 -30.969 1.00 0.00 H new ATOM 0 HB2 ALA A 28 16.952 12.029 -32.011 1.00 0.00 H new ATOM 0 HB3 ALA A 28 16.283 10.649 -31.108 1.00 0.00 H new ATOM 430 N THR A 29 16.579 10.607 -28.015 1.00 0.00 N ATOM 431 CA THR A 29 16.050 10.301 -26.656 1.00 0.00 C ATOM 432 C THR A 29 16.939 10.811 -25.465 1.00 0.00 C ATOM 433 O THR A 29 16.360 11.239 -24.468 1.00 0.00 O ATOM 434 CB THR A 29 15.725 8.778 -26.590 1.00 0.00 C ATOM 435 OG1 THR A 29 14.899 8.388 -27.687 1.00 0.00 O ATOM 436 CG2 THR A 29 14.976 8.344 -25.318 1.00 0.00 C ATOM 0 H THR A 29 16.859 9.777 -28.539 1.00 0.00 H new ATOM 0 HA THR A 29 15.135 10.876 -26.512 1.00 0.00 H new ATOM 0 HB THR A 29 16.703 8.297 -26.608 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.030 8.084 -27.350 1.00 0.00 H new ATOM 0 HG21 THR A 29 14.790 7.271 -25.354 1.00 0.00 H new ATOM 0 HG22 THR A 29 15.581 8.579 -24.442 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.026 8.875 -25.256 1.00 0.00 H new ATOM 444 N ARG A 30 18.293 10.824 -25.537 1.00 0.00 N ATOM 445 CA ARG A 30 19.133 11.618 -24.577 1.00 0.00 C ATOM 446 C ARG A 30 18.999 13.174 -24.662 1.00 0.00 C ATOM 447 O ARG A 30 18.942 13.825 -23.615 1.00 0.00 O ATOM 448 CB ARG A 30 20.619 11.161 -24.513 1.00 0.00 C ATOM 449 CG ARG A 30 21.452 11.159 -25.813 1.00 0.00 C ATOM 450 CD ARG A 30 22.980 11.123 -25.604 1.00 0.00 C ATOM 451 NE ARG A 30 23.495 12.514 -25.451 1.00 0.00 N ATOM 452 CZ ARG A 30 24.696 12.853 -24.989 1.00 0.00 C ATOM 453 NH1 ARG A 30 25.587 11.987 -24.582 1.00 0.00 N ATOM 454 NH2 ARG A 30 24.999 14.117 -24.937 1.00 0.00 N ATOM 0 H ARG A 30 18.829 10.306 -26.234 1.00 0.00 H new ATOM 0 HA ARG A 30 18.678 11.364 -23.620 1.00 0.00 H new ATOM 0 HB2 ARG A 30 21.131 11.801 -23.794 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.636 10.149 -24.108 1.00 0.00 H new ATOM 0 HG2 ARG A 30 21.161 10.296 -26.412 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.200 12.048 -26.391 1.00 0.00 H new ATOM 0 HD2 ARG A 30 23.223 10.535 -24.719 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.462 10.637 -26.452 1.00 0.00 H new ATOM 0 HE ARG A 30 22.871 13.273 -25.725 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.378 10.989 -24.609 1.00 0.00 H new ATOM 0 HH12 ARG A 30 26.491 12.309 -24.238 1.00 0.00 H new ATOM 0 HH21 ARG A 30 24.324 14.816 -25.246 1.00 0.00 H new ATOM 0 HH22 ARG A 30 25.912 14.409 -24.588 1.00 0.00 H new ATOM 468 N GLN A 31 18.919 13.780 -25.860 1.00 0.00 N ATOM 469 CA GLN A 31 18.562 15.226 -26.009 1.00 0.00 C ATOM 470 C GLN A 31 17.155 15.631 -25.447 1.00 0.00 C ATOM 471 O GLN A 31 17.064 16.631 -24.734 1.00 0.00 O ATOM 472 CB GLN A 31 18.785 15.673 -27.482 1.00 0.00 C ATOM 473 CG GLN A 31 20.216 15.510 -28.076 1.00 0.00 C ATOM 474 CD GLN A 31 21.353 16.317 -27.436 1.00 0.00 C ATOM 475 OE1 GLN A 31 21.818 17.320 -27.962 1.00 0.00 O ATOM 476 NE2 GLN A 31 21.856 15.912 -26.293 1.00 0.00 N ATOM 0 H GLN A 31 19.094 13.303 -26.744 1.00 0.00 H new ATOM 0 HA GLN A 31 19.242 15.781 -25.363 1.00 0.00 H new ATOM 0 HB2 GLN A 31 18.094 15.112 -28.112 1.00 0.00 H new ATOM 0 HB3 GLN A 31 18.506 16.724 -27.560 1.00 0.00 H new ATOM 0 HG2 GLN A 31 20.483 14.455 -28.022 1.00 0.00 H new ATOM 0 HG3 GLN A 31 20.172 15.774 -29.133 1.00 0.00 H new ATOM 0 HE21 GLN A 31 21.483 15.079 -25.838 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.620 16.431 -25.860 1.00 0.00 H new ATOM 485 N VAL A 32 16.097 14.831 -25.683 1.00 0.00 N ATOM 486 CA VAL A 32 14.787 14.957 -24.968 1.00 0.00 C ATOM 487 C VAL A 32 14.899 14.628 -23.433 1.00 0.00 C ATOM 488 O VAL A 32 14.611 15.499 -22.611 1.00 0.00 O ATOM 489 CB VAL A 32 13.698 14.140 -25.758 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.359 13.953 -25.008 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.355 14.773 -27.130 1.00 0.00 C ATOM 0 H VAL A 32 16.114 14.078 -26.370 1.00 0.00 H new ATOM 0 HA VAL A 32 14.462 15.997 -24.963 1.00 0.00 H new ATOM 0 HB VAL A 32 14.175 13.168 -25.880 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.671 13.379 -25.629 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.536 13.419 -24.074 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.924 14.929 -24.791 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.599 14.168 -27.631 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.971 15.782 -26.979 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.253 14.815 -27.746 1.00 0.00 H new ATOM 501 N GLY A 33 15.305 13.403 -23.044 1.00 0.00 N ATOM 502 CA GLY A 33 15.354 12.954 -21.620 1.00 0.00 C ATOM 503 C GLY A 33 16.199 13.713 -20.571 1.00 0.00 C ATOM 504 O GLY A 33 15.855 13.656 -19.389 1.00 0.00 O ATOM 0 H GLY A 33 15.611 12.688 -23.704 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.327 12.942 -21.254 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.703 11.921 -21.623 1.00 0.00 H new ATOM 508 N ASN A 34 17.271 14.415 -20.968 1.00 0.00 N ATOM 509 CA ASN A 34 17.952 15.401 -20.074 1.00 0.00 C ATOM 510 C ASN A 34 17.175 16.747 -19.850 1.00 0.00 C ATOM 511 O ASN A 34 17.191 17.253 -18.726 1.00 0.00 O ATOM 512 CB ASN A 34 19.407 15.654 -20.558 1.00 0.00 C ATOM 513 CG ASN A 34 20.401 14.501 -20.352 1.00 0.00 C ATOM 514 OD1 ASN A 34 20.984 14.317 -19.289 1.00 0.00 O ATOM 515 ND2 ASN A 34 20.658 13.712 -21.364 1.00 0.00 N ATOM 0 H ASN A 34 17.693 14.329 -21.893 1.00 0.00 H new ATOM 0 HA ASN A 34 17.970 14.937 -19.088 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.377 15.895 -21.621 1.00 0.00 H new ATOM 0 HB3 ASN A 34 19.791 16.534 -20.042 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.335 12.956 -21.262 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.181 13.853 -22.254 1.00 0.00 H new ATOM 522 N VAL A 35 16.506 17.329 -20.868 1.00 0.00 N ATOM 523 CA VAL A 35 15.622 18.529 -20.677 1.00 0.00 C ATOM 524 C VAL A 35 14.211 18.244 -20.049 1.00 0.00 C ATOM 525 O VAL A 35 13.702 19.104 -19.326 1.00 0.00 O ATOM 526 CB VAL A 35 15.514 19.435 -21.957 1.00 0.00 C ATOM 527 CG1 VAL A 35 16.873 20.000 -22.427 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.786 18.811 -23.170 1.00 0.00 C ATOM 0 H VAL A 35 16.552 16.999 -21.832 1.00 0.00 H new ATOM 0 HA VAL A 35 16.155 19.097 -19.915 1.00 0.00 H new ATOM 0 HB VAL A 35 14.883 20.247 -21.594 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.724 20.616 -23.314 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.309 20.607 -21.633 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.546 19.177 -22.666 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.772 19.525 -23.993 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.309 17.907 -23.483 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.763 18.560 -22.890 1.00 0.00 H new ATOM 538 N THR A 36 13.558 17.099 -20.335 1.00 0.00 N ATOM 539 CA THR A 36 12.163 16.821 -19.878 1.00 0.00 C ATOM 540 C THR A 36 12.112 16.099 -18.493 1.00 0.00 C ATOM 541 O THR A 36 12.720 15.042 -18.297 1.00 0.00 O ATOM 542 CB THR A 36 11.353 16.097 -20.997 1.00 0.00 C ATOM 543 OG1 THR A 36 9.965 16.175 -20.698 1.00 0.00 O ATOM 544 CG2 THR A 36 11.651 14.610 -21.248 1.00 0.00 C ATOM 0 H THR A 36 13.969 16.343 -20.882 1.00 0.00 H new ATOM 0 HA THR A 36 11.670 17.777 -19.701 1.00 0.00 H new ATOM 0 HB THR A 36 11.663 16.626 -21.898 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.510 16.699 -21.390 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.014 14.242 -22.052 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.697 14.491 -21.531 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.454 14.041 -20.339 1.00 0.00 H new ATOM 552 N LYS A 37 11.338 16.659 -17.549 1.00 0.00 N ATOM 553 CA LYS A 37 11.074 16.032 -16.227 1.00 0.00 C ATOM 554 C LYS A 37 9.651 15.357 -16.258 1.00 0.00 C ATOM 555 O LYS A 37 8.665 16.064 -16.017 1.00 0.00 O ATOM 556 CB LYS A 37 11.220 17.118 -15.117 1.00 0.00 C ATOM 557 CG LYS A 37 12.655 17.429 -14.618 1.00 0.00 C ATOM 558 CD LYS A 37 13.601 18.209 -15.562 1.00 0.00 C ATOM 559 CE LYS A 37 13.255 19.695 -15.786 1.00 0.00 C ATOM 560 NZ LYS A 37 12.331 19.890 -16.922 1.00 0.00 N ATOM 0 H LYS A 37 10.874 17.559 -17.673 1.00 0.00 H new ATOM 0 HA LYS A 37 11.795 15.246 -16.002 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.783 18.044 -15.490 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.623 16.808 -14.259 1.00 0.00 H new ATOM 0 HG2 LYS A 37 12.570 17.994 -13.690 1.00 0.00 H new ATOM 0 HG3 LYS A 37 13.135 16.482 -14.372 1.00 0.00 H new ATOM 0 HD2 LYS A 37 14.613 18.148 -15.162 1.00 0.00 H new ATOM 0 HD3 LYS A 37 13.610 17.708 -16.530 1.00 0.00 H new ATOM 0 HE2 LYS A 37 12.805 20.102 -14.880 1.00 0.00 H new ATOM 0 HE3 LYS A 37 14.172 20.256 -15.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.061 20.893 -16.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 12.801 19.605 -17.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 11.480 19.310 -16.780 1.00 0.00 H new ATOM 573 N PRO A 38 9.462 14.029 -16.550 1.00 0.00 N ATOM 574 CA PRO A 38 8.108 13.427 -16.700 1.00 0.00 C ATOM 575 C PRO A 38 7.265 13.304 -15.393 1.00 0.00 C ATOM 576 O PRO A 38 7.771 13.025 -14.300 1.00 0.00 O ATOM 577 CB PRO A 38 8.408 12.058 -17.348 1.00 0.00 C ATOM 578 CG PRO A 38 9.854 11.748 -16.968 1.00 0.00 C ATOM 579 CD PRO A 38 10.532 13.116 -16.995 1.00 0.00 C ATOM 0 HA PRO A 38 7.461 14.071 -17.296 1.00 0.00 H new ATOM 0 HB2 PRO A 38 7.729 11.289 -16.978 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.284 12.098 -18.430 1.00 0.00 H new ATOM 0 HG2 PRO A 38 9.920 11.287 -15.982 1.00 0.00 H new ATOM 0 HG3 PRO A 38 10.315 11.058 -17.674 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.395 13.151 -16.330 1.00 0.00 H new ATOM 0 HD3 PRO A 38 10.889 13.369 -17.993 1.00 0.00 H new ATOM 587 N THR A 39 5.946 13.485 -15.556 1.00 0.00 N ATOM 588 CA THR A 39 4.953 13.318 -14.461 1.00 0.00 C ATOM 589 C THR A 39 4.516 11.820 -14.383 1.00 0.00 C ATOM 590 O THR A 39 3.866 11.293 -15.293 1.00 0.00 O ATOM 591 CB THR A 39 3.781 14.310 -14.720 1.00 0.00 C ATOM 592 OG1 THR A 39 4.274 15.647 -14.754 1.00 0.00 O ATOM 593 CG2 THR A 39 2.691 14.300 -13.643 1.00 0.00 C ATOM 0 H THR A 39 5.528 13.752 -16.447 1.00 0.00 H new ATOM 0 HA THR A 39 5.371 13.558 -13.484 1.00 0.00 H new ATOM 0 HB THR A 39 3.348 13.981 -15.665 1.00 0.00 H new ATOM 0 HG1 THR A 39 3.532 16.265 -14.919 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.915 15.020 -13.904 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.254 13.304 -13.577 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.127 14.569 -12.681 1.00 0.00 H new ATOM 601 N VAL A 40 4.908 11.132 -13.300 1.00 0.00 N ATOM 602 CA VAL A 40 4.664 9.670 -13.128 1.00 0.00 C ATOM 603 C VAL A 40 3.359 9.460 -12.288 1.00 0.00 C ATOM 604 O VAL A 40 3.352 9.635 -11.069 1.00 0.00 O ATOM 605 CB VAL A 40 5.976 9.000 -12.580 1.00 0.00 C ATOM 606 CG1 VAL A 40 5.786 7.581 -12.004 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.076 8.892 -13.662 1.00 0.00 C ATOM 0 H VAL A 40 5.401 11.560 -12.516 1.00 0.00 H new ATOM 0 HA VAL A 40 4.462 9.157 -14.069 1.00 0.00 H new ATOM 0 HB VAL A 40 6.271 9.672 -11.774 1.00 0.00 H new ATOM 0 HG11 VAL A 40 6.744 7.200 -11.651 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.081 7.617 -11.173 1.00 0.00 H new ATOM 0 HG13 VAL A 40 5.398 6.922 -12.781 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.962 8.423 -13.234 1.00 0.00 H new ATOM 0 HG22 VAL A 40 6.711 8.289 -14.493 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.331 9.889 -14.022 1.00 0.00 H new ATOM 617 N ILE A 41 2.252 9.063 -12.938 1.00 0.00 N ATOM 618 CA ILE A 41 0.946 8.809 -12.252 1.00 0.00 C ATOM 619 C ILE A 41 0.874 7.280 -11.940 1.00 0.00 C ATOM 620 O ILE A 41 0.625 6.471 -12.841 1.00 0.00 O ATOM 621 CB ILE A 41 -0.262 9.361 -13.098 1.00 0.00 C ATOM 622 CG1 ILE A 41 -0.175 10.897 -13.359 1.00 0.00 C ATOM 623 CG2 ILE A 41 -1.632 9.040 -12.437 1.00 0.00 C ATOM 624 CD1 ILE A 41 -1.097 11.428 -14.470 1.00 0.00 C ATOM 0 H ILE A 41 2.223 8.906 -13.945 1.00 0.00 H new ATOM 0 HA ILE A 41 0.876 9.352 -11.310 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.192 8.846 -14.056 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.411 11.420 -12.432 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.855 11.148 -13.613 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.436 9.439 -13.055 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.747 7.960 -12.345 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.674 9.495 -11.448 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.961 12.505 -14.572 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.849 10.940 -15.413 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -2.135 11.216 -14.213 1.00 0.00 H new ATOM 636 N ILE A 42 1.086 6.889 -10.670 1.00 0.00 N ATOM 637 CA ILE A 42 0.985 5.462 -10.229 1.00 0.00 C ATOM 638 C ILE A 42 -0.484 5.218 -9.760 1.00 0.00 C ATOM 639 O ILE A 42 -0.930 5.796 -8.763 1.00 0.00 O ATOM 640 CB ILE A 42 2.051 5.111 -9.125 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.516 5.312 -9.616 1.00 0.00 C ATOM 642 CG2 ILE A 42 1.867 3.685 -8.526 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.638 5.104 -8.589 1.00 0.00 C ATOM 0 H ILE A 42 1.330 7.535 -9.919 1.00 0.00 H new ATOM 0 HA ILE A 42 1.215 4.790 -11.056 1.00 0.00 H new ATOM 0 HB ILE A 42 1.867 5.826 -8.323 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.689 4.629 -10.448 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.604 6.324 -10.011 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.633 3.506 -7.771 1.00 0.00 H new ATOM 0 HG22 ILE A 42 0.881 3.607 -8.068 1.00 0.00 H new ATOM 0 HG23 ILE A 42 1.958 2.943 -9.319 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.603 5.276 -9.065 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.510 5.805 -7.764 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.598 4.084 -8.208 1.00 0.00 H new ATOM 655 N SER A 43 -1.217 4.351 -10.476 1.00 0.00 N ATOM 656 CA SER A 43 -2.662 4.112 -10.220 1.00 0.00 C ATOM 657 C SER A 43 -2.980 2.595 -10.058 1.00 0.00 C ATOM 658 O SER A 43 -2.658 1.781 -10.927 1.00 0.00 O ATOM 659 CB SER A 43 -3.471 4.765 -11.372 1.00 0.00 C ATOM 660 OG SER A 43 -3.288 4.115 -12.635 1.00 0.00 O ATOM 0 H SER A 43 -0.837 3.797 -11.243 1.00 0.00 H new ATOM 0 HA SER A 43 -2.950 4.570 -9.273 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.530 4.752 -11.115 1.00 0.00 H new ATOM 0 HB3 SER A 43 -3.178 5.811 -11.464 1.00 0.00 H new ATOM 0 HG SER A 43 -2.496 3.540 -12.595 1.00 0.00 H new ATOM 666 N GLN A 44 -3.661 2.207 -8.969 1.00 0.00 N ATOM 667 CA GLN A 44 -4.237 0.834 -8.829 1.00 0.00 C ATOM 668 C GLN A 44 -5.649 0.794 -9.496 1.00 0.00 C ATOM 669 O GLN A 44 -6.494 1.653 -9.217 1.00 0.00 O ATOM 670 CB GLN A 44 -4.294 0.433 -7.331 1.00 0.00 C ATOM 671 CG GLN A 44 -2.918 0.326 -6.620 1.00 0.00 C ATOM 672 CD GLN A 44 -2.997 -0.148 -5.167 1.00 0.00 C ATOM 673 OE1 GLN A 44 -3.372 0.586 -4.259 1.00 0.00 O ATOM 674 NE2 GLN A 44 -2.628 -1.376 -4.891 1.00 0.00 N ATOM 0 H GLN A 44 -3.833 2.813 -8.167 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.602 0.109 -9.338 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.903 1.164 -6.799 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.803 -0.527 -7.248 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.285 -0.362 -7.181 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.431 1.301 -6.646 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.314 -1.995 -5.639 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.655 -1.712 -3.928 1.00 0.00 H new ATOM 683 N GLU A 45 -5.894 -0.132 -10.441 1.00 0.00 N ATOM 684 CA GLU A 45 -7.098 -0.062 -11.325 1.00 0.00 C ATOM 685 C GLU A 45 -7.805 -1.449 -11.408 1.00 0.00 C ATOM 686 O GLU A 45 -7.494 -2.279 -12.270 1.00 0.00 O ATOM 687 CB GLU A 45 -6.688 0.508 -12.716 1.00 0.00 C ATOM 688 CG GLU A 45 -6.094 1.944 -12.761 1.00 0.00 C ATOM 689 CD GLU A 45 -7.052 3.095 -12.447 1.00 0.00 C ATOM 690 OE1 GLU A 45 -7.561 3.793 -13.320 1.00 0.00 O ATOM 691 OE2 GLU A 45 -7.263 3.269 -11.105 1.00 0.00 O ATOM 0 H GLU A 45 -5.289 -0.933 -10.620 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.834 0.621 -10.900 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.957 -0.171 -13.155 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.568 0.488 -13.359 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.264 1.991 -12.056 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.678 2.109 -13.755 1.00 0.00 H new ATOM 699 N GLY A 46 -8.767 -1.705 -10.496 1.00 0.00 N ATOM 700 CA GLY A 46 -9.571 -2.963 -10.507 1.00 0.00 C ATOM 701 C GLY A 46 -8.882 -4.206 -9.902 1.00 0.00 C ATOM 702 O GLY A 46 -9.287 -4.729 -8.865 1.00 0.00 O ATOM 0 H GLY A 46 -9.011 -1.064 -9.741 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.498 -2.784 -9.963 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.845 -3.188 -11.538 1.00 0.00 H new ATOM 706 N ASP A 47 -7.853 -4.700 -10.592 1.00 0.00 N ATOM 707 CA ASP A 47 -6.906 -5.723 -10.055 1.00 0.00 C ATOM 708 C ASP A 47 -5.409 -5.316 -10.279 1.00 0.00 C ATOM 709 O ASP A 47 -4.609 -5.455 -9.351 1.00 0.00 O ATOM 710 CB ASP A 47 -7.216 -7.125 -10.658 1.00 0.00 C ATOM 711 CG ASP A 47 -8.372 -7.969 -10.100 1.00 0.00 C ATOM 712 OD1 ASP A 47 -8.444 -9.176 -10.311 1.00 0.00 O ATOM 713 OD2 ASP A 47 -9.292 -7.270 -9.364 1.00 0.00 O ATOM 0 H ASP A 47 -7.638 -4.411 -11.546 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.054 -5.777 -8.976 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.403 -6.984 -11.723 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.308 -7.722 -10.570 1.00 0.00 H new ATOM 719 N LYS A 48 -5.009 -4.867 -11.488 1.00 0.00 N ATOM 720 CA LYS A 48 -3.591 -4.586 -11.830 1.00 0.00 C ATOM 721 C LYS A 48 -3.109 -3.131 -11.497 1.00 0.00 C ATOM 722 O LYS A 48 -3.897 -2.194 -11.316 1.00 0.00 O ATOM 723 CB LYS A 48 -3.425 -5.013 -13.317 1.00 0.00 C ATOM 724 CG LYS A 48 -4.043 -4.093 -14.400 1.00 0.00 C ATOM 725 CD LYS A 48 -4.163 -4.713 -15.811 1.00 0.00 C ATOM 726 CE LYS A 48 -2.870 -5.335 -16.368 1.00 0.00 C ATOM 727 NZ LYS A 48 -2.997 -5.647 -17.804 1.00 0.00 N ATOM 0 H LYS A 48 -5.656 -4.688 -12.256 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.920 -5.162 -11.193 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.359 -5.105 -13.523 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.859 -6.006 -13.432 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.036 -3.789 -14.070 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.440 -3.188 -14.470 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.936 -5.481 -15.788 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.502 -3.941 -16.502 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.039 -4.647 -16.216 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -2.635 -6.245 -15.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.109 -6.065 -18.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.775 -6.323 -17.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.197 -4.774 -18.333 1.00 0.00 H new ATOM 740 N VAL A 49 -1.779 -2.958 -11.428 1.00 0.00 N ATOM 741 CA VAL A 49 -1.132 -1.638 -11.157 1.00 0.00 C ATOM 742 C VAL A 49 -0.767 -0.982 -12.532 1.00 0.00 C ATOM 743 O VAL A 49 -0.080 -1.578 -13.371 1.00 0.00 O ATOM 744 CB VAL A 49 0.102 -1.793 -10.203 1.00 0.00 C ATOM 745 CG1 VAL A 49 0.754 -0.438 -9.831 1.00 0.00 C ATOM 746 CG2 VAL A 49 -0.200 -2.518 -8.868 1.00 0.00 C ATOM 0 H VAL A 49 -1.113 -3.719 -11.556 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.820 -0.978 -10.629 1.00 0.00 H new ATOM 0 HB VAL A 49 0.780 -2.404 -10.799 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.602 -0.612 -9.169 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.097 0.062 -10.737 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.022 0.191 -9.325 1.00 0.00 H new ATOM 0 HG21 VAL A 49 0.711 -2.579 -8.273 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.958 -1.962 -8.315 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.567 -3.523 -9.075 1.00 0.00 H new ATOM 756 N VAL A 50 -1.251 0.250 -12.750 1.00 0.00 N ATOM 757 CA VAL A 50 -1.155 0.962 -14.055 1.00 0.00 C ATOM 758 C VAL A 50 -0.351 2.278 -13.796 1.00 0.00 C ATOM 759 O VAL A 50 -0.873 3.230 -13.197 1.00 0.00 O ATOM 760 CB VAL A 50 -2.581 1.202 -14.668 1.00 0.00 C ATOM 761 CG1 VAL A 50 -2.520 1.885 -16.055 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.433 -0.082 -14.830 1.00 0.00 C ATOM 0 H VAL A 50 -1.725 0.793 -12.028 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.629 0.369 -14.803 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.059 1.851 -13.934 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.532 2.028 -16.435 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.027 2.853 -15.963 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.959 1.256 -16.746 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.401 0.176 -15.260 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.917 -0.780 -15.490 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.581 -0.546 -13.855 1.00 0.00 H new ATOM 772 N ILE A 51 0.919 2.325 -14.240 1.00 0.00 N ATOM 773 CA ILE A 51 1.803 3.518 -14.056 1.00 0.00 C ATOM 774 C ILE A 51 1.894 4.280 -15.419 1.00 0.00 C ATOM 775 O ILE A 51 2.369 3.723 -16.415 1.00 0.00 O ATOM 776 CB ILE A 51 3.216 3.160 -13.459 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.142 2.367 -12.118 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.095 4.432 -13.298 1.00 0.00 C ATOM 779 CD1 ILE A 51 4.474 1.877 -11.513 1.00 0.00 C ATOM 0 H ILE A 51 1.368 1.553 -14.732 1.00 0.00 H new ATOM 0 HA ILE A 51 1.359 4.173 -13.306 1.00 0.00 H new ATOM 0 HB ILE A 51 3.686 2.494 -14.183 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.648 2.998 -11.379 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.502 1.498 -12.274 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.064 4.154 -12.884 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.237 4.902 -14.271 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.601 5.133 -12.626 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.277 1.342 -10.584 1.00 0.00 H new ATOM 0 HD12 ILE A 51 4.970 1.210 -12.218 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.118 2.733 -11.309 1.00 0.00 H new ATOM 791 N ARG A 52 1.504 5.569 -15.435 1.00 0.00 N ATOM 792 CA ARG A 52 1.671 6.448 -16.631 1.00 0.00 C ATOM 793 C ARG A 52 2.865 7.430 -16.449 1.00 0.00 C ATOM 794 O ARG A 52 2.818 8.335 -15.616 1.00 0.00 O ATOM 795 CB ARG A 52 0.372 7.225 -16.966 1.00 0.00 C ATOM 796 CG ARG A 52 -0.822 6.349 -17.411 1.00 0.00 C ATOM 797 CD ARG A 52 -2.024 7.143 -17.958 1.00 0.00 C ATOM 798 NE ARG A 52 -1.750 7.608 -19.350 1.00 0.00 N ATOM 799 CZ ARG A 52 -2.527 8.424 -20.061 1.00 0.00 C ATOM 800 NH1 ARG A 52 -3.655 8.918 -19.616 1.00 0.00 N ATOM 801 NH2 ARG A 52 -2.149 8.756 -21.260 1.00 0.00 N ATOM 0 H ARG A 52 1.070 6.034 -14.638 1.00 0.00 H new ATOM 0 HA ARG A 52 1.891 5.794 -17.475 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.074 7.799 -16.088 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.590 7.943 -17.757 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.481 5.654 -18.179 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.153 5.750 -16.563 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.917 6.518 -17.946 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.225 7.999 -17.315 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.895 7.272 -19.794 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.980 8.682 -18.678 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.208 9.539 -20.207 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -1.274 8.393 -21.638 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -2.728 9.379 -21.823 1.00 0.00 H new ATOM 815 N THR A 53 3.916 7.262 -17.264 1.00 0.00 N ATOM 816 CA THR A 53 5.089 8.190 -17.296 1.00 0.00 C ATOM 817 C THR A 53 4.877 9.253 -18.419 1.00 0.00 C ATOM 818 O THR A 53 5.020 8.958 -19.613 1.00 0.00 O ATOM 819 CB THR A 53 6.385 7.342 -17.471 1.00 0.00 C ATOM 820 OG1 THR A 53 6.496 6.412 -16.398 1.00 0.00 O ATOM 821 CG2 THR A 53 7.699 8.139 -17.491 1.00 0.00 C ATOM 0 H THR A 53 3.991 6.487 -17.923 1.00 0.00 H new ATOM 0 HA THR A 53 5.191 8.746 -16.364 1.00 0.00 H new ATOM 0 HB THR A 53 6.269 6.873 -18.448 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.310 5.879 -16.510 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.538 7.454 -17.617 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.682 8.848 -18.319 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.811 8.680 -16.552 1.00 0.00 H new ATOM 829 N LEU A 54 4.505 10.483 -18.026 1.00 0.00 N ATOM 830 CA LEU A 54 4.016 11.512 -18.983 1.00 0.00 C ATOM 831 C LEU A 54 5.023 12.693 -19.113 1.00 0.00 C ATOM 832 O LEU A 54 5.065 13.603 -18.278 1.00 0.00 O ATOM 833 CB LEU A 54 2.597 11.993 -18.558 1.00 0.00 C ATOM 834 CG LEU A 54 1.462 10.935 -18.480 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.128 11.606 -18.114 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.279 10.147 -19.787 1.00 0.00 C ATOM 0 H LEU A 54 4.530 10.797 -17.056 1.00 0.00 H new ATOM 0 HA LEU A 54 3.940 11.065 -19.974 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.683 12.463 -17.578 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.284 12.768 -19.257 1.00 0.00 H new ATOM 0 HG LEU A 54 1.761 10.228 -17.706 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.657 10.851 -18.063 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.222 12.098 -17.146 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.128 12.345 -18.873 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.472 9.425 -19.666 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.032 10.835 -20.595 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.203 9.621 -20.027 1.00 0.00 H new ATOM 848 N SER A 55 5.809 12.693 -20.200 1.00 0.00 N ATOM 849 CA SER A 55 6.543 13.901 -20.661 1.00 0.00 C ATOM 850 C SER A 55 5.672 14.784 -21.612 1.00 0.00 C ATOM 851 O SER A 55 4.856 14.275 -22.389 1.00 0.00 O ATOM 852 CB SER A 55 7.816 13.385 -21.382 1.00 0.00 C ATOM 853 OG SER A 55 8.555 14.450 -21.985 1.00 0.00 O ATOM 0 H SER A 55 5.959 11.871 -20.784 1.00 0.00 H new ATOM 0 HA SER A 55 6.798 14.542 -19.817 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.451 12.861 -20.667 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.532 12.661 -22.146 1.00 0.00 H new ATOM 0 HG SER A 55 9.033 14.951 -21.291 1.00 0.00 H new ATOM 859 N THR A 56 5.987 16.091 -21.702 1.00 0.00 N ATOM 860 CA THR A 56 5.593 16.943 -22.882 1.00 0.00 C ATOM 861 C THR A 56 6.292 16.609 -24.268 1.00 0.00 C ATOM 862 O THR A 56 6.543 17.502 -25.083 1.00 0.00 O ATOM 863 CB THR A 56 5.731 18.443 -22.467 1.00 0.00 C ATOM 864 OG1 THR A 56 5.231 19.260 -23.518 1.00 0.00 O ATOM 865 CG2 THR A 56 7.156 18.951 -22.170 1.00 0.00 C ATOM 0 H THR A 56 6.510 16.594 -20.985 1.00 0.00 H new ATOM 0 HA THR A 56 4.556 16.701 -23.112 1.00 0.00 H new ATOM 0 HB THR A 56 5.174 18.507 -21.533 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.596 18.952 -24.374 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.116 20.005 -21.894 1.00 0.00 H new ATOM 0 HG22 THR A 56 7.583 18.376 -21.348 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.777 18.832 -23.058 1.00 0.00 H new ATOM 873 N PHE A 57 6.575 15.320 -24.524 1.00 0.00 N ATOM 874 CA PHE A 57 7.278 14.816 -25.737 1.00 0.00 C ATOM 875 C PHE A 57 6.777 13.361 -26.043 1.00 0.00 C ATOM 876 O PHE A 57 6.209 13.131 -27.112 1.00 0.00 O ATOM 877 CB PHE A 57 8.834 14.855 -25.588 1.00 0.00 C ATOM 878 CG PHE A 57 9.518 16.233 -25.548 1.00 0.00 C ATOM 879 CD1 PHE A 57 9.939 16.852 -26.730 1.00 0.00 C ATOM 880 CD2 PHE A 57 9.801 16.841 -24.320 1.00 0.00 C ATOM 881 CE1 PHE A 57 10.635 18.059 -26.681 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.494 18.047 -24.272 1.00 0.00 C ATOM 883 CZ PHE A 57 10.915 18.652 -25.452 1.00 0.00 C ATOM 0 H PHE A 57 6.318 14.572 -23.880 1.00 0.00 H new ATOM 0 HA PHE A 57 7.040 15.475 -26.572 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.096 14.325 -24.672 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.264 14.292 -26.417 1.00 0.00 H new ATOM 0 HD1 PHE A 57 9.724 16.393 -27.684 1.00 0.00 H new ATOM 0 HD2 PHE A 57 9.479 16.371 -23.402 1.00 0.00 H new ATOM 0 HE1 PHE A 57 10.957 18.534 -27.596 1.00 0.00 H new ATOM 0 HE2 PHE A 57 10.705 18.512 -23.320 1.00 0.00 H new ATOM 0 HZ PHE A 57 11.460 19.584 -25.415 1.00 0.00 H new ATOM 893 N LYS A 58 6.990 12.387 -25.124 1.00 0.00 N ATOM 894 CA LYS A 58 6.615 10.959 -25.323 1.00 0.00 C ATOM 895 C LYS A 58 5.646 10.489 -24.184 1.00 0.00 C ATOM 896 O LYS A 58 5.982 10.532 -22.994 1.00 0.00 O ATOM 897 CB LYS A 58 7.930 10.116 -25.401 1.00 0.00 C ATOM 898 CG LYS A 58 7.884 8.852 -26.297 1.00 0.00 C ATOM 899 CD LYS A 58 7.187 7.631 -25.670 1.00 0.00 C ATOM 900 CE LYS A 58 7.075 6.445 -26.641 1.00 0.00 C ATOM 901 NZ LYS A 58 6.277 5.371 -26.017 1.00 0.00 N ATOM 0 H LYS A 58 7.428 12.567 -24.220 1.00 0.00 H new ATOM 0 HA LYS A 58 6.069 10.821 -26.256 1.00 0.00 H new ATOM 0 HB2 LYS A 58 8.730 10.762 -25.762 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.200 9.809 -24.391 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.374 9.104 -27.227 1.00 0.00 H new ATOM 0 HG3 LYS A 58 8.905 8.574 -26.558 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.740 7.318 -24.784 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.189 7.919 -25.338 1.00 0.00 H new ATOM 0 HE2 LYS A 58 6.607 6.766 -27.572 1.00 0.00 H new ATOM 0 HE3 LYS A 58 8.068 6.074 -26.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 5.957 4.706 -26.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.860 4.865 -25.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 5.450 5.785 -25.541 1.00 0.00 H new ATOM 914 N ASN A 59 4.450 10.000 -24.563 1.00 0.00 N ATOM 915 CA ASN A 59 3.535 9.264 -23.644 1.00 0.00 C ATOM 916 C ASN A 59 3.932 7.749 -23.583 1.00 0.00 C ATOM 917 O ASN A 59 3.802 7.029 -24.581 1.00 0.00 O ATOM 918 CB ASN A 59 2.086 9.512 -24.166 1.00 0.00 C ATOM 919 CG ASN A 59 0.961 8.685 -23.521 1.00 0.00 C ATOM 920 OD1 ASN A 59 0.405 9.011 -22.479 1.00 0.00 O ATOM 921 ND2 ASN A 59 0.599 7.572 -24.111 1.00 0.00 N ATOM 0 H ASN A 59 4.084 10.099 -25.510 1.00 0.00 H new ATOM 0 HA ASN A 59 3.605 9.618 -22.616 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.852 10.568 -24.028 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.075 9.320 -25.239 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.135 6.993 -23.702 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.051 7.285 -24.979 1.00 0.00 H new ATOM 928 N THR A 60 4.365 7.265 -22.407 1.00 0.00 N ATOM 929 CA THR A 60 4.629 5.811 -22.174 1.00 0.00 C ATOM 930 C THR A 60 3.966 5.322 -20.846 1.00 0.00 C ATOM 931 O THR A 60 3.858 6.058 -19.858 1.00 0.00 O ATOM 932 CB THR A 60 6.145 5.480 -22.320 1.00 0.00 C ATOM 933 OG1 THR A 60 6.318 4.068 -22.306 1.00 0.00 O ATOM 934 CG2 THR A 60 7.104 6.072 -21.276 1.00 0.00 C ATOM 0 H THR A 60 4.544 7.852 -21.592 1.00 0.00 H new ATOM 0 HA THR A 60 4.144 5.228 -22.957 1.00 0.00 H new ATOM 0 HB THR A 60 6.418 5.955 -23.262 1.00 0.00 H new ATOM 0 HG1 THR A 60 7.270 3.854 -22.399 1.00 0.00 H new ATOM 0 HG21 THR A 60 8.124 5.760 -21.501 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.043 7.160 -21.302 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.826 5.716 -20.284 1.00 0.00 H new ATOM 942 N GLU A 61 3.480 4.069 -20.832 1.00 0.00 N ATOM 943 CA GLU A 61 2.743 3.503 -19.666 1.00 0.00 C ATOM 944 C GLU A 61 2.903 1.959 -19.522 1.00 0.00 C ATOM 945 O GLU A 61 3.085 1.231 -20.505 1.00 0.00 O ATOM 946 CB GLU A 61 1.255 3.967 -19.635 1.00 0.00 C ATOM 947 CG GLU A 61 0.325 3.653 -20.837 1.00 0.00 C ATOM 948 CD GLU A 61 0.233 4.796 -21.852 1.00 0.00 C ATOM 949 OE1 GLU A 61 -0.360 5.853 -21.631 1.00 0.00 O ATOM 950 OE2 GLU A 61 0.892 4.513 -23.013 1.00 0.00 O ATOM 0 H GLU A 61 3.580 3.420 -21.612 1.00 0.00 H new ATOM 0 HA GLU A 61 3.218 3.919 -18.777 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.797 3.532 -18.747 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.254 5.048 -19.497 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.687 2.757 -21.342 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.674 3.427 -20.464 1.00 0.00 H new ATOM 958 N ILE A 62 2.842 1.484 -18.265 1.00 0.00 N ATOM 959 CA ILE A 62 3.053 0.049 -17.901 1.00 0.00 C ATOM 960 C ILE A 62 1.837 -0.485 -17.081 1.00 0.00 C ATOM 961 O ILE A 62 1.410 0.127 -16.097 1.00 0.00 O ATOM 962 CB ILE A 62 4.411 -0.201 -17.150 1.00 0.00 C ATOM 963 CG1 ILE A 62 4.634 0.648 -15.870 1.00 0.00 C ATOM 964 CG2 ILE A 62 5.603 -0.067 -18.118 1.00 0.00 C ATOM 965 CD1 ILE A 62 5.847 0.262 -15.012 1.00 0.00 C ATOM 0 H ILE A 62 2.645 2.079 -17.460 1.00 0.00 H new ATOM 0 HA ILE A 62 3.122 -0.513 -18.832 1.00 0.00 H new ATOM 0 HB ILE A 62 4.342 -1.226 -16.787 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.739 1.692 -16.164 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.739 0.579 -15.251 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.533 -0.244 -17.577 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.505 -0.799 -18.920 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.616 0.937 -18.543 1.00 0.00 H new ATOM 0 HD11 ILE A 62 5.904 0.921 -14.146 1.00 0.00 H new ATOM 0 HD12 ILE A 62 5.742 -0.770 -14.677 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.757 0.361 -15.604 1.00 0.00 H new ATOM 977 N SER A 63 1.311 -1.650 -17.486 1.00 0.00 N ATOM 978 CA SER A 63 0.146 -2.304 -16.826 1.00 0.00 C ATOM 979 C SER A 63 0.543 -3.733 -16.352 1.00 0.00 C ATOM 980 O SER A 63 0.826 -4.597 -17.192 1.00 0.00 O ATOM 981 CB SER A 63 -1.039 -2.329 -17.824 1.00 0.00 C ATOM 982 OG SER A 63 -0.806 -3.231 -18.910 1.00 0.00 O ATOM 0 H SER A 63 1.674 -2.175 -18.281 1.00 0.00 H new ATOM 0 HA SER A 63 -0.161 -1.745 -15.942 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.949 -2.621 -17.299 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.205 -1.325 -18.215 1.00 0.00 H new ATOM 0 HG SER A 63 -0.215 -3.954 -18.614 1.00 0.00 H new ATOM 988 N PHE A 64 0.565 -3.988 -15.032 1.00 0.00 N ATOM 989 CA PHE A 64 1.214 -5.208 -14.466 1.00 0.00 C ATOM 990 C PHE A 64 0.486 -5.778 -13.205 1.00 0.00 C ATOM 991 O PHE A 64 0.016 -5.038 -12.334 1.00 0.00 O ATOM 992 CB PHE A 64 2.726 -4.925 -14.203 1.00 0.00 C ATOM 993 CG PHE A 64 3.083 -3.800 -13.209 1.00 0.00 C ATOM 994 CD1 PHE A 64 3.229 -2.487 -13.667 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.229 -4.070 -11.844 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.510 -1.460 -12.772 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.525 -3.042 -10.953 1.00 0.00 C ATOM 998 CZ PHE A 64 3.668 -1.739 -11.418 1.00 0.00 C ATOM 0 H PHE A 64 0.146 -3.376 -14.332 1.00 0.00 H new ATOM 0 HA PHE A 64 1.128 -6.000 -15.210 1.00 0.00 H new ATOM 0 HB2 PHE A 64 3.182 -5.847 -13.844 1.00 0.00 H new ATOM 0 HB3 PHE A 64 3.194 -4.689 -15.159 1.00 0.00 H new ATOM 0 HD1 PHE A 64 3.123 -2.269 -14.720 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.112 -5.080 -11.480 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.606 -0.445 -13.128 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.644 -3.256 -9.901 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.902 -0.943 -10.727 1.00 0.00 H new ATOM 1008 N GLN A 65 0.458 -7.116 -13.083 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.097 -7.823 -11.882 1.00 0.00 C ATOM 1010 C GLN A 65 0.959 -8.311 -10.817 1.00 0.00 C ATOM 1011 O GLN A 65 0.644 -9.195 -10.019 1.00 0.00 O ATOM 1012 CB GLN A 65 -0.976 -8.995 -12.419 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.292 -8.577 -13.129 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.069 -9.743 -13.744 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -2.846 -10.139 -14.882 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -4.003 -10.324 -13.030 1.00 0.00 N ATOM 0 H GLN A 65 0.813 -7.748 -13.801 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.679 -7.102 -11.308 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.379 -9.583 -13.116 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.227 -9.649 -11.584 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -2.933 -8.066 -12.411 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.056 -7.858 -13.913 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.195 -10.001 -12.082 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.537 -11.099 -13.423 1.00 0.00 H new ATOM 1025 N LEU A 66 2.175 -7.721 -10.761 1.00 0.00 N ATOM 1026 CA LEU A 66 3.276 -8.099 -9.815 1.00 0.00 C ATOM 1027 C LEU A 66 3.901 -9.504 -10.111 1.00 0.00 C ATOM 1028 O LEU A 66 3.242 -10.537 -9.961 1.00 0.00 O ATOM 1029 CB LEU A 66 2.928 -7.898 -8.309 1.00 0.00 C ATOM 1030 CG LEU A 66 2.546 -6.460 -7.868 1.00 0.00 C ATOM 1031 CD1 LEU A 66 2.027 -6.466 -6.420 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.728 -5.482 -7.979 1.00 0.00 C ATOM 0 H LEU A 66 2.434 -6.953 -11.380 1.00 0.00 H new ATOM 0 HA LEU A 66 4.062 -7.372 -10.021 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.100 -8.562 -8.060 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.784 -8.220 -7.716 1.00 0.00 H new ATOM 0 HG LEU A 66 1.763 -6.119 -8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.763 -5.451 -6.124 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.146 -7.105 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.804 -6.847 -5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.410 -4.490 -7.659 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.544 -5.824 -7.343 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.068 -5.438 -9.014 1.00 0.00 H new ATOM 1044 N GLY A 67 5.162 -9.547 -10.584 1.00 0.00 N ATOM 1045 CA GLY A 67 5.755 -10.798 -11.152 1.00 0.00 C ATOM 1046 C GLY A 67 5.407 -11.210 -12.613 1.00 0.00 C ATOM 1047 O GLY A 67 6.002 -12.160 -13.123 1.00 0.00 O ATOM 0 H GLY A 67 5.793 -8.745 -10.589 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.839 -10.706 -11.087 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.466 -11.623 -10.501 1.00 0.00 H new ATOM 1051 N GLU A 68 4.472 -10.519 -13.283 1.00 0.00 N ATOM 1052 CA GLU A 68 4.025 -10.837 -14.662 1.00 0.00 C ATOM 1053 C GLU A 68 5.004 -10.222 -15.719 1.00 0.00 C ATOM 1054 O GLU A 68 5.259 -9.013 -15.717 1.00 0.00 O ATOM 1055 CB GLU A 68 2.562 -10.303 -14.778 1.00 0.00 C ATOM 1056 CG GLU A 68 1.691 -10.840 -15.946 1.00 0.00 C ATOM 1057 CD GLU A 68 2.151 -10.439 -17.346 1.00 0.00 C ATOM 1058 OE1 GLU A 68 2.086 -9.296 -17.786 1.00 0.00 O ATOM 1059 OE2 GLU A 68 2.703 -11.487 -18.022 1.00 0.00 O ATOM 0 H GLU A 68 3.994 -9.711 -12.883 1.00 0.00 H new ATOM 0 HA GLU A 68 4.037 -11.908 -14.865 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.047 -10.528 -13.844 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.606 -9.217 -14.864 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.667 -11.928 -15.888 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.668 -10.491 -15.804 1.00 0.00 H new ATOM 1067 N GLU A 69 5.522 -11.060 -16.635 1.00 0.00 N ATOM 1068 CA GLU A 69 6.378 -10.597 -17.765 1.00 0.00 C ATOM 1069 C GLU A 69 5.542 -10.025 -18.962 1.00 0.00 C ATOM 1070 O GLU A 69 4.655 -10.699 -19.502 1.00 0.00 O ATOM 1071 CB GLU A 69 7.301 -11.770 -18.197 1.00 0.00 C ATOM 1072 CG GLU A 69 8.457 -11.346 -19.143 1.00 0.00 C ATOM 1073 CD GLU A 69 9.466 -12.449 -19.452 1.00 0.00 C ATOM 1074 OE1 GLU A 69 10.603 -12.472 -18.990 1.00 0.00 O ATOM 1075 OE2 GLU A 69 8.963 -13.381 -20.315 1.00 0.00 O ATOM 0 H GLU A 69 5.367 -12.068 -16.622 1.00 0.00 H new ATOM 0 HA GLU A 69 6.990 -9.761 -17.427 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.725 -12.233 -17.306 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.698 -12.530 -18.694 1.00 0.00 H new ATOM 0 HG2 GLU A 69 8.029 -10.991 -20.080 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.985 -10.505 -18.695 1.00 0.00 H new ATOM 1083 N PHE A 70 5.856 -8.792 -19.385 1.00 0.00 N ATOM 1084 CA PHE A 70 5.158 -8.104 -20.513 1.00 0.00 C ATOM 1085 C PHE A 70 6.188 -7.378 -21.443 1.00 0.00 C ATOM 1086 O PHE A 70 7.102 -6.703 -20.960 1.00 0.00 O ATOM 1087 CB PHE A 70 4.039 -7.157 -19.967 1.00 0.00 C ATOM 1088 CG PHE A 70 4.474 -5.976 -19.074 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.676 -6.163 -17.702 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.776 -4.737 -19.647 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.236 -5.148 -16.929 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.318 -3.720 -18.868 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.559 -3.927 -17.513 1.00 0.00 C ATOM 0 H PHE A 70 6.598 -8.233 -18.964 1.00 0.00 H new ATOM 0 HA PHE A 70 4.658 -8.846 -21.135 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.497 -6.750 -20.821 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.332 -7.764 -19.401 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.397 -7.098 -17.240 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.588 -4.569 -20.697 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.419 -5.309 -15.877 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.553 -2.766 -19.316 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.996 -3.141 -16.915 1.00 0.00 H new ATOM 1103 N ASP A 71 6.036 -7.467 -22.778 1.00 0.00 N ATOM 1104 CA ASP A 71 6.889 -6.688 -23.729 1.00 0.00 C ATOM 1105 C ASP A 71 6.462 -5.183 -23.779 1.00 0.00 C ATOM 1106 O ASP A 71 5.284 -4.861 -23.957 1.00 0.00 O ATOM 1107 CB ASP A 71 6.867 -7.266 -25.167 1.00 0.00 C ATOM 1108 CG ASP A 71 7.478 -8.658 -25.363 1.00 0.00 C ATOM 1109 OD1 ASP A 71 7.181 -9.629 -24.672 1.00 0.00 O ATOM 1110 OD2 ASP A 71 8.374 -8.705 -26.399 1.00 0.00 O ATOM 0 H ASP A 71 5.341 -8.061 -23.230 1.00 0.00 H new ATOM 0 HA ASP A 71 7.906 -6.769 -23.344 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.831 -7.300 -25.504 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.392 -6.570 -25.821 1.00 0.00 H new ATOM 1116 N GLU A 72 7.439 -4.276 -23.638 1.00 0.00 N ATOM 1117 CA GLU A 72 7.169 -2.820 -23.477 1.00 0.00 C ATOM 1118 C GLU A 72 8.033 -1.978 -24.458 1.00 0.00 C ATOM 1119 O GLU A 72 9.236 -1.802 -24.230 1.00 0.00 O ATOM 1120 CB GLU A 72 7.434 -2.447 -21.992 1.00 0.00 C ATOM 1121 CG GLU A 72 7.062 -0.992 -21.598 1.00 0.00 C ATOM 1122 CD GLU A 72 5.572 -0.637 -21.614 1.00 0.00 C ATOM 1123 OE1 GLU A 72 4.658 -1.456 -21.657 1.00 0.00 O ATOM 1124 OE2 GLU A 72 5.373 0.703 -21.478 1.00 0.00 O ATOM 0 H GLU A 72 8.430 -4.516 -23.631 1.00 0.00 H new ATOM 0 HA GLU A 72 6.131 -2.596 -23.725 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.874 -3.133 -21.357 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.491 -2.605 -21.778 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.447 -0.801 -20.596 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.581 -0.313 -22.274 1.00 0.00 H new ATOM 1132 N THR A 73 7.416 -1.421 -25.519 1.00 0.00 N ATOM 1133 CA THR A 73 8.110 -0.530 -26.502 1.00 0.00 C ATOM 1134 C THR A 73 8.495 0.835 -25.843 1.00 0.00 C ATOM 1135 O THR A 73 7.653 1.692 -25.560 1.00 0.00 O ATOM 1136 CB THR A 73 7.241 -0.362 -27.787 1.00 0.00 C ATOM 1137 OG1 THR A 73 6.926 -1.636 -28.342 1.00 0.00 O ATOM 1138 CG2 THR A 73 7.924 0.417 -28.925 1.00 0.00 C ATOM 0 H THR A 73 6.429 -1.568 -25.728 1.00 0.00 H new ATOM 0 HA THR A 73 9.046 -0.996 -26.810 1.00 0.00 H new ATOM 0 HB THR A 73 6.368 0.193 -27.445 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.379 -1.516 -29.146 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.247 0.485 -29.777 1.00 0.00 H new ATOM 0 HG22 THR A 73 8.175 1.420 -28.580 1.00 0.00 H new ATOM 0 HG23 THR A 73 8.835 -0.101 -29.225 1.00 0.00 H new ATOM 1146 N THR A 74 9.799 0.992 -25.589 1.00 0.00 N ATOM 1147 CA THR A 74 10.358 2.160 -24.846 1.00 0.00 C ATOM 1148 C THR A 74 10.489 3.454 -25.723 1.00 0.00 C ATOM 1149 O THR A 74 10.368 3.424 -26.952 1.00 0.00 O ATOM 1150 CB THR A 74 11.737 1.743 -24.228 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.629 1.296 -25.243 1.00 0.00 O ATOM 1152 CG2 THR A 74 11.676 0.655 -23.142 1.00 0.00 C ATOM 0 H THR A 74 10.508 0.321 -25.886 1.00 0.00 H new ATOM 0 HA THR A 74 9.656 2.426 -24.056 1.00 0.00 H new ATOM 0 HB THR A 74 12.090 2.654 -23.744 1.00 0.00 H new ATOM 0 HG1 THR A 74 12.360 0.403 -25.545 1.00 0.00 H new ATOM 0 HG21 THR A 74 12.683 0.442 -22.783 1.00 0.00 H new ATOM 0 HG22 THR A 74 11.061 1.003 -22.312 1.00 0.00 H new ATOM 0 HG23 THR A 74 11.241 -0.253 -23.560 1.00 0.00 H new ATOM 1160 N ALA A 75 10.853 4.589 -25.093 1.00 0.00 N ATOM 1161 CA ALA A 75 11.264 5.829 -25.821 1.00 0.00 C ATOM 1162 C ALA A 75 12.536 5.787 -26.755 1.00 0.00 C ATOM 1163 O ALA A 75 12.898 6.813 -27.337 1.00 0.00 O ATOM 1164 CB ALA A 75 11.381 6.916 -24.733 1.00 0.00 C ATOM 0 H ALA A 75 10.874 4.683 -24.078 1.00 0.00 H new ATOM 0 HA ALA A 75 10.501 6.019 -26.576 1.00 0.00 H new ATOM 0 HB1 ALA A 75 11.680 7.859 -25.191 1.00 0.00 H new ATOM 0 HB2 ALA A 75 10.417 7.042 -24.239 1.00 0.00 H new ATOM 0 HB3 ALA A 75 12.128 6.616 -23.998 1.00 0.00 H new ATOM 1170 N ASP A 76 13.190 4.624 -26.936 1.00 0.00 N ATOM 1171 CA ASP A 76 14.091 4.347 -28.099 1.00 0.00 C ATOM 1172 C ASP A 76 13.547 3.312 -29.154 1.00 0.00 C ATOM 1173 O ASP A 76 14.234 3.088 -30.154 1.00 0.00 O ATOM 1174 CB ASP A 76 15.470 3.897 -27.540 1.00 0.00 C ATOM 1175 CG ASP A 76 16.274 5.040 -26.933 1.00 0.00 C ATOM 1176 OD1 ASP A 76 16.964 5.811 -27.593 1.00 0.00 O ATOM 1177 OD2 ASP A 76 16.120 5.126 -25.583 1.00 0.00 O ATOM 0 H ASP A 76 13.116 3.841 -26.286 1.00 0.00 H new ATOM 0 HA ASP A 76 14.164 5.274 -28.667 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.314 3.129 -26.783 1.00 0.00 H new ATOM 0 HB3 ASP A 76 16.049 3.441 -28.343 1.00 0.00 H new ATOM 1183 N ASP A 77 12.341 2.716 -28.999 1.00 0.00 N ATOM 1184 CA ASP A 77 11.791 1.613 -29.868 1.00 0.00 C ATOM 1185 C ASP A 77 12.139 0.138 -29.445 1.00 0.00 C ATOM 1186 O ASP A 77 11.594 -0.800 -30.035 1.00 0.00 O ATOM 1187 CB ASP A 77 11.936 1.783 -31.414 1.00 0.00 C ATOM 1188 CG ASP A 77 11.489 3.115 -32.008 1.00 0.00 C ATOM 1189 OD1 ASP A 77 10.375 3.307 -32.484 1.00 0.00 O ATOM 1190 OD2 ASP A 77 12.483 4.050 -31.954 1.00 0.00 O ATOM 0 H ASP A 77 11.698 2.984 -28.254 1.00 0.00 H new ATOM 0 HA ASP A 77 10.735 1.764 -29.643 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.983 1.630 -31.675 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.367 0.988 -31.897 1.00 0.00 H new ATOM 1196 N ARG A 78 12.985 -0.102 -28.422 1.00 0.00 N ATOM 1197 CA ARG A 78 13.289 -1.472 -27.919 1.00 0.00 C ATOM 1198 C ARG A 78 12.114 -2.009 -27.041 1.00 0.00 C ATOM 1199 O ARG A 78 11.729 -1.354 -26.060 1.00 0.00 O ATOM 1200 CB ARG A 78 14.683 -1.517 -27.216 1.00 0.00 C ATOM 1201 CG ARG A 78 14.906 -0.623 -25.966 1.00 0.00 C ATOM 1202 CD ARG A 78 16.242 -0.840 -25.210 1.00 0.00 C ATOM 1203 NE ARG A 78 17.144 0.350 -25.174 1.00 0.00 N ATOM 1204 CZ ARG A 78 16.910 1.492 -24.530 1.00 0.00 C ATOM 1205 NH1 ARG A 78 15.861 1.700 -23.771 1.00 0.00 N ATOM 1206 NH2 ARG A 78 17.769 2.455 -24.670 1.00 0.00 N ATOM 0 H ARG A 78 13.477 0.637 -27.920 1.00 0.00 H new ATOM 0 HA ARG A 78 13.369 -2.156 -28.764 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.875 -2.550 -26.925 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.437 -1.249 -27.956 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.851 0.421 -26.275 1.00 0.00 H new ATOM 0 HG3 ARG A 78 14.085 -0.793 -25.270 1.00 0.00 H new ATOM 0 HD2 ARG A 78 16.019 -1.140 -24.186 1.00 0.00 H new ATOM 0 HD3 ARG A 78 16.776 -1.669 -25.676 1.00 0.00 H new ATOM 0 HE ARG A 78 18.021 0.282 -25.691 1.00 0.00 H new ATOM 0 HH11 ARG A 78 15.167 0.963 -23.648 1.00 0.00 H new ATOM 0 HH12 ARG A 78 15.739 2.599 -23.304 1.00 0.00 H new ATOM 0 HH21 ARG A 78 18.591 2.323 -25.259 1.00 0.00 H new ATOM 0 HH22 ARG A 78 17.622 3.344 -24.191 1.00 0.00 H new ATOM 1220 N ASN A 79 11.534 -3.169 -27.420 1.00 0.00 N ATOM 1221 CA ASN A 79 10.404 -3.787 -26.673 1.00 0.00 C ATOM 1222 C ASN A 79 10.916 -4.783 -25.583 1.00 0.00 C ATOM 1223 O ASN A 79 11.271 -5.930 -25.875 1.00 0.00 O ATOM 1224 CB ASN A 79 9.281 -4.286 -27.626 1.00 0.00 C ATOM 1225 CG ASN A 79 9.437 -5.648 -28.309 1.00 0.00 C ATOM 1226 OD1 ASN A 79 9.009 -6.675 -27.790 1.00 0.00 O ATOM 1227 ND2 ASN A 79 10.016 -5.707 -29.483 1.00 0.00 N ATOM 0 H ASN A 79 11.827 -3.701 -28.240 1.00 0.00 H new ATOM 0 HA ASN A 79 9.892 -3.024 -26.087 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.352 -4.308 -27.056 1.00 0.00 H new ATOM 0 HB3 ASN A 79 9.157 -3.538 -28.409 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.109 -6.603 -29.961 1.00 0.00 H new ATOM 0 HD22 ASN A 79 10.373 -4.857 -29.919 1.00 0.00 H new ATOM 1234 N CYS A 80 11.007 -4.315 -24.328 1.00 0.00 N ATOM 1235 CA CYS A 80 11.697 -5.063 -23.252 1.00 0.00 C ATOM 1236 C CYS A 80 10.726 -5.953 -22.422 1.00 0.00 C ATOM 1237 O CYS A 80 9.684 -5.494 -21.936 1.00 0.00 O ATOM 1238 CB CYS A 80 12.437 -4.052 -22.361 1.00 0.00 C ATOM 1239 SG CYS A 80 13.674 -3.097 -23.304 1.00 0.00 S ATOM 0 H CYS A 80 10.613 -3.423 -24.028 1.00 0.00 H new ATOM 0 HA CYS A 80 12.408 -5.754 -23.704 1.00 0.00 H new ATOM 0 HB2 CYS A 80 11.717 -3.369 -21.910 1.00 0.00 H new ATOM 0 HB3 CYS A 80 12.930 -4.580 -21.545 1.00 0.00 H new ATOM 0 HG CYS A 80 14.869 -3.478 -22.963 1.00 0.00 H new ATOM 1245 N LYS A 81 11.120 -7.221 -22.229 1.00 0.00 N ATOM 1246 CA LYS A 81 10.376 -8.222 -21.419 1.00 0.00 C ATOM 1247 C LYS A 81 10.459 -7.842 -19.907 1.00 0.00 C ATOM 1248 O LYS A 81 11.505 -7.971 -19.262 1.00 0.00 O ATOM 1249 CB LYS A 81 10.981 -9.626 -21.723 1.00 0.00 C ATOM 1250 CG LYS A 81 10.486 -10.366 -22.993 1.00 0.00 C ATOM 1251 CD LYS A 81 10.748 -9.695 -24.360 1.00 0.00 C ATOM 1252 CE LYS A 81 12.226 -9.639 -24.783 1.00 0.00 C ATOM 1253 NZ LYS A 81 12.387 -8.781 -25.974 1.00 0.00 N ATOM 0 H LYS A 81 11.978 -7.595 -22.635 1.00 0.00 H new ATOM 0 HA LYS A 81 9.317 -8.240 -21.676 1.00 0.00 H new ATOM 0 HB2 LYS A 81 12.063 -9.515 -21.800 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.786 -10.268 -20.864 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.949 -11.353 -23.009 1.00 0.00 H new ATOM 0 HG3 LYS A 81 9.411 -10.520 -22.895 1.00 0.00 H new ATOM 0 HD2 LYS A 81 10.187 -10.232 -25.125 1.00 0.00 H new ATOM 0 HD3 LYS A 81 10.355 -8.679 -24.330 1.00 0.00 H new ATOM 0 HE2 LYS A 81 12.831 -9.252 -23.963 1.00 0.00 H new ATOM 0 HE3 LYS A 81 12.588 -10.644 -24.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 13.399 -8.656 -26.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 11.922 -9.229 -26.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 11.953 -7.853 -25.795 1.00 0.00 H new ATOM 1266 N SER A 82 9.368 -7.263 -19.392 1.00 0.00 N ATOM 1267 CA SER A 82 9.410 -6.414 -18.178 1.00 0.00 C ATOM 1268 C SER A 82 8.707 -7.100 -16.976 1.00 0.00 C ATOM 1269 O SER A 82 7.530 -7.458 -17.062 1.00 0.00 O ATOM 1270 CB SER A 82 8.740 -5.067 -18.530 1.00 0.00 C ATOM 1271 OG SER A 82 9.455 -4.334 -19.530 1.00 0.00 O ATOM 0 H SER A 82 8.436 -7.363 -19.794 1.00 0.00 H new ATOM 0 HA SER A 82 10.443 -6.253 -17.870 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.724 -5.252 -18.879 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.661 -4.460 -17.628 1.00 0.00 H new ATOM 0 HG SER A 82 9.290 -4.734 -20.409 1.00 0.00 H new ATOM 1277 N VAL A 83 9.434 -7.273 -15.860 1.00 0.00 N ATOM 1278 CA VAL A 83 8.919 -7.985 -14.650 1.00 0.00 C ATOM 1279 C VAL A 83 9.025 -7.007 -13.435 1.00 0.00 C ATOM 1280 O VAL A 83 10.134 -6.682 -12.998 1.00 0.00 O ATOM 1281 CB VAL A 83 9.706 -9.326 -14.404 1.00 0.00 C ATOM 1282 CG1 VAL A 83 9.213 -10.107 -13.162 1.00 0.00 C ATOM 1283 CG2 VAL A 83 9.665 -10.324 -15.584 1.00 0.00 C ATOM 0 H VAL A 83 10.390 -6.931 -15.758 1.00 0.00 H new ATOM 0 HA VAL A 83 7.877 -8.271 -14.792 1.00 0.00 H new ATOM 0 HB VAL A 83 10.725 -8.966 -14.263 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.798 -11.020 -13.051 1.00 0.00 H new ATOM 0 HG12 VAL A 83 9.333 -9.489 -12.272 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.161 -10.363 -13.287 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.233 -11.217 -15.325 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.631 -10.599 -15.792 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.102 -9.860 -16.468 1.00 0.00 H new ATOM 1293 N VAL A 84 7.891 -6.562 -12.859 1.00 0.00 N ATOM 1294 CA VAL A 84 7.902 -5.638 -11.678 1.00 0.00 C ATOM 1295 C VAL A 84 7.673 -6.453 -10.360 1.00 0.00 C ATOM 1296 O VAL A 84 6.601 -7.039 -10.168 1.00 0.00 O ATOM 1297 CB VAL A 84 6.906 -4.435 -11.813 1.00 0.00 C ATOM 1298 CG1 VAL A 84 7.159 -3.364 -10.723 1.00 0.00 C ATOM 1299 CG2 VAL A 84 6.929 -3.686 -13.166 1.00 0.00 C ATOM 0 H VAL A 84 6.957 -6.817 -13.179 1.00 0.00 H new ATOM 0 HA VAL A 84 8.889 -5.176 -11.638 1.00 0.00 H new ATOM 0 HB VAL A 84 5.936 -4.922 -11.712 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.451 -2.545 -10.847 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.029 -3.810 -9.737 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.176 -2.982 -10.817 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.201 -2.875 -13.145 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.924 -3.276 -13.338 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.678 -4.378 -13.970 1.00 0.00 H new ATOM 1309 N SER A 85 8.664 -6.460 -9.449 1.00 0.00 N ATOM 1310 CA SER A 85 8.570 -7.174 -8.143 1.00 0.00 C ATOM 1311 C SER A 85 8.532 -6.191 -6.931 1.00 0.00 C ATOM 1312 O SER A 85 9.365 -5.286 -6.809 1.00 0.00 O ATOM 1313 CB SER A 85 9.773 -8.135 -8.043 1.00 0.00 C ATOM 1314 OG SER A 85 9.680 -8.966 -6.885 1.00 0.00 O ATOM 0 H SER A 85 9.551 -5.976 -9.588 1.00 0.00 H new ATOM 0 HA SER A 85 7.633 -7.730 -8.104 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.819 -8.757 -8.937 1.00 0.00 H new ATOM 0 HB3 SER A 85 10.698 -7.560 -8.007 1.00 0.00 H new ATOM 0 HG SER A 85 10.455 -9.565 -6.849 1.00 0.00 H new ATOM 1320 N LEU A 86 7.576 -6.403 -6.013 1.00 0.00 N ATOM 1321 CA LEU A 86 7.449 -5.605 -4.761 1.00 0.00 C ATOM 1322 C LEU A 86 8.246 -6.284 -3.599 1.00 0.00 C ATOM 1323 O LEU A 86 7.769 -7.236 -2.971 1.00 0.00 O ATOM 1324 CB LEU A 86 5.929 -5.440 -4.451 1.00 0.00 C ATOM 1325 CG LEU A 86 5.481 -4.198 -3.636 1.00 0.00 C ATOM 1326 CD1 LEU A 86 3.966 -4.276 -3.377 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.197 -4.003 -2.290 1.00 0.00 C ATOM 0 H LEU A 86 6.865 -7.129 -6.108 1.00 0.00 H new ATOM 0 HA LEU A 86 7.885 -4.613 -4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.394 -5.426 -5.401 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.600 -6.329 -3.913 1.00 0.00 H new ATOM 0 HG LEU A 86 5.753 -3.340 -4.251 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.649 -3.404 -2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.435 -4.298 -4.329 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.739 -5.182 -2.814 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.812 -3.109 -1.799 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.019 -4.870 -1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.268 -3.891 -2.460 1.00 0.00 H new ATOM 1339 N ASP A 87 9.456 -5.782 -3.296 1.00 0.00 N ATOM 1340 CA ASP A 87 10.269 -6.285 -2.152 1.00 0.00 C ATOM 1341 C ASP A 87 10.001 -5.415 -0.877 1.00 0.00 C ATOM 1342 O ASP A 87 10.720 -4.453 -0.591 1.00 0.00 O ATOM 1343 CB ASP A 87 11.742 -6.352 -2.642 1.00 0.00 C ATOM 1344 CG ASP A 87 12.703 -7.054 -1.682 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.373 -6.461 -0.843 1.00 0.00 O ATOM 1346 OD2 ASP A 87 12.725 -8.408 -1.868 1.00 0.00 O ATOM 0 H ASP A 87 9.900 -5.029 -3.821 1.00 0.00 H new ATOM 0 HA ASP A 87 9.995 -7.291 -1.834 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.768 -6.867 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.100 -5.337 -2.815 1.00 0.00 H new ATOM 1352 N GLY A 88 8.927 -5.736 -0.127 1.00 0.00 N ATOM 1353 CA GLY A 88 8.544 -4.981 1.103 1.00 0.00 C ATOM 1354 C GLY A 88 7.875 -3.610 0.858 1.00 0.00 C ATOM 1355 O GLY A 88 6.648 -3.496 0.864 1.00 0.00 O ATOM 0 H GLY A 88 8.303 -6.513 -0.345 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.864 -5.598 1.691 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.438 -4.827 1.707 1.00 0.00 H new ATOM 1359 N ASP A 89 8.693 -2.574 0.616 1.00 0.00 N ATOM 1360 CA ASP A 89 8.209 -1.312 -0.020 1.00 0.00 C ATOM 1361 C ASP A 89 9.225 -0.750 -1.077 1.00 0.00 C ATOM 1362 O ASP A 89 9.593 0.430 -1.057 1.00 0.00 O ATOM 1363 CB ASP A 89 7.790 -0.309 1.094 1.00 0.00 C ATOM 1364 CG ASP A 89 6.788 0.744 0.622 1.00 0.00 C ATOM 1365 OD1 ASP A 89 7.100 1.877 0.268 1.00 0.00 O ATOM 1366 OD2 ASP A 89 5.509 0.262 0.631 1.00 0.00 O ATOM 0 H ASP A 89 9.687 -2.572 0.844 1.00 0.00 H new ATOM 0 HA ASP A 89 7.318 -1.512 -0.615 1.00 0.00 H new ATOM 0 HB2 ASP A 89 7.357 -0.863 1.927 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.680 0.193 1.474 1.00 0.00 H new ATOM 1372 N LYS A 90 9.622 -1.591 -2.053 1.00 0.00 N ATOM 1373 CA LYS A 90 10.381 -1.152 -3.251 1.00 0.00 C ATOM 1374 C LYS A 90 9.911 -1.940 -4.514 1.00 0.00 C ATOM 1375 O LYS A 90 9.977 -3.174 -4.553 1.00 0.00 O ATOM 1376 CB LYS A 90 11.915 -1.128 -3.014 1.00 0.00 C ATOM 1377 CG LYS A 90 12.647 -2.471 -2.813 1.00 0.00 C ATOM 1378 CD LYS A 90 14.139 -2.263 -2.499 1.00 0.00 C ATOM 1379 CE LYS A 90 14.906 -3.589 -2.432 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.328 -3.318 -2.155 1.00 0.00 N ATOM 0 H LYS A 90 9.428 -2.592 -2.037 1.00 0.00 H new ATOM 0 HA LYS A 90 10.147 -0.107 -3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.374 -0.623 -3.864 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.106 -0.511 -2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.177 -3.024 -1.999 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.545 -3.079 -3.712 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.584 -1.626 -3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.239 -1.739 -1.549 1.00 0.00 H new ATOM 0 HE2 LYS A 90 14.487 -4.225 -1.652 1.00 0.00 H new ATOM 0 HE3 LYS A 90 14.804 -4.129 -3.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.850 -4.216 -2.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.723 -2.726 -2.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.416 -2.820 -1.246 1.00 0.00 H new ATOM 1393 N LEU A 91 9.428 -1.221 -5.544 1.00 0.00 N ATOM 1394 CA LEU A 91 9.006 -1.835 -6.835 1.00 0.00 C ATOM 1395 C LEU A 91 10.216 -1.904 -7.817 1.00 0.00 C ATOM 1396 O LEU A 91 10.657 -0.890 -8.368 1.00 0.00 O ATOM 1397 CB LEU A 91 7.809 -1.046 -7.441 1.00 0.00 C ATOM 1398 CG LEU A 91 6.423 -1.255 -6.783 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.454 -0.158 -7.254 1.00 0.00 C ATOM 1400 CD2 LEU A 91 5.819 -2.631 -7.116 1.00 0.00 C ATOM 0 H LEU A 91 9.316 -0.208 -5.515 1.00 0.00 H new ATOM 0 HA LEU A 91 8.668 -2.856 -6.657 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.047 0.017 -7.398 1.00 0.00 H new ATOM 0 HB3 LEU A 91 7.727 -1.312 -8.495 1.00 0.00 H new ATOM 0 HG LEU A 91 6.568 -1.203 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.480 -0.309 -6.789 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.845 0.819 -6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.350 -0.206 -8.338 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.848 -2.729 -6.631 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.697 -2.723 -8.195 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.484 -3.417 -6.758 1.00 0.00 H new ATOM 1412 N VAL A 92 10.747 -3.116 -8.030 1.00 0.00 N ATOM 1413 CA VAL A 92 11.952 -3.348 -8.880 1.00 0.00 C ATOM 1414 C VAL A 92 11.449 -3.764 -10.298 1.00 0.00 C ATOM 1415 O VAL A 92 11.067 -4.917 -10.526 1.00 0.00 O ATOM 1416 CB VAL A 92 12.914 -4.387 -8.202 1.00 0.00 C ATOM 1417 CG1 VAL A 92 14.203 -4.614 -9.025 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.356 -4.010 -6.765 1.00 0.00 C ATOM 0 H VAL A 92 10.364 -3.970 -7.625 1.00 0.00 H new ATOM 0 HA VAL A 92 12.555 -2.446 -8.988 1.00 0.00 H new ATOM 0 HB VAL A 92 12.309 -5.293 -8.158 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.837 -5.340 -8.516 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.942 -4.991 -10.014 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.741 -3.671 -9.126 1.00 0.00 H new ATOM 0 HG21 VAL A 92 14.018 -4.782 -6.374 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.883 -3.056 -6.785 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.478 -3.926 -6.125 1.00 0.00 H new ATOM 1428 N HIS A 93 11.447 -2.804 -11.239 1.00 0.00 N ATOM 1429 CA HIS A 93 11.019 -3.035 -12.647 1.00 0.00 C ATOM 1430 C HIS A 93 12.213 -3.576 -13.491 1.00 0.00 C ATOM 1431 O HIS A 93 13.094 -2.816 -13.894 1.00 0.00 O ATOM 1432 CB HIS A 93 10.432 -1.683 -13.135 1.00 0.00 C ATOM 1433 CG HIS A 93 9.879 -1.552 -14.558 1.00 0.00 C ATOM 1434 ND1 HIS A 93 9.788 -2.558 -15.514 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.443 -0.326 -15.091 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.322 -1.817 -16.568 1.00 0.00 C ATOM 1437 NE2 HIS A 93 9.108 -0.477 -16.424 1.00 0.00 N ATOM 0 H HIS A 93 11.740 -1.845 -11.054 1.00 0.00 H new ATOM 0 HA HIS A 93 10.254 -3.805 -12.748 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.628 -1.413 -12.450 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.213 -0.932 -13.021 1.00 0.00 H new ATOM 0 HD2 HIS A 93 9.379 0.600 -14.539 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.123 -2.295 -17.516 1.00 0.00 H new ATOM 0 HE2 HIS A 93 8.792 0.214 -17.104 1.00 0.00 H new ATOM 1445 N ILE A 94 12.234 -4.893 -13.733 1.00 0.00 N ATOM 1446 CA ILE A 94 13.348 -5.595 -14.437 1.00 0.00 C ATOM 1447 C ILE A 94 13.030 -5.617 -15.966 1.00 0.00 C ATOM 1448 O ILE A 94 12.138 -6.358 -16.379 1.00 0.00 O ATOM 1449 CB ILE A 94 13.516 -7.041 -13.833 1.00 0.00 C ATOM 1450 CG1 ILE A 94 13.905 -7.067 -12.323 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.528 -7.895 -14.637 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.579 -8.385 -11.596 1.00 0.00 C ATOM 0 H ILE A 94 11.479 -5.518 -13.449 1.00 0.00 H new ATOM 0 HA ILE A 94 14.296 -5.076 -14.297 1.00 0.00 H new ATOM 0 HB ILE A 94 12.521 -7.478 -13.916 1.00 0.00 H new ATOM 0 HG12 ILE A 94 14.974 -6.874 -12.234 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.390 -6.251 -11.815 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.611 -8.883 -14.184 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.183 -7.995 -15.666 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.503 -7.408 -14.627 1.00 0.00 H new ATOM 0 HD11 ILE A 94 13.884 -8.310 -10.552 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.507 -8.573 -11.648 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.115 -9.206 -12.073 1.00 0.00 H new ATOM 1464 N GLN A 95 13.775 -4.870 -16.799 1.00 0.00 N ATOM 1465 CA GLN A 95 13.564 -4.852 -18.273 1.00 0.00 C ATOM 1466 C GLN A 95 14.648 -5.711 -18.998 1.00 0.00 C ATOM 1467 O GLN A 95 15.841 -5.409 -18.926 1.00 0.00 O ATOM 1468 CB GLN A 95 13.545 -3.378 -18.763 1.00 0.00 C ATOM 1469 CG GLN A 95 12.284 -2.572 -18.346 1.00 0.00 C ATOM 1470 CD GLN A 95 11.884 -1.454 -19.317 1.00 0.00 C ATOM 1471 OE1 GLN A 95 12.583 -0.466 -19.518 1.00 0.00 O ATOM 1472 NE2 GLN A 95 10.751 -1.578 -19.966 1.00 0.00 N ATOM 0 H GLN A 95 14.534 -4.266 -16.483 1.00 0.00 H new ATOM 0 HA GLN A 95 12.603 -5.303 -18.518 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.429 -2.870 -18.377 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.622 -3.370 -19.850 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.446 -3.262 -18.244 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.458 -2.135 -17.363 1.00 0.00 H new ATOM 0 HE21 GLN A 95 10.160 -2.394 -19.809 1.00 0.00 H new ATOM 0 HE22 GLN A 95 10.461 -0.858 -20.628 1.00 0.00 H new ATOM 1481 N LYS A 96 14.214 -6.769 -19.704 1.00 0.00 N ATOM 1482 CA LYS A 96 15.111 -7.724 -20.423 1.00 0.00 C ATOM 1483 C LYS A 96 14.997 -7.550 -21.972 1.00 0.00 C ATOM 1484 O LYS A 96 13.891 -7.563 -22.520 1.00 0.00 O ATOM 1485 CB LYS A 96 14.664 -9.161 -20.024 1.00 0.00 C ATOM 1486 CG LYS A 96 15.069 -9.624 -18.606 1.00 0.00 C ATOM 1487 CD LYS A 96 14.308 -10.896 -18.188 1.00 0.00 C ATOM 1488 CE LYS A 96 14.737 -11.411 -16.808 1.00 0.00 C ATOM 1489 NZ LYS A 96 13.894 -12.560 -16.423 1.00 0.00 N ATOM 0 H LYS A 96 13.225 -6.998 -19.800 1.00 0.00 H new ATOM 0 HA LYS A 96 16.149 -7.537 -20.149 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.579 -9.220 -20.108 1.00 0.00 H new ATOM 0 HB3 LYS A 96 15.078 -9.864 -20.747 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.142 -9.815 -18.577 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.868 -8.827 -17.891 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.238 -10.688 -18.178 1.00 0.00 H new ATOM 0 HD3 LYS A 96 14.475 -11.676 -18.931 1.00 0.00 H new ATOM 0 HE2 LYS A 96 15.786 -11.708 -16.829 1.00 0.00 H new ATOM 0 HE3 LYS A 96 14.646 -10.616 -16.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.187 -12.907 -15.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.898 -12.263 -16.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.003 -13.321 -17.124 1.00 0.00 H new ATOM 1502 N TRP A 97 16.120 -7.418 -22.701 1.00 0.00 N ATOM 1503 CA TRP A 97 16.107 -7.307 -24.193 1.00 0.00 C ATOM 1504 C TRP A 97 17.438 -7.858 -24.797 1.00 0.00 C ATOM 1505 O TRP A 97 18.520 -7.371 -24.464 1.00 0.00 O ATOM 1506 CB TRP A 97 15.761 -5.857 -24.666 1.00 0.00 C ATOM 1507 CG TRP A 97 16.845 -4.773 -24.509 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.737 -4.372 -25.526 1.00 0.00 C ATOM 1509 CD2 TRP A 97 17.283 -4.138 -23.361 1.00 0.00 C ATOM 1510 NE1 TRP A 97 18.722 -3.486 -25.042 1.00 0.00 N ATOM 1511 CE2 TRP A 97 18.431 -3.372 -23.692 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.864 -4.252 -22.012 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 19.178 -2.739 -22.671 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.611 -3.615 -21.026 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.756 -2.883 -21.348 1.00 0.00 C ATOM 0 H TRP A 97 17.054 -7.384 -22.292 1.00 0.00 H new ATOM 0 HA TRP A 97 15.304 -7.935 -24.580 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.485 -5.905 -25.719 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.877 -5.528 -24.120 1.00 0.00 H new ATOM 0 HD1 TRP A 97 17.673 -4.704 -26.552 1.00 0.00 H new ATOM 0 HE1 TRP A 97 19.473 -3.035 -25.564 1.00 0.00 H new ATOM 0 HE3 TRP A 97 15.983 -4.821 -21.755 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 20.056 -2.157 -22.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.300 -3.688 -19.994 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.327 -2.419 -20.557 1.00 0.00 H new ATOM 1526 N ASP A 98 17.381 -8.852 -25.707 1.00 0.00 N ATOM 1527 CA ASP A 98 18.589 -9.374 -26.441 1.00 0.00 C ATOM 1528 C ASP A 98 19.814 -9.860 -25.568 1.00 0.00 C ATOM 1529 O ASP A 98 20.973 -9.630 -25.929 1.00 0.00 O ATOM 1530 CB ASP A 98 19.011 -8.347 -27.544 1.00 0.00 C ATOM 1531 CG ASP A 98 18.008 -8.062 -28.667 1.00 0.00 C ATOM 1532 OD1 ASP A 98 16.995 -8.727 -28.875 1.00 0.00 O ATOM 1533 OD2 ASP A 98 18.380 -6.979 -29.410 1.00 0.00 O ATOM 0 H ASP A 98 16.513 -9.322 -25.964 1.00 0.00 H new ATOM 0 HA ASP A 98 18.262 -10.311 -26.892 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.243 -7.402 -27.053 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.934 -8.704 -28.000 1.00 0.00 H new ATOM 1539 N GLY A 99 19.573 -10.499 -24.405 1.00 0.00 N ATOM 1540 CA GLY A 99 20.639 -10.692 -23.373 1.00 0.00 C ATOM 1541 C GLY A 99 20.933 -9.535 -22.375 1.00 0.00 C ATOM 1542 O GLY A 99 21.429 -9.800 -21.279 1.00 0.00 O ATOM 0 H GLY A 99 18.666 -10.889 -24.149 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.377 -11.574 -22.788 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.567 -10.921 -23.896 1.00 0.00 H new ATOM 1546 N LYS A 100 20.669 -8.271 -22.744 1.00 0.00 N ATOM 1547 CA LYS A 100 20.915 -7.083 -21.885 1.00 0.00 C ATOM 1548 C LYS A 100 19.757 -6.846 -20.860 1.00 0.00 C ATOM 1549 O LYS A 100 18.575 -7.046 -21.165 1.00 0.00 O ATOM 1550 CB LYS A 100 21.069 -5.844 -22.808 1.00 0.00 C ATOM 1551 CG LYS A 100 22.291 -5.812 -23.749 1.00 0.00 C ATOM 1552 CD LYS A 100 22.415 -4.424 -24.408 1.00 0.00 C ATOM 1553 CE LYS A 100 23.637 -4.224 -25.307 1.00 0.00 C ATOM 1554 NZ LYS A 100 24.905 -4.155 -24.552 1.00 0.00 N ATOM 0 H LYS A 100 20.275 -8.034 -23.654 1.00 0.00 H new ATOM 0 HA LYS A 100 21.821 -7.252 -21.304 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.170 -5.765 -23.419 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.105 -4.956 -22.177 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.198 -6.039 -23.188 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.189 -6.580 -24.516 1.00 0.00 H new ATOM 0 HD2 LYS A 100 21.518 -4.241 -24.999 1.00 0.00 H new ATOM 0 HD3 LYS A 100 22.438 -3.669 -23.622 1.00 0.00 H new ATOM 0 HE2 LYS A 100 23.692 -5.043 -26.024 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.512 -3.306 -25.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.696 -4.019 -25.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.870 -3.357 -23.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 25.043 -5.040 -24.024 1.00 0.00 H new ATOM 1567 N GLU A 101 20.111 -6.404 -19.639 1.00 0.00 N ATOM 1568 CA GLU A 101 19.130 -6.201 -18.539 1.00 0.00 C ATOM 1569 C GLU A 101 19.422 -4.888 -17.745 1.00 0.00 C ATOM 1570 O GLU A 101 20.534 -4.671 -17.253 1.00 0.00 O ATOM 1571 CB GLU A 101 19.130 -7.450 -17.615 1.00 0.00 C ATOM 1572 CG GLU A 101 17.931 -7.509 -16.633 1.00 0.00 C ATOM 1573 CD GLU A 101 17.987 -8.672 -15.650 1.00 0.00 C ATOM 1574 OE1 GLU A 101 18.215 -8.541 -14.452 1.00 0.00 O ATOM 1575 OE2 GLU A 101 17.737 -9.871 -16.244 1.00 0.00 O ATOM 0 H GLU A 101 21.072 -6.178 -19.382 1.00 0.00 H new ATOM 0 HA GLU A 101 18.134 -6.084 -18.967 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.124 -8.347 -18.234 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.057 -7.465 -17.042 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.889 -6.575 -16.072 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.008 -7.578 -17.208 1.00 0.00 H new ATOM 1583 N THR A 102 18.385 -4.056 -17.567 1.00 0.00 N ATOM 1584 CA THR A 102 18.369 -2.976 -16.536 1.00 0.00 C ATOM 1585 C THR A 102 17.267 -3.279 -15.471 1.00 0.00 C ATOM 1586 O THR A 102 16.228 -3.874 -15.787 1.00 0.00 O ATOM 1587 CB THR A 102 18.220 -1.562 -17.183 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.440 -0.576 -16.182 1.00 0.00 O ATOM 1589 CG2 THR A 102 16.870 -1.238 -17.844 1.00 0.00 C ATOM 0 H THR A 102 17.532 -4.102 -18.124 1.00 0.00 H new ATOM 0 HA THR A 102 19.330 -2.961 -16.022 1.00 0.00 H new ATOM 0 HB THR A 102 18.955 -1.561 -17.988 1.00 0.00 H new ATOM 0 HG1 THR A 102 18.619 0.288 -16.608 1.00 0.00 H new ATOM 0 HG21 THR A 102 16.898 -0.228 -18.253 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.678 -1.950 -18.647 1.00 0.00 H new ATOM 0 HG23 THR A 102 16.075 -1.306 -17.101 1.00 0.00 H new ATOM 1597 N ASN A 103 17.453 -2.827 -14.218 1.00 0.00 N ATOM 1598 CA ASN A 103 16.346 -2.794 -13.220 1.00 0.00 C ATOM 1599 C ASN A 103 16.171 -1.386 -12.564 1.00 0.00 C ATOM 1600 O ASN A 103 17.143 -0.714 -12.202 1.00 0.00 O ATOM 1601 CB ASN A 103 16.383 -4.013 -12.260 1.00 0.00 C ATOM 1602 CG ASN A 103 17.512 -4.106 -11.235 1.00 0.00 C ATOM 1603 OD1 ASN A 103 17.453 -3.531 -10.155 1.00 0.00 O ATOM 1604 ND2 ASN A 103 18.548 -4.861 -11.511 1.00 0.00 N ATOM 0 H ASN A 103 18.346 -2.481 -13.866 1.00 0.00 H new ATOM 0 HA ASN A 103 15.404 -2.928 -13.751 1.00 0.00 H new ATOM 0 HB2 ASN A 103 15.439 -4.033 -11.715 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.417 -4.914 -12.872 1.00 0.00 H new ATOM 0 HD21 ASN A 103 19.298 -4.967 -10.828 1.00 0.00 H new ATOM 0 HD22 ASN A 103 18.603 -5.343 -12.408 1.00 0.00 H new ATOM 1611 N PHE A 104 14.906 -0.937 -12.444 1.00 0.00 N ATOM 1612 CA PHE A 104 14.567 0.414 -11.923 1.00 0.00 C ATOM 1613 C PHE A 104 14.027 0.200 -10.477 1.00 0.00 C ATOM 1614 O PHE A 104 12.875 -0.214 -10.289 1.00 0.00 O ATOM 1615 CB PHE A 104 13.521 1.155 -12.818 1.00 0.00 C ATOM 1616 CG PHE A 104 13.797 1.411 -14.319 1.00 0.00 C ATOM 1617 CD1 PHE A 104 13.814 0.354 -15.239 1.00 0.00 C ATOM 1618 CD2 PHE A 104 13.880 2.723 -14.800 1.00 0.00 C ATOM 1619 CE1 PHE A 104 13.950 0.601 -16.601 1.00 0.00 C ATOM 1620 CE2 PHE A 104 14.001 2.969 -16.168 1.00 0.00 C ATOM 1621 CZ PHE A 104 14.048 1.908 -17.067 1.00 0.00 C ATOM 0 H PHE A 104 14.090 -1.492 -12.702 1.00 0.00 H new ATOM 0 HA PHE A 104 15.449 1.054 -11.929 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.591 0.591 -12.756 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.336 2.125 -12.357 1.00 0.00 H new ATOM 0 HD1 PHE A 104 13.721 -0.663 -14.887 1.00 0.00 H new ATOM 0 HD2 PHE A 104 13.850 3.551 -14.107 1.00 0.00 H new ATOM 0 HE1 PHE A 104 13.980 -0.223 -17.298 1.00 0.00 H new ATOM 0 HE2 PHE A 104 14.058 3.985 -16.530 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.160 2.099 -18.124 1.00 0.00 H new ATOM 1631 N VAL A 105 14.868 0.446 -9.460 1.00 0.00 N ATOM 1632 CA VAL A 105 14.527 0.177 -8.032 1.00 0.00 C ATOM 1633 C VAL A 105 13.752 1.416 -7.476 1.00 0.00 C ATOM 1634 O VAL A 105 14.347 2.430 -7.100 1.00 0.00 O ATOM 1635 CB VAL A 105 15.818 -0.190 -7.219 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.553 -0.415 -5.712 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.568 -1.441 -7.736 1.00 0.00 C ATOM 0 H VAL A 105 15.802 0.835 -9.591 1.00 0.00 H new ATOM 0 HA VAL A 105 13.875 -0.691 -7.934 1.00 0.00 H new ATOM 0 HB VAL A 105 16.442 0.691 -7.369 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.488 -0.665 -5.211 1.00 0.00 H new ATOM 0 HG12 VAL A 105 15.140 0.494 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.844 -1.233 -5.585 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.446 -1.621 -7.116 1.00 0.00 H new ATOM 0 HG22 VAL A 105 15.907 -2.307 -7.689 1.00 0.00 H new ATOM 0 HG23 VAL A 105 16.879 -1.278 -8.768 1.00 0.00 H new ATOM 1647 N ARG A 106 12.416 1.324 -7.452 1.00 0.00 N ATOM 1648 CA ARG A 106 11.527 2.437 -7.035 1.00 0.00 C ATOM 1649 C ARG A 106 11.245 2.346 -5.508 1.00 0.00 C ATOM 1650 O ARG A 106 10.491 1.466 -5.092 1.00 0.00 O ATOM 1651 CB ARG A 106 10.236 2.255 -7.877 1.00 0.00 C ATOM 1652 CG ARG A 106 9.278 3.460 -7.952 1.00 0.00 C ATOM 1653 CD ARG A 106 7.896 3.124 -8.551 1.00 0.00 C ATOM 1654 NE ARG A 106 7.955 2.537 -9.926 1.00 0.00 N ATOM 1655 CZ ARG A 106 7.938 3.216 -11.071 1.00 0.00 C ATOM 1656 NH1 ARG A 106 7.832 4.517 -11.139 1.00 0.00 N ATOM 1657 NH2 ARG A 106 8.027 2.548 -12.185 1.00 0.00 N ATOM 0 H ARG A 106 11.912 0.479 -7.720 1.00 0.00 H new ATOM 0 HA ARG A 106 11.967 3.420 -7.203 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.528 1.990 -8.893 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.684 1.407 -7.472 1.00 0.00 H new ATOM 0 HG2 ARG A 106 9.140 3.865 -6.949 1.00 0.00 H new ATOM 0 HG3 ARG A 106 9.742 4.244 -8.551 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.385 2.424 -7.890 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.294 4.032 -8.580 1.00 0.00 H new ATOM 0 HE ARG A 106 8.014 1.521 -9.992 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.757 5.068 -10.284 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.825 4.981 -12.047 1.00 0.00 H new ATOM 0 HH21 ARG A 106 8.107 1.531 -12.165 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.017 3.041 -13.078 1.00 0.00 H new ATOM 1671 N GLU A 107 11.832 3.223 -4.680 1.00 0.00 N ATOM 1672 CA GLU A 107 11.699 3.148 -3.192 1.00 0.00 C ATOM 1673 C GLU A 107 11.140 4.469 -2.573 1.00 0.00 C ATOM 1674 O GLU A 107 11.530 5.570 -2.973 1.00 0.00 O ATOM 1675 CB GLU A 107 13.052 2.692 -2.571 1.00 0.00 C ATOM 1676 CG GLU A 107 14.257 3.664 -2.694 1.00 0.00 C ATOM 1677 CD GLU A 107 15.557 3.136 -2.098 1.00 0.00 C ATOM 1678 OE1 GLU A 107 16.484 2.697 -2.774 1.00 0.00 O ATOM 1679 OE2 GLU A 107 15.565 3.221 -0.735 1.00 0.00 O ATOM 0 H GLU A 107 12.408 4.000 -5.004 1.00 0.00 H new ATOM 0 HA GLU A 107 10.950 2.396 -2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.887 2.492 -1.512 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.333 1.746 -3.034 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.420 3.889 -3.748 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.002 4.603 -2.203 1.00 0.00 H new ATOM 1687 N ILE A 108 10.266 4.370 -1.553 1.00 0.00 N ATOM 1688 CA ILE A 108 9.795 5.564 -0.778 1.00 0.00 C ATOM 1689 C ILE A 108 10.895 5.974 0.263 1.00 0.00 C ATOM 1690 O ILE A 108 11.250 5.186 1.146 1.00 0.00 O ATOM 1691 CB ILE A 108 8.378 5.322 -0.140 1.00 0.00 C ATOM 1692 CG1 ILE A 108 7.246 4.997 -1.161 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.898 6.480 0.778 1.00 0.00 C ATOM 1694 CD1 ILE A 108 6.942 6.061 -2.235 1.00 0.00 C ATOM 0 H ILE A 108 9.866 3.486 -1.238 1.00 0.00 H new ATOM 0 HA ILE A 108 9.655 6.407 -1.454 1.00 0.00 H new ATOM 0 HB ILE A 108 8.551 4.432 0.465 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.505 4.068 -1.669 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.329 4.810 -0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.914 6.241 1.181 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.604 6.611 1.598 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.839 7.402 0.200 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.136 5.709 -2.878 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.641 6.990 -1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.834 6.237 -2.835 1.00 0.00 H new ATOM 1706 N LYS A 109 11.422 7.209 0.158 1.00 0.00 N ATOM 1707 CA LYS A 109 12.455 7.732 1.092 1.00 0.00 C ATOM 1708 C LYS A 109 12.116 9.206 1.476 1.00 0.00 C ATOM 1709 O LYS A 109 12.169 10.107 0.633 1.00 0.00 O ATOM 1710 CB LYS A 109 13.854 7.579 0.436 1.00 0.00 C ATOM 1711 CG LYS A 109 15.020 7.881 1.402 1.00 0.00 C ATOM 1712 CD LYS A 109 16.405 7.734 0.750 1.00 0.00 C ATOM 1713 CE LYS A 109 17.514 8.083 1.753 1.00 0.00 C ATOM 1714 NZ LYS A 109 18.840 7.934 1.126 1.00 0.00 N ATOM 0 H LYS A 109 11.151 7.872 -0.568 1.00 0.00 H new ATOM 0 HA LYS A 109 12.467 7.161 2.020 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.960 6.563 0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.920 8.248 -0.422 1.00 0.00 H new ATOM 0 HG2 LYS A 109 14.912 8.896 1.784 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.956 7.210 2.258 1.00 0.00 H new ATOM 0 HD2 LYS A 109 16.538 6.713 0.393 1.00 0.00 H new ATOM 0 HD3 LYS A 109 16.475 8.387 -0.120 1.00 0.00 H new ATOM 0 HE2 LYS A 109 17.385 9.106 2.106 1.00 0.00 H new ATOM 0 HE3 LYS A 109 17.442 7.433 2.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 19.580 8.174 1.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 18.966 6.951 0.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 18.911 8.572 0.308 1.00 0.00 H new ATOM 1727 N ASP A 110 11.775 9.443 2.761 1.00 0.00 N ATOM 1728 CA ASP A 110 11.430 10.795 3.314 1.00 0.00 C ATOM 1729 C ASP A 110 10.450 11.688 2.461 1.00 0.00 C ATOM 1730 O ASP A 110 10.789 12.808 2.068 1.00 0.00 O ATOM 1731 CB ASP A 110 12.765 11.479 3.737 1.00 0.00 C ATOM 1732 CG ASP A 110 12.612 12.683 4.668 1.00 0.00 C ATOM 1733 OD1 ASP A 110 11.994 12.652 5.727 1.00 0.00 O ATOM 1734 OD2 ASP A 110 13.245 13.791 4.194 1.00 0.00 O ATOM 0 H ASP A 110 11.727 8.702 3.460 1.00 0.00 H new ATOM 0 HA ASP A 110 10.794 10.652 4.187 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.395 10.738 4.228 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.292 11.799 2.838 1.00 0.00 H new ATOM 1740 N GLY A 111 9.249 11.169 2.137 1.00 0.00 N ATOM 1741 CA GLY A 111 8.339 11.833 1.156 1.00 0.00 C ATOM 1742 C GLY A 111 8.540 11.534 -0.354 1.00 0.00 C ATOM 1743 O GLY A 111 7.551 11.486 -1.089 1.00 0.00 O ATOM 0 H GLY A 111 8.881 10.303 2.530 1.00 0.00 H new ATOM 0 HA2 GLY A 111 7.316 11.561 1.415 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.428 12.910 1.296 1.00 0.00 H new ATOM 1747 N LYS A 112 9.788 11.377 -0.827 1.00 0.00 N ATOM 1748 CA LYS A 112 10.090 11.145 -2.262 1.00 0.00 C ATOM 1749 C LYS A 112 9.950 9.655 -2.708 1.00 0.00 C ATOM 1750 O LYS A 112 10.224 8.715 -1.957 1.00 0.00 O ATOM 1751 CB LYS A 112 11.544 11.604 -2.573 1.00 0.00 C ATOM 1752 CG LYS A 112 11.787 13.120 -2.701 1.00 0.00 C ATOM 1753 CD LYS A 112 13.258 13.425 -3.048 1.00 0.00 C ATOM 1754 CE LYS A 112 13.476 14.871 -3.514 1.00 0.00 C ATOM 1755 NZ LYS A 112 14.907 15.105 -3.787 1.00 0.00 N ATOM 0 H LYS A 112 10.617 11.406 -0.234 1.00 0.00 H new ATOM 0 HA LYS A 112 9.351 11.724 -2.816 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.195 11.222 -1.787 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.857 11.131 -3.504 1.00 0.00 H new ATOM 0 HG2 LYS A 112 11.136 13.531 -3.473 1.00 0.00 H new ATOM 0 HG3 LYS A 112 11.522 13.613 -1.766 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.879 13.233 -2.173 1.00 0.00 H new ATOM 0 HD3 LYS A 112 13.590 12.743 -3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.890 15.064 -4.413 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.125 15.564 -2.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 15.005 15.823 -4.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.375 15.440 -2.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.350 14.218 -4.099 1.00 0.00 H new ATOM 1768 N MET A 113 9.652 9.474 -4.004 1.00 0.00 N ATOM 1769 CA MET A 113 9.917 8.210 -4.728 1.00 0.00 C ATOM 1770 C MET A 113 11.329 8.293 -5.387 1.00 0.00 C ATOM 1771 O MET A 113 11.559 9.030 -6.351 1.00 0.00 O ATOM 1772 CB MET A 113 8.759 7.987 -5.730 1.00 0.00 C ATOM 1773 CG MET A 113 8.869 6.711 -6.578 1.00 0.00 C ATOM 1774 SD MET A 113 9.708 7.036 -8.142 1.00 0.00 S ATOM 1775 CE MET A 113 8.308 7.570 -9.144 1.00 0.00 C ATOM 0 H MET A 113 9.221 10.195 -4.583 1.00 0.00 H new ATOM 0 HA MET A 113 9.942 7.343 -4.068 1.00 0.00 H new ATOM 0 HB2 MET A 113 7.821 7.957 -5.176 1.00 0.00 H new ATOM 0 HB3 MET A 113 8.707 8.846 -6.399 1.00 0.00 H new ATOM 0 HG2 MET A 113 9.414 5.948 -6.022 1.00 0.00 H new ATOM 0 HG3 MET A 113 7.873 6.314 -6.773 1.00 0.00 H new ATOM 0 HE1 MET A 113 8.618 7.658 -10.185 1.00 0.00 H new ATOM 0 HE2 MET A 113 7.504 6.838 -9.066 1.00 0.00 H new ATOM 0 HE3 MET A 113 7.954 8.537 -8.788 1.00 0.00 H new ATOM 1785 N VAL A 114 12.279 7.526 -4.845 1.00 0.00 N ATOM 1786 CA VAL A 114 13.676 7.476 -5.354 1.00 0.00 C ATOM 1787 C VAL A 114 13.756 6.266 -6.338 1.00 0.00 C ATOM 1788 O VAL A 114 13.743 5.102 -5.924 1.00 0.00 O ATOM 1789 CB VAL A 114 14.672 7.429 -4.144 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.147 7.245 -4.559 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.621 8.706 -3.267 1.00 0.00 C ATOM 0 H VAL A 114 12.114 6.919 -4.042 1.00 0.00 H new ATOM 0 HA VAL A 114 13.967 8.366 -5.912 1.00 0.00 H new ATOM 0 HB VAL A 114 14.332 6.559 -3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 114 16.775 7.222 -3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.257 6.308 -5.105 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.452 8.075 -5.197 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.333 8.613 -2.447 1.00 0.00 H new ATOM 0 HG22 VAL A 114 14.878 9.574 -3.873 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.616 8.830 -2.863 1.00 0.00 H new ATOM 1801 N MET A 115 13.818 6.557 -7.648 1.00 0.00 N ATOM 1802 CA MET A 115 14.033 5.528 -8.697 1.00 0.00 C ATOM 1803 C MET A 115 15.564 5.351 -8.939 1.00 0.00 C ATOM 1804 O MET A 115 16.197 6.216 -9.548 1.00 0.00 O ATOM 1805 CB MET A 115 13.257 5.995 -9.958 1.00 0.00 C ATOM 1806 CG MET A 115 13.255 4.998 -11.136 1.00 0.00 C ATOM 1807 SD MET A 115 12.668 5.801 -12.643 1.00 0.00 S ATOM 1808 CE MET A 115 10.885 5.645 -12.449 1.00 0.00 C ATOM 0 H MET A 115 13.722 7.504 -8.015 1.00 0.00 H new ATOM 0 HA MET A 115 13.658 4.547 -8.406 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.225 6.199 -9.674 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.686 6.937 -10.301 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.261 4.609 -11.292 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.617 4.147 -10.898 1.00 0.00 H new ATOM 0 HE1 MET A 115 10.385 6.097 -13.306 1.00 0.00 H new ATOM 0 HE2 MET A 115 10.617 4.590 -12.387 1.00 0.00 H new ATOM 0 HE3 MET A 115 10.572 6.153 -11.537 1.00 0.00 H new ATOM 1818 N THR A 116 16.145 4.236 -8.473 1.00 0.00 N ATOM 1819 CA THR A 116 17.590 3.921 -8.685 1.00 0.00 C ATOM 1820 C THR A 116 17.722 2.983 -9.933 1.00 0.00 C ATOM 1821 O THR A 116 17.292 1.826 -9.920 1.00 0.00 O ATOM 1822 CB THR A 116 18.197 3.361 -7.364 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.128 4.347 -6.338 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.678 2.963 -7.453 1.00 0.00 C ATOM 0 H THR A 116 15.643 3.525 -7.942 1.00 0.00 H new ATOM 0 HA THR A 116 18.177 4.810 -8.915 1.00 0.00 H new ATOM 0 HB THR A 116 17.605 2.470 -7.155 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.510 3.986 -5.511 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.012 2.585 -6.487 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.801 2.187 -8.209 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.273 3.834 -7.727 1.00 0.00 H new ATOM 1832 N LEU A 117 18.290 3.510 -11.028 1.00 0.00 N ATOM 1833 CA LEU A 117 18.312 2.843 -12.354 1.00 0.00 C ATOM 1834 C LEU A 117 19.689 2.142 -12.551 1.00 0.00 C ATOM 1835 O LEU A 117 20.689 2.811 -12.834 1.00 0.00 O ATOM 1836 CB LEU A 117 18.064 3.867 -13.503 1.00 0.00 C ATOM 1837 CG LEU A 117 16.800 4.767 -13.496 1.00 0.00 C ATOM 1838 CD1 LEU A 117 16.987 6.051 -12.668 1.00 0.00 C ATOM 1839 CD2 LEU A 117 16.439 5.197 -14.929 1.00 0.00 C ATOM 0 H LEU A 117 18.753 4.419 -11.026 1.00 0.00 H new ATOM 0 HA LEU A 117 17.512 2.104 -12.388 1.00 0.00 H new ATOM 0 HB2 LEU A 117 18.930 4.528 -13.537 1.00 0.00 H new ATOM 0 HB3 LEU A 117 18.054 3.306 -14.438 1.00 0.00 H new ATOM 0 HG LEU A 117 16.009 4.166 -13.048 1.00 0.00 H new ATOM 0 HD11 LEU A 117 16.071 6.641 -12.699 1.00 0.00 H new ATOM 0 HD12 LEU A 117 17.214 5.788 -11.635 1.00 0.00 H new ATOM 0 HD13 LEU A 117 17.809 6.635 -13.083 1.00 0.00 H new ATOM 0 HD21 LEU A 117 15.550 5.828 -14.907 1.00 0.00 H new ATOM 0 HD22 LEU A 117 17.269 5.755 -15.361 1.00 0.00 H new ATOM 0 HD23 LEU A 117 16.241 4.313 -15.535 1.00 0.00 H new ATOM 1851 N THR A 118 19.749 0.811 -12.393 1.00 0.00 N ATOM 1852 CA THR A 118 21.026 0.043 -12.473 1.00 0.00 C ATOM 1853 C THR A 118 21.087 -0.817 -13.774 1.00 0.00 C ATOM 1854 O THR A 118 20.355 -1.801 -13.929 1.00 0.00 O ATOM 1855 CB THR A 118 21.293 -0.745 -11.151 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.510 -1.484 -11.247 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.226 -1.755 -10.704 1.00 0.00 C ATOM 0 H THR A 118 18.930 0.231 -12.208 1.00 0.00 H new ATOM 0 HA THR A 118 21.859 0.741 -12.559 1.00 0.00 H new ATOM 0 HB THR A 118 21.308 0.054 -10.410 1.00 0.00 H new ATOM 0 HG1 THR A 118 22.664 -1.971 -10.410 1.00 0.00 H new ATOM 0 HG21 THR A 118 20.540 -2.228 -9.774 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.279 -1.238 -10.547 1.00 0.00 H new ATOM 0 HG23 THR A 118 20.100 -2.516 -11.474 1.00 0.00 H new ATOM 1865 N PHE A 119 22.010 -0.464 -14.691 1.00 0.00 N ATOM 1866 CA PHE A 119 22.423 -1.362 -15.805 1.00 0.00 C ATOM 1867 C PHE A 119 23.753 -2.083 -15.406 1.00 0.00 C ATOM 1868 O PHE A 119 24.854 -1.659 -15.779 1.00 0.00 O ATOM 1869 CB PHE A 119 22.484 -0.506 -17.103 1.00 0.00 C ATOM 1870 CG PHE A 119 22.811 -1.290 -18.385 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.883 -2.191 -18.916 1.00 0.00 C ATOM 1872 CD2 PHE A 119 24.049 -1.136 -19.015 1.00 0.00 C ATOM 1873 CE1 PHE A 119 22.190 -2.931 -20.053 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.354 -1.872 -20.158 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.421 -2.765 -20.679 1.00 0.00 C ATOM 0 H PHE A 119 22.488 0.437 -14.688 1.00 0.00 H new ATOM 0 HA PHE A 119 21.713 -2.165 -16.001 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.525 -0.006 -17.236 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.234 0.274 -16.971 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.921 -2.313 -18.440 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.773 -0.443 -18.614 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.473 -3.634 -20.450 1.00 0.00 H new ATOM 0 HE2 PHE A 119 25.313 -1.750 -20.639 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.653 -3.329 -21.570 1.00 0.00 H new ATOM 1885 N GLY A 120 23.635 -3.148 -14.588 1.00 0.00 N ATOM 1886 CA GLY A 120 24.805 -3.849 -13.991 1.00 0.00 C ATOM 1887 C GLY A 120 25.645 -2.996 -13.013 1.00 0.00 C ATOM 1888 O GLY A 120 25.255 -2.783 -11.864 1.00 0.00 O ATOM 0 H GLY A 120 22.736 -3.549 -14.320 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.450 -4.735 -13.465 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.453 -4.195 -14.797 1.00 0.00 H new ATOM 1892 N ASP A 121 26.779 -2.483 -13.504 1.00 0.00 N ATOM 1893 CA ASP A 121 27.612 -1.491 -12.757 1.00 0.00 C ATOM 1894 C ASP A 121 27.203 0.016 -12.913 1.00 0.00 C ATOM 1895 O ASP A 121 27.556 0.812 -12.039 1.00 0.00 O ATOM 1896 CB ASP A 121 29.104 -1.691 -13.147 1.00 0.00 C ATOM 1897 CG ASP A 121 29.730 -3.016 -12.708 1.00 0.00 C ATOM 1898 OD1 ASP A 121 30.000 -3.933 -13.476 1.00 0.00 O ATOM 1899 OD2 ASP A 121 29.954 -3.063 -11.365 1.00 0.00 O ATOM 0 H ASP A 121 27.155 -2.730 -14.419 1.00 0.00 H new ATOM 0 HA ASP A 121 27.436 -1.700 -11.702 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.192 -1.610 -14.230 1.00 0.00 H new ATOM 0 HB3 ASP A 121 29.686 -0.875 -12.718 1.00 0.00 H new ATOM 1905 N VAL A 122 26.508 0.438 -13.991 1.00 0.00 N ATOM 1906 CA VAL A 122 26.222 1.881 -14.264 1.00 0.00 C ATOM 1907 C VAL A 122 24.871 2.279 -13.576 1.00 0.00 C ATOM 1908 O VAL A 122 23.800 1.782 -13.946 1.00 0.00 O ATOM 1909 CB VAL A 122 26.258 2.196 -15.801 1.00 0.00 C ATOM 1910 CG1 VAL A 122 26.081 3.705 -16.095 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.569 1.769 -16.507 1.00 0.00 C ATOM 0 H VAL A 122 26.129 -0.196 -14.695 1.00 0.00 H new ATOM 0 HA VAL A 122 27.008 2.499 -13.830 1.00 0.00 H new ATOM 0 HB VAL A 122 25.426 1.611 -16.193 1.00 0.00 H new ATOM 0 HG11 VAL A 122 26.113 3.872 -17.172 1.00 0.00 H new ATOM 0 HG12 VAL A 122 25.121 4.042 -15.704 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.884 4.266 -15.617 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.511 2.022 -17.566 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.412 2.290 -16.054 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.707 0.693 -16.398 1.00 0.00 H new ATOM 1921 N VAL A 123 24.945 3.166 -12.566 1.00 0.00 N ATOM 1922 CA VAL A 123 23.790 3.494 -11.677 1.00 0.00 C ATOM 1923 C VAL A 123 23.417 5.008 -11.837 1.00 0.00 C ATOM 1924 O VAL A 123 24.202 5.894 -11.482 1.00 0.00 O ATOM 1925 CB VAL A 123 24.086 3.095 -10.185 1.00 0.00 C ATOM 1926 CG1 VAL A 123 22.891 3.375 -9.240 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.457 1.604 -9.983 1.00 0.00 C ATOM 0 H VAL A 123 25.797 3.678 -12.336 1.00 0.00 H new ATOM 0 HA VAL A 123 22.924 2.904 -11.978 1.00 0.00 H new ATOM 0 HB VAL A 123 24.942 3.722 -9.937 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.154 3.080 -8.224 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.654 4.439 -9.259 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.024 2.804 -9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.645 1.416 -8.926 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.634 0.975 -10.323 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.353 1.371 -10.558 1.00 0.00 H new ATOM 1937 N ALA A 124 22.185 5.293 -12.296 1.00 0.00 N ATOM 1938 CA ALA A 124 21.562 6.638 -12.175 1.00 0.00 C ATOM 1939 C ALA A 124 20.474 6.699 -11.053 1.00 0.00 C ATOM 1940 O ALA A 124 19.950 5.671 -10.617 1.00 0.00 O ATOM 1941 CB ALA A 124 20.984 6.975 -13.561 1.00 0.00 C ATOM 0 H ALA A 124 21.590 4.606 -12.760 1.00 0.00 H new ATOM 0 HA ALA A 124 22.306 7.375 -11.873 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.512 7.957 -13.529 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.787 6.982 -14.298 1.00 0.00 H new ATOM 0 HB3 ALA A 124 20.243 6.225 -13.838 1.00 0.00 H new ATOM 1947 N VAL A 125 20.117 7.909 -10.580 1.00 0.00 N ATOM 1948 CA VAL A 125 19.055 8.082 -9.534 1.00 0.00 C ATOM 1949 C VAL A 125 18.070 9.226 -9.960 1.00 0.00 C ATOM 1950 O VAL A 125 18.442 10.402 -9.984 1.00 0.00 O ATOM 1951 CB VAL A 125 19.611 8.283 -8.076 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.498 8.084 -7.026 1.00 0.00 C ATOM 1953 CG2 VAL A 125 20.788 7.369 -7.657 1.00 0.00 C ATOM 0 H VAL A 125 20.537 8.784 -10.894 1.00 0.00 H new ATOM 0 HA VAL A 125 18.506 7.142 -9.481 1.00 0.00 H new ATOM 0 HB VAL A 125 19.990 9.305 -8.105 1.00 0.00 H new ATOM 0 HG11 VAL A 125 18.910 8.229 -6.027 1.00 0.00 H new ATOM 0 HG12 VAL A 125 17.702 8.808 -7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.095 7.075 -7.110 1.00 0.00 H new ATOM 0 HG21 VAL A 125 21.083 7.601 -6.634 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.478 6.326 -7.717 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.633 7.535 -8.325 1.00 0.00 H new ATOM 1963 N ARG A 126 16.803 8.893 -10.267 1.00 0.00 N ATOM 1964 CA ARG A 126 15.741 9.899 -10.570 1.00 0.00 C ATOM 1965 C ARG A 126 14.840 10.134 -9.311 1.00 0.00 C ATOM 1966 O ARG A 126 14.166 9.224 -8.819 1.00 0.00 O ATOM 1967 CB ARG A 126 14.958 9.451 -11.837 1.00 0.00 C ATOM 1968 CG ARG A 126 15.696 9.748 -13.174 1.00 0.00 C ATOM 1969 CD ARG A 126 15.229 8.977 -14.425 1.00 0.00 C ATOM 1970 NE ARG A 126 13.790 9.173 -14.758 1.00 0.00 N ATOM 1971 CZ ARG A 126 13.186 8.713 -15.856 1.00 0.00 C ATOM 1972 NH1 ARG A 126 13.797 8.024 -16.785 1.00 0.00 N ATOM 1973 NH2 ARG A 126 11.920 8.956 -16.017 1.00 0.00 N ATOM 0 H ARG A 126 16.477 7.928 -10.315 1.00 0.00 H new ATOM 0 HA ARG A 126 16.181 10.869 -10.800 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.763 8.381 -11.771 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.990 9.951 -11.849 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.604 10.814 -13.381 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.756 9.542 -13.027 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.834 9.288 -15.277 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.414 7.914 -14.274 1.00 0.00 H new ATOM 0 HE ARG A 126 13.222 9.700 -14.095 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.790 7.811 -16.692 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.280 7.700 -17.602 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.409 9.488 -15.312 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.437 8.615 -16.848 1.00 0.00 H new ATOM 1987 N HIS A 127 14.863 11.370 -8.782 1.00 0.00 N ATOM 1988 CA HIS A 127 14.294 11.702 -7.443 1.00 0.00 C ATOM 1989 C HIS A 127 12.912 12.418 -7.582 1.00 0.00 C ATOM 1990 O HIS A 127 12.855 13.586 -7.989 1.00 0.00 O ATOM 1991 CB HIS A 127 15.307 12.621 -6.700 1.00 0.00 C ATOM 1992 CG HIS A 127 16.639 12.003 -6.271 1.00 0.00 C ATOM 1993 ND1 HIS A 127 16.909 11.579 -4.987 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.813 11.951 -7.045 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.252 11.324 -5.096 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.895 11.519 -6.292 1.00 0.00 N ATOM 0 H HIS A 127 15.273 12.172 -9.261 1.00 0.00 H new ATOM 0 HA HIS A 127 14.130 10.785 -6.878 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.524 13.473 -7.345 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.815 13.012 -5.809 1.00 0.00 H new ATOM 0 HD2 HIS A 127 17.865 12.214 -8.091 1.00 0.00 H new ATOM 0 HE1 HIS A 127 18.805 10.969 -4.239 1.00 0.00 H new ATOM 0 HE2 HIS A 127 19.873 11.386 -6.550 1.00 0.00 H new ATOM 2004 N TYR A 128 11.796 11.750 -7.242 1.00 0.00 N ATOM 2005 CA TYR A 128 10.432 12.267 -7.539 1.00 0.00 C ATOM 2006 C TYR A 128 9.700 12.758 -6.253 1.00 0.00 C ATOM 2007 O TYR A 128 9.543 11.994 -5.298 1.00 0.00 O ATOM 2008 CB TYR A 128 9.626 11.120 -8.199 1.00 0.00 C ATOM 2009 CG TYR A 128 10.016 10.698 -9.625 1.00 0.00 C ATOM 2010 CD1 TYR A 128 10.999 9.719 -9.804 1.00 0.00 C ATOM 2011 CD2 TYR A 128 9.332 11.193 -10.739 1.00 0.00 C ATOM 2012 CE1 TYR A 128 11.276 9.224 -11.073 1.00 0.00 C ATOM 2013 CE2 TYR A 128 9.621 10.706 -12.013 1.00 0.00 C ATOM 2014 CZ TYR A 128 10.582 9.711 -12.174 1.00 0.00 C ATOM 2015 OH TYR A 128 10.809 9.145 -13.396 1.00 0.00 O ATOM 0 H TYR A 128 11.803 10.850 -6.761 1.00 0.00 H new ATOM 0 HA TYR A 128 10.514 13.126 -8.205 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.705 10.243 -7.557 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.576 11.413 -8.212 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.546 9.345 -8.951 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.577 11.955 -10.612 1.00 0.00 H new ATOM 0 HE1 TYR A 128 12.030 8.462 -11.203 1.00 0.00 H new ATOM 0 HE2 TYR A 128 9.101 11.100 -12.874 1.00 0.00 H new ATOM 0 HH TYR A 128 9.996 9.205 -13.940 1.00 0.00 H new ATOM 2025 N GLU A 129 9.187 14.000 -6.254 1.00 0.00 N ATOM 2026 CA GLU A 129 8.312 14.518 -5.156 1.00 0.00 C ATOM 2027 C GLU A 129 6.787 14.264 -5.386 1.00 0.00 C ATOM 2028 O GLU A 129 6.311 14.124 -6.517 1.00 0.00 O ATOM 2029 CB GLU A 129 8.611 16.029 -4.911 1.00 0.00 C ATOM 2030 CG GLU A 129 9.762 16.317 -3.914 1.00 0.00 C ATOM 2031 CD GLU A 129 9.516 15.925 -2.449 1.00 0.00 C ATOM 2032 OE1 GLU A 129 8.496 15.386 -2.028 1.00 0.00 O ATOM 2033 OE2 GLU A 129 10.582 16.229 -1.660 1.00 0.00 O ATOM 0 H GLU A 129 9.356 14.675 -6.999 1.00 0.00 H new ATOM 0 HA GLU A 129 8.559 13.948 -4.260 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.853 16.495 -5.866 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.704 16.508 -4.543 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.653 15.794 -4.262 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.984 17.384 -3.949 1.00 0.00 H new ATOM 2041 N LYS A 130 6.027 14.183 -4.279 1.00 0.00 N ATOM 2042 CA LYS A 130 4.635 13.672 -4.286 1.00 0.00 C ATOM 2043 C LYS A 130 3.553 14.762 -4.570 1.00 0.00 C ATOM 2044 O LYS A 130 3.587 15.872 -4.029 1.00 0.00 O ATOM 2045 CB LYS A 130 4.442 12.991 -2.905 1.00 0.00 C ATOM 2046 CG LYS A 130 3.322 11.935 -2.876 1.00 0.00 C ATOM 2047 CD LYS A 130 3.331 11.119 -1.567 1.00 0.00 C ATOM 2048 CE LYS A 130 2.491 9.839 -1.681 1.00 0.00 C ATOM 2049 NZ LYS A 130 2.618 9.019 -0.462 1.00 0.00 N ATOM 0 H LYS A 130 6.354 14.467 -3.356 1.00 0.00 H new ATOM 0 HA LYS A 130 4.494 12.973 -5.111 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.379 12.519 -2.610 1.00 0.00 H new ATOM 0 HB3 LYS A 130 4.223 13.757 -2.161 1.00 0.00 H new ATOM 0 HG2 LYS A 130 2.356 12.428 -2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.438 11.261 -3.724 1.00 0.00 H new ATOM 0 HD2 LYS A 130 4.357 10.857 -1.310 1.00 0.00 H new ATOM 0 HD3 LYS A 130 2.946 11.734 -0.754 1.00 0.00 H new ATOM 0 HE2 LYS A 130 1.445 10.098 -1.843 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.814 9.263 -2.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.912 8.055 -0.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 3.330 9.441 0.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.702 8.982 0.028 1.00 0.00 H new ATOM 2062 N ALA A 131 2.578 14.393 -5.408 1.00 0.00 N ATOM 2063 CA ALA A 131 1.411 15.229 -5.765 1.00 0.00 C ATOM 2064 C ALA A 131 0.088 14.407 -5.746 1.00 0.00 C ATOM 2065 O ALA A 131 -0.958 15.005 -5.406 1.00 0.00 O ATOM 2066 CB ALA A 131 1.679 15.856 -7.142 1.00 0.00 C ATOM 2067 OXT ALA A 131 0.064 13.190 -6.072 1.00 0.00 O ATOM 0 H ALA A 131 2.572 13.484 -5.871 1.00 0.00 H new ATOM 0 HA ALA A 131 1.280 16.018 -5.025 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.832 16.479 -7.429 1.00 0.00 H new ATOM 0 HB2 ALA A 131 2.580 16.468 -7.094 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.816 15.066 -7.881 1.00 0.00 H new TER 2073 ALA A 131