USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1051 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 132 HIS : no HE2:sc= -2.34! X(o=-1.1!,f=-0.89) USER MOD Set 1.2: A 135 THR OG1 : rot 157:sc= 1.26 USER MOD Set 2.1: A 101 SER OG : rot 167:sc= 0.0903 USER MOD Set 2.2: A 103 LYS NZ :NH3+ -165:sc= 0.163 (180deg=-0.22!) USER MOD Set 3.1: A 41 GLN : amide:sc= -2.6! K(o=-2!,f=-3.9) USER MOD Set 3.2: A 84 LYS NZ :NH3+ 173:sc= 0.631 (180deg=0) USER MOD Set 4.1: A 67 HIS : no HE2:sc= -0.225 K(o=0.13,f=-2.1) USER MOD Set 4.2: A 111 THR OG1 : rot 160:sc= 0.352 USER MOD Set 5.1: A 63 MET CE :methyl -152:sc= -4.14! (180deg=-4.32) USER MOD Set 5.2: A 151 THR OG1 : rot -81:sc= -1.07 USER MOD Set 6.1: A 54 ASN : amide:sc= -2.36! C(o=-4.2!,f=-4.3!) USER MOD Set 6.2: A 57 THR OG1 : rot -4:sc= -1.85! USER MOD Set 7.1: A 35 SER OG : rot -110:sc= 0 USER MOD Set 7.2: A 154 LYS NZ :NH3+ -176:sc= 0.73 (180deg=0.68) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.738 K(o=-0.74,f=-1.3!) USER MOD Single : A 33 GLN : amide:sc= 0.901 K(o=0.9,f=-0.41) USER MOD Single : A 37 TYR OH : rot 1:sc= -0.136 USER MOD Single : A 45 LYS NZ :NH3+ -167:sc= 1.2 (180deg=0.784) USER MOD Single : A 48 SER OG : rot -77:sc= 1.22 USER MOD Single : A 55 GLN : amide:sc= -4.13! C(o=-4.1!,f=-4.6!) USER MOD Single : A 59 HIS :FLIP no HE2:sc= -1.02 F(o=-2.4!,f=-1) USER MOD Single : A 65 SER OG : rot 3:sc= -0.625 USER MOD Single : A 68 ASN : amide:sc= -0.715 X(o=-0.72,f=-0.68) USER MOD Single : A 72 ASN : amide:sc= -2.67! C(o=-2.7!,f=-9.2!) USER MOD Single : A 78 THR OG1 : rot -177:sc= 1.77 USER MOD Single : A 80 LYS NZ :NH3+ 141:sc= 0.422 (180deg=-1.06!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN :FLIP amide:sc= 0 F(o=-0.75,f=0) USER MOD Single : A 93 MET CE :methyl 147:sc= -2.52 (180deg=-5.93!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.00719 USER MOD Single : A 107 ASN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 108 SER OG : rot 129:sc= 1.28 USER MOD Single : A 109 ASN : amide:sc= -0.0268 K(o=-0.027,f=-0.82) USER MOD Single : A 110 MET CE :methyl -105:sc= -4.75! (180deg=-7.46!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 100:sc= 0.941 USER MOD Single : A 118 GLN : amide:sc= -0.57 K(o=-0.57,f=-9.6!) USER MOD Single : A 127 THR OG1 : rot -99:sc= -0.0647 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.17) USER MOD Single : A 140 LYS NZ :NH3+ -144:sc= 1.19 (180deg=0.347) USER MOD Single : A 142 ASN :FLIP amide:sc= -3.03! C(o=-5.5!,f=-3!) USER MOD Single : A 146 SER OG : rot -22:sc= -0.119 USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot 127:sc= 0.504 USER MOD Single : A 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ -176:sc= 1.23 (180deg=1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 22 -1.049 -22.628 5.256 1.00 0.00 N ATOM 2 CA MET A 22 -1.149 -21.269 4.717 1.00 0.00 C ATOM 3 C MET A 22 -2.003 -20.397 5.625 1.00 0.00 C ATOM 4 O MET A 22 -3.201 -20.647 5.805 1.00 0.00 O ATOM 5 CB MET A 22 -1.695 -21.254 3.255 1.00 0.00 C ATOM 6 CG MET A 22 -3.070 -21.903 3.029 1.00 0.00 C ATOM 7 SD MET A 22 -3.078 -23.693 3.295 1.00 0.00 S ATOM 8 CE MET A 22 -4.794 -24.079 2.935 1.00 0.00 C ATOM 0 HA MET A 22 -0.141 -20.857 4.684 1.00 0.00 H new ATOM 0 HB2 MET A 22 -1.748 -20.218 2.921 1.00 0.00 H new ATOM 0 HB3 MET A 22 -0.971 -21.758 2.615 1.00 0.00 H new ATOM 0 HG2 MET A 22 -3.795 -21.441 3.699 1.00 0.00 H new ATOM 0 HG3 MET A 22 -3.398 -21.694 2.011 1.00 0.00 H new ATOM 0 HE1 MET A 22 -4.959 -25.150 3.055 1.00 0.00 H new ATOM 0 HE2 MET A 22 -5.441 -23.533 3.621 1.00 0.00 H new ATOM 0 HE3 MET A 22 -5.025 -23.789 1.910 1.00 0.00 H new ATOM 20 N ASP A 23 -1.389 -19.402 6.229 1.00 0.00 N ATOM 21 CA ASP A 23 -2.114 -18.478 7.097 1.00 0.00 C ATOM 22 C ASP A 23 -2.832 -17.486 6.249 1.00 0.00 C ATOM 23 O ASP A 23 -3.974 -17.109 6.508 1.00 0.00 O ATOM 24 CB ASP A 23 -1.181 -17.741 8.057 1.00 0.00 C ATOM 25 CG ASP A 23 -0.508 -18.627 9.075 1.00 0.00 C ATOM 26 OD1 ASP A 23 -1.066 -18.832 10.173 1.00 0.00 O ATOM 27 OD2 ASP A 23 0.611 -19.104 8.818 1.00 0.00 O ATOM 0 H ASP A 23 -0.392 -19.206 6.140 1.00 0.00 H new ATOM 0 HA ASP A 23 -2.815 -19.057 7.698 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -0.414 -17.228 7.477 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.751 -16.974 8.581 1.00 0.00 H new ATOM 32 N CYS A 24 -2.165 -17.099 5.224 1.00 0.00 N ATOM 33 CA CYS A 24 -2.678 -16.194 4.255 1.00 0.00 C ATOM 34 C CYS A 24 -3.583 -16.961 3.274 1.00 0.00 C ATOM 35 O CYS A 24 -3.464 -18.193 3.153 1.00 0.00 O ATOM 36 CB CYS A 24 -1.523 -15.560 3.502 1.00 0.00 C ATOM 37 SG CYS A 24 -0.316 -14.629 4.517 1.00 0.00 S ATOM 0 H CYS A 24 -1.215 -17.413 5.027 1.00 0.00 H new ATOM 0 HA CYS A 24 -3.259 -15.414 4.747 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -0.989 -16.346 2.968 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -1.932 -14.885 2.750 1.00 0.00 H new ATOM 42 N PRO A 25 -4.533 -16.268 2.599 1.00 0.00 N ATOM 43 CA PRO A 25 -5.441 -16.900 1.612 1.00 0.00 C ATOM 44 C PRO A 25 -4.699 -17.602 0.464 1.00 0.00 C ATOM 45 O PRO A 25 -4.922 -18.783 0.186 1.00 0.00 O ATOM 46 CB PRO A 25 -6.204 -15.697 1.051 1.00 0.00 C ATOM 47 CG PRO A 25 -6.210 -14.716 2.156 1.00 0.00 C ATOM 48 CD PRO A 25 -4.856 -14.829 2.777 1.00 0.00 C ATOM 0 HA PRO A 25 -6.054 -17.675 2.072 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -5.714 -15.294 0.165 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -7.217 -15.971 0.758 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -6.393 -13.707 1.787 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -6.996 -14.939 2.878 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.128 -14.187 2.281 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.868 -14.544 3.829 1.00 0.00 H new ATOM 56 N SER A 26 -3.802 -16.890 -0.166 1.00 0.00 N ATOM 57 CA SER A 26 -3.089 -17.403 -1.305 1.00 0.00 C ATOM 58 C SER A 26 -1.604 -17.080 -1.178 1.00 0.00 C ATOM 59 O SER A 26 -1.209 -16.341 -0.273 1.00 0.00 O ATOM 60 CB SER A 26 -3.679 -16.808 -2.580 1.00 0.00 C ATOM 61 OG SER A 26 -5.082 -17.062 -2.653 1.00 0.00 O ATOM 0 H SER A 26 -3.545 -15.938 0.096 1.00 0.00 H new ATOM 0 HA SER A 26 -3.192 -18.487 -1.350 1.00 0.00 H new ATOM 0 HB2 SER A 26 -3.497 -15.734 -2.604 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.181 -17.235 -3.451 1.00 0.00 H new ATOM 0 HG SER A 26 -5.443 -16.672 -3.476 1.00 0.00 H new ATOM 67 N SER A 27 -0.804 -17.577 -2.100 1.00 0.00 N ATOM 68 CA SER A 27 0.639 -17.427 -2.039 1.00 0.00 C ATOM 69 C SER A 27 1.103 -16.026 -2.459 1.00 0.00 C ATOM 70 O SER A 27 2.266 -15.669 -2.288 1.00 0.00 O ATOM 71 CB SER A 27 1.281 -18.489 -2.897 1.00 0.00 C ATOM 72 OG SER A 27 0.791 -19.785 -2.528 1.00 0.00 O ATOM 0 H SER A 27 -1.134 -18.096 -2.913 1.00 0.00 H new ATOM 0 HA SER A 27 0.951 -17.551 -1.002 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.067 -18.297 -3.948 1.00 0.00 H new ATOM 0 HB3 SER A 27 2.364 -18.455 -2.781 1.00 0.00 H new ATOM 0 HG SER A 27 1.212 -20.467 -3.092 1.00 0.00 H new ATOM 78 N THR A 28 0.192 -15.239 -3.000 1.00 0.00 N ATOM 79 CA THR A 28 0.486 -13.868 -3.368 1.00 0.00 C ATOM 80 C THR A 28 0.415 -12.978 -2.104 1.00 0.00 C ATOM 81 O THR A 28 0.796 -11.802 -2.113 1.00 0.00 O ATOM 82 CB THR A 28 -0.524 -13.387 -4.444 1.00 0.00 C ATOM 83 OG1 THR A 28 -0.587 -14.378 -5.499 1.00 0.00 O ATOM 84 CG2 THR A 28 -0.086 -12.066 -5.057 1.00 0.00 C ATOM 0 H THR A 28 -0.766 -15.530 -3.195 1.00 0.00 H new ATOM 0 HA THR A 28 1.489 -13.800 -3.789 1.00 0.00 H new ATOM 0 HB THR A 28 -1.495 -13.251 -3.969 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.224 -14.086 -6.184 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.813 -11.754 -5.807 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.021 -11.307 -4.277 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.890 -12.189 -5.527 1.00 0.00 H new ATOM 92 N TRP A 29 -0.045 -13.579 -1.019 1.00 0.00 N ATOM 93 CA TRP A 29 -0.163 -12.911 0.240 1.00 0.00 C ATOM 94 C TRP A 29 1.069 -13.165 1.066 1.00 0.00 C ATOM 95 O TRP A 29 1.435 -14.313 1.351 1.00 0.00 O ATOM 96 CB TRP A 29 -1.379 -13.383 0.996 1.00 0.00 C ATOM 97 CG TRP A 29 -2.674 -13.057 0.363 1.00 0.00 C ATOM 98 CD1 TRP A 29 -3.228 -13.652 -0.697 1.00 0.00 C ATOM 99 CD2 TRP A 29 -3.584 -12.083 0.790 1.00 0.00 C ATOM 100 NE1 TRP A 29 -4.429 -13.094 -0.981 1.00 0.00 N ATOM 101 CE2 TRP A 29 -4.668 -12.118 -0.071 1.00 0.00 C ATOM 102 CE3 TRP A 29 -3.573 -11.185 1.810 1.00 0.00 C ATOM 103 CZ2 TRP A 29 -5.737 -11.279 0.070 1.00 0.00 C ATOM 104 CZ3 TRP A 29 -4.652 -10.335 1.963 1.00 0.00 C ATOM 105 CH2 TRP A 29 -5.719 -10.393 1.087 1.00 0.00 C ATOM 0 H TRP A 29 -0.346 -14.553 -1.001 1.00 0.00 H new ATOM 0 HA TRP A 29 -0.269 -11.843 0.049 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -1.314 -14.464 1.120 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -1.360 -12.946 1.994 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -2.781 -14.465 -1.250 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -5.047 -13.362 -1.747 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -2.735 -11.136 2.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -6.572 -11.324 -0.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -4.661 -9.621 2.773 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -6.552 -9.718 1.219 1.00 0.00 H new ATOM 116 N ILE A 30 1.680 -12.113 1.442 1.00 0.00 N ATOM 117 CA ILE A 30 2.899 -12.125 2.173 1.00 0.00 C ATOM 118 C ILE A 30 2.621 -11.959 3.662 1.00 0.00 C ATOM 119 O ILE A 30 1.981 -11.004 4.074 1.00 0.00 O ATOM 120 CB ILE A 30 3.806 -11.015 1.604 1.00 0.00 C ATOM 121 CG1 ILE A 30 4.079 -11.364 0.139 1.00 0.00 C ATOM 122 CG2 ILE A 30 5.112 -10.857 2.387 1.00 0.00 C ATOM 123 CD1 ILE A 30 4.976 -10.428 -0.544 1.00 0.00 C ATOM 0 H ILE A 30 1.336 -11.173 1.244 1.00 0.00 H new ATOM 0 HA ILE A 30 3.414 -13.080 2.066 1.00 0.00 H new ATOM 0 HB ILE A 30 3.301 -10.053 1.691 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.510 -12.364 0.090 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.131 -11.398 -0.398 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.710 -10.062 1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.887 -10.604 3.423 1.00 0.00 H new ATOM 0 HG23 ILE A 30 5.671 -11.792 2.355 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.117 -10.747 -1.577 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.539 -9.429 -0.529 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.940 -10.410 -0.035 1.00 0.00 H new ATOM 135 N GLN A 31 3.061 -12.919 4.441 1.00 0.00 N ATOM 136 CA GLN A 31 2.826 -12.931 5.873 1.00 0.00 C ATOM 137 C GLN A 31 3.925 -12.174 6.583 1.00 0.00 C ATOM 138 O GLN A 31 5.122 -12.420 6.354 1.00 0.00 O ATOM 139 CB GLN A 31 2.778 -14.369 6.377 1.00 0.00 C ATOM 140 CG GLN A 31 2.460 -14.539 7.861 1.00 0.00 C ATOM 141 CD GLN A 31 2.582 -15.986 8.281 1.00 0.00 C ATOM 142 OE1 GLN A 31 3.360 -16.750 7.708 1.00 0.00 O ATOM 143 NE2 GLN A 31 1.872 -16.364 9.289 1.00 0.00 N ATOM 0 H GLN A 31 3.595 -13.719 4.102 1.00 0.00 H new ATOM 0 HA GLN A 31 1.871 -12.448 6.081 1.00 0.00 H new ATOM 0 HB2 GLN A 31 2.030 -14.913 5.799 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.741 -14.838 6.174 1.00 0.00 H new ATOM 0 HG2 GLN A 31 3.139 -13.926 8.454 1.00 0.00 H new ATOM 0 HG3 GLN A 31 1.450 -14.182 8.063 1.00 0.00 H new ATOM 0 HE21 GLN A 31 1.237 -15.706 9.741 1.00 0.00 H new ATOM 0 HE22 GLN A 31 1.945 -17.321 9.634 1.00 0.00 H new ATOM 152 N PHE A 32 3.539 -11.263 7.415 1.00 0.00 N ATOM 153 CA PHE A 32 4.459 -10.485 8.148 1.00 0.00 C ATOM 154 C PHE A 32 3.940 -10.256 9.543 1.00 0.00 C ATOM 155 O PHE A 32 2.862 -9.673 9.724 1.00 0.00 O ATOM 156 CB PHE A 32 4.690 -9.194 7.415 1.00 0.00 C ATOM 157 CG PHE A 32 5.634 -8.248 8.055 1.00 0.00 C ATOM 158 CD1 PHE A 32 6.993 -8.479 8.019 1.00 0.00 C ATOM 159 CD2 PHE A 32 5.168 -7.108 8.653 1.00 0.00 C ATOM 160 CE1 PHE A 32 7.867 -7.589 8.573 1.00 0.00 C ATOM 161 CE2 PHE A 32 6.038 -6.205 9.201 1.00 0.00 C ATOM 162 CZ PHE A 32 7.395 -6.449 9.159 1.00 0.00 C ATOM 0 H PHE A 32 2.561 -11.042 7.601 1.00 0.00 H new ATOM 0 HA PHE A 32 5.413 -11.005 8.240 1.00 0.00 H new ATOM 0 HB2 PHE A 32 5.060 -9.426 6.416 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.730 -8.692 7.291 1.00 0.00 H new ATOM 0 HD1 PHE A 32 7.370 -9.374 7.547 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.105 -6.920 8.693 1.00 0.00 H new ATOM 0 HE1 PHE A 32 8.929 -7.786 8.548 1.00 0.00 H new ATOM 0 HE2 PHE A 32 5.663 -5.304 9.665 1.00 0.00 H new ATOM 0 HZ PHE A 32 8.085 -5.738 9.590 1.00 0.00 H new ATOM 172 N GLN A 33 4.702 -10.757 10.509 1.00 0.00 N ATOM 173 CA GLN A 33 4.439 -10.693 11.952 1.00 0.00 C ATOM 174 C GLN A 33 3.157 -11.430 12.349 1.00 0.00 C ATOM 175 O GLN A 33 3.213 -12.472 13.008 1.00 0.00 O ATOM 176 CB GLN A 33 4.447 -9.256 12.481 1.00 0.00 C ATOM 177 CG GLN A 33 5.714 -8.480 12.146 1.00 0.00 C ATOM 178 CD GLN A 33 5.791 -7.150 12.857 1.00 0.00 C ATOM 179 OE1 GLN A 33 4.768 -6.547 13.206 1.00 0.00 O ATOM 180 NE2 GLN A 33 6.975 -6.633 13.007 1.00 0.00 N ATOM 0 H GLN A 33 5.571 -11.248 10.300 1.00 0.00 H new ATOM 0 HA GLN A 33 5.266 -11.217 12.431 1.00 0.00 H new ATOM 0 HB2 GLN A 33 3.588 -8.724 12.071 1.00 0.00 H new ATOM 0 HB3 GLN A 33 4.322 -9.277 13.564 1.00 0.00 H new ATOM 0 HG2 GLN A 33 6.584 -9.080 12.413 1.00 0.00 H new ATOM 0 HG3 GLN A 33 5.759 -8.315 11.070 1.00 0.00 H new ATOM 0 HE21 GLN A 33 7.800 -7.154 12.710 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.078 -5.707 13.422 1.00 0.00 H new ATOM 189 N ASP A 34 2.029 -10.910 11.936 1.00 0.00 N ATOM 190 CA ASP A 34 0.727 -11.494 12.243 1.00 0.00 C ATOM 191 C ASP A 34 -0.296 -11.062 11.209 1.00 0.00 C ATOM 192 O ASP A 34 -1.508 -11.131 11.435 1.00 0.00 O ATOM 193 CB ASP A 34 0.243 -11.078 13.648 1.00 0.00 C ATOM 194 CG ASP A 34 0.062 -9.568 13.811 1.00 0.00 C ATOM 195 OD1 ASP A 34 -1.032 -9.041 13.547 1.00 0.00 O ATOM 196 OD2 ASP A 34 1.021 -8.878 14.223 1.00 0.00 O ATOM 0 H ASP A 34 1.977 -10.062 11.372 1.00 0.00 H new ATOM 0 HA ASP A 34 0.836 -12.578 12.222 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -0.705 -11.574 13.858 1.00 0.00 H new ATOM 0 HB3 ASP A 34 0.959 -11.432 14.389 1.00 0.00 H new ATOM 201 N SER A 35 0.163 -10.651 10.066 1.00 0.00 N ATOM 202 CA SER A 35 -0.741 -10.204 9.053 1.00 0.00 C ATOM 203 C SER A 35 -0.315 -10.677 7.694 1.00 0.00 C ATOM 204 O SER A 35 0.792 -11.181 7.517 1.00 0.00 O ATOM 205 CB SER A 35 -0.833 -8.700 9.040 1.00 0.00 C ATOM 206 OG SER A 35 -1.167 -8.177 10.320 1.00 0.00 O ATOM 0 H SER A 35 1.151 -10.616 9.813 1.00 0.00 H new ATOM 0 HA SER A 35 -1.718 -10.627 9.288 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.119 -8.281 8.714 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.584 -8.389 8.314 1.00 0.00 H new ATOM 0 HG SER A 35 -2.078 -7.815 10.298 1.00 0.00 H new ATOM 212 N CYS A 36 -1.190 -10.493 6.757 1.00 0.00 N ATOM 213 CA CYS A 36 -0.982 -10.849 5.400 1.00 0.00 C ATOM 214 C CYS A 36 -1.187 -9.661 4.518 1.00 0.00 C ATOM 215 O CYS A 36 -2.096 -8.844 4.717 1.00 0.00 O ATOM 216 CB CYS A 36 -1.850 -12.014 5.017 1.00 0.00 C ATOM 217 SG CYS A 36 -1.433 -13.585 5.848 1.00 0.00 S ATOM 0 H CYS A 36 -2.104 -10.073 6.929 1.00 0.00 H new ATOM 0 HA CYS A 36 0.050 -11.173 5.267 1.00 0.00 H new ATOM 0 HB2 CYS A 36 -2.887 -11.765 5.241 1.00 0.00 H new ATOM 0 HB3 CYS A 36 -1.783 -12.160 3.939 1.00 0.00 H new ATOM 222 N TYR A 37 -0.283 -9.553 3.617 1.00 0.00 N ATOM 223 CA TYR A 37 -0.117 -8.448 2.747 1.00 0.00 C ATOM 224 C TYR A 37 -0.234 -8.848 1.294 1.00 0.00 C ATOM 225 O TYR A 37 0.242 -9.896 0.908 1.00 0.00 O ATOM 226 CB TYR A 37 1.275 -7.941 3.021 1.00 0.00 C ATOM 227 CG TYR A 37 1.439 -7.295 4.340 1.00 0.00 C ATOM 228 CD1 TYR A 37 1.601 -8.050 5.432 1.00 0.00 C ATOM 229 CD2 TYR A 37 1.442 -5.952 4.466 1.00 0.00 C ATOM 230 CE1 TYR A 37 1.762 -7.519 6.676 1.00 0.00 C ATOM 231 CE2 TYR A 37 1.602 -5.358 5.701 1.00 0.00 C ATOM 232 CZ TYR A 37 1.761 -6.148 6.814 1.00 0.00 C ATOM 233 OH TYR A 37 1.947 -5.564 8.047 1.00 0.00 O ATOM 0 H TYR A 37 0.409 -10.285 3.456 1.00 0.00 H new ATOM 0 HA TYR A 37 -0.889 -7.698 2.922 1.00 0.00 H new ATOM 0 HB2 TYR A 37 1.973 -8.775 2.949 1.00 0.00 H new ATOM 0 HB3 TYR A 37 1.549 -7.228 2.244 1.00 0.00 H new ATOM 0 HD1 TYR A 37 1.604 -9.124 5.323 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.318 -5.334 3.589 1.00 0.00 H new ATOM 0 HE1 TYR A 37 1.888 -8.159 7.536 1.00 0.00 H new ATOM 0 HE2 TYR A 37 1.602 -4.282 5.792 1.00 0.00 H new ATOM 0 HH TYR A 37 2.087 -6.261 8.721 1.00 0.00 H new ATOM 243 N ILE A 38 -0.876 -8.022 0.505 1.00 0.00 N ATOM 244 CA ILE A 38 -0.996 -8.260 -0.925 1.00 0.00 C ATOM 245 C ILE A 38 -1.088 -6.935 -1.682 1.00 0.00 C ATOM 246 O ILE A 38 -1.745 -6.006 -1.217 1.00 0.00 O ATOM 247 CB ILE A 38 -2.198 -9.185 -1.268 1.00 0.00 C ATOM 248 CG1 ILE A 38 -2.241 -9.499 -2.775 1.00 0.00 C ATOM 249 CG2 ILE A 38 -3.502 -8.574 -0.793 1.00 0.00 C ATOM 250 CD1 ILE A 38 -3.376 -10.408 -3.188 1.00 0.00 C ATOM 0 H ILE A 38 -1.331 -7.168 0.827 1.00 0.00 H new ATOM 0 HA ILE A 38 -0.095 -8.783 -1.246 1.00 0.00 H new ATOM 0 HB ILE A 38 -2.061 -10.128 -0.739 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -2.321 -8.563 -3.327 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -1.297 -9.960 -3.065 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -4.328 -9.239 -1.044 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.465 -8.433 0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -3.651 -7.610 -1.280 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.333 -10.578 -4.264 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.287 -11.361 -2.666 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.327 -9.941 -2.932 1.00 0.00 H new ATOM 262 N PHE A 39 -0.380 -6.809 -2.791 1.00 0.00 N ATOM 263 CA PHE A 39 -0.506 -5.623 -3.607 1.00 0.00 C ATOM 264 C PHE A 39 -1.264 -5.984 -4.785 1.00 0.00 C ATOM 265 O PHE A 39 -0.893 -6.918 -5.517 1.00 0.00 O ATOM 266 CB PHE A 39 0.797 -5.111 -4.131 1.00 0.00 C ATOM 267 CG PHE A 39 0.840 -3.632 -4.327 1.00 0.00 C ATOM 268 CD1 PHE A 39 0.725 -2.787 -3.259 1.00 0.00 C ATOM 269 CD2 PHE A 39 1.006 -3.091 -5.567 1.00 0.00 C ATOM 270 CE1 PHE A 39 0.763 -1.424 -3.423 1.00 0.00 C ATOM 271 CE2 PHE A 39 1.050 -1.722 -5.738 1.00 0.00 C ATOM 272 CZ PHE A 39 0.925 -0.892 -4.670 1.00 0.00 C ATOM 0 H PHE A 39 0.279 -7.505 -3.140 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.962 -4.859 -2.977 1.00 0.00 H new ATOM 0 HB2 PHE A 39 1.591 -5.398 -3.441 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.010 -5.598 -5.082 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.602 -3.199 -2.268 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.104 -3.740 -6.425 1.00 0.00 H new ATOM 0 HE1 PHE A 39 0.665 -0.774 -2.566 1.00 0.00 H new ATOM 0 HE2 PHE A 39 1.185 -1.308 -6.727 1.00 0.00 H new ATOM 0 HZ PHE A 39 0.953 0.179 -4.806 1.00 0.00 H new ATOM 282 N LEU A 40 -2.296 -5.328 -4.983 1.00 0.00 N ATOM 283 CA LEU A 40 -3.015 -5.515 -6.109 1.00 0.00 C ATOM 284 C LEU A 40 -3.147 -4.235 -6.823 1.00 0.00 C ATOM 285 O LEU A 40 -3.863 -3.336 -6.393 1.00 0.00 O ATOM 286 CB LEU A 40 -4.349 -6.300 -5.923 1.00 0.00 C ATOM 287 CG LEU A 40 -5.205 -6.124 -4.632 1.00 0.00 C ATOM 288 CD1 LEU A 40 -4.465 -6.601 -3.412 1.00 0.00 C ATOM 289 CD2 LEU A 40 -5.732 -4.698 -4.437 1.00 0.00 C ATOM 0 H LEU A 40 -2.669 -4.627 -4.343 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.455 -6.200 -6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.989 -6.049 -6.769 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.111 -7.360 -6.008 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.083 -6.754 -4.771 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.091 -6.464 -2.530 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.222 -7.658 -3.524 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.545 -6.028 -3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.319 -4.649 -3.520 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.893 -4.006 -4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.360 -4.423 -5.284 1.00 0.00 H new ATOM 301 N GLN A 41 -2.325 -4.062 -7.794 1.00 0.00 N ATOM 302 CA GLN A 41 -2.496 -2.929 -8.631 1.00 0.00 C ATOM 303 C GLN A 41 -3.787 -3.050 -9.451 1.00 0.00 C ATOM 304 O GLN A 41 -3.829 -3.668 -10.522 1.00 0.00 O ATOM 305 CB GLN A 41 -1.271 -2.691 -9.502 1.00 0.00 C ATOM 306 CG GLN A 41 -0.092 -2.291 -8.657 1.00 0.00 C ATOM 307 CD GLN A 41 1.133 -1.871 -9.413 1.00 0.00 C ATOM 308 OE1 GLN A 41 1.046 -1.365 -10.533 1.00 0.00 O ATOM 309 NE2 GLN A 41 2.303 -2.023 -8.802 1.00 0.00 N ATOM 0 H GLN A 41 -1.543 -4.675 -8.027 1.00 0.00 H new ATOM 0 HA GLN A 41 -2.599 -2.047 -7.999 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.034 -3.596 -10.062 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -1.483 -1.911 -10.233 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -0.395 -1.470 -8.007 1.00 0.00 H new ATOM 0 HG3 GLN A 41 0.171 -3.129 -8.011 1.00 0.00 H new ATOM 0 HE21 GLN A 41 2.343 -2.446 -7.875 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.161 -1.717 -9.260 1.00 0.00 H new ATOM 318 N GLU A 42 -4.825 -2.455 -8.908 1.00 0.00 N ATOM 319 CA GLU A 42 -6.143 -2.413 -9.491 1.00 0.00 C ATOM 320 C GLU A 42 -6.493 -0.989 -9.877 1.00 0.00 C ATOM 321 O GLU A 42 -6.505 -0.095 -9.029 1.00 0.00 O ATOM 322 CB GLU A 42 -7.169 -2.895 -8.466 1.00 0.00 C ATOM 323 CG GLU A 42 -6.969 -4.318 -7.975 1.00 0.00 C ATOM 324 CD GLU A 42 -7.110 -5.332 -9.065 1.00 0.00 C ATOM 325 OE1 GLU A 42 -8.263 -5.638 -9.451 1.00 0.00 O ATOM 326 OE2 GLU A 42 -6.086 -5.846 -9.572 1.00 0.00 O ATOM 0 H GLU A 42 -4.770 -1.969 -8.013 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.156 -3.053 -10.374 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.145 -2.224 -7.607 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.163 -2.815 -8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -5.979 -4.407 -7.528 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.694 -4.532 -7.190 1.00 0.00 H new ATOM 333 N ALA A 43 -6.765 -0.770 -11.129 1.00 0.00 N ATOM 334 CA ALA A 43 -7.189 0.532 -11.578 1.00 0.00 C ATOM 335 C ALA A 43 -8.693 0.625 -11.431 1.00 0.00 C ATOM 336 O ALA A 43 -9.428 -0.144 -12.055 1.00 0.00 O ATOM 337 CB ALA A 43 -6.792 0.749 -13.025 1.00 0.00 C ATOM 0 H ALA A 43 -6.702 -1.475 -11.863 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.707 1.303 -10.976 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.120 1.737 -13.348 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.708 0.677 -13.120 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.262 -0.011 -13.649 1.00 0.00 H new ATOM 343 N ILE A 44 -9.143 1.530 -10.595 1.00 0.00 N ATOM 344 CA ILE A 44 -10.575 1.736 -10.336 1.00 0.00 C ATOM 345 C ILE A 44 -10.835 3.201 -10.067 1.00 0.00 C ATOM 346 O ILE A 44 -9.911 3.945 -9.703 1.00 0.00 O ATOM 347 CB ILE A 44 -11.155 0.943 -9.119 1.00 0.00 C ATOM 348 CG1 ILE A 44 -10.563 1.431 -7.808 1.00 0.00 C ATOM 349 CG2 ILE A 44 -10.970 -0.566 -9.261 1.00 0.00 C ATOM 350 CD1 ILE A 44 -11.329 0.955 -6.611 1.00 0.00 C ATOM 0 H ILE A 44 -8.535 2.155 -10.065 1.00 0.00 H new ATOM 0 HA ILE A 44 -11.071 1.366 -11.233 1.00 0.00 H new ATOM 0 HB ILE A 44 -12.227 1.138 -9.109 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.531 1.090 -7.732 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.540 2.521 -7.809 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -11.390 -1.068 -8.389 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -11.480 -0.912 -10.160 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -9.907 -0.797 -9.335 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.859 1.335 -5.704 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -12.355 1.318 -6.668 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -11.330 -0.135 -6.590 1.00 0.00 H new ATOM 362 N LYS A 45 -12.048 3.631 -10.292 1.00 0.00 N ATOM 363 CA LYS A 45 -12.444 4.972 -9.988 1.00 0.00 C ATOM 364 C LYS A 45 -12.435 5.155 -8.473 1.00 0.00 C ATOM 365 O LYS A 45 -13.258 4.583 -7.763 1.00 0.00 O ATOM 366 CB LYS A 45 -13.847 5.262 -10.502 1.00 0.00 C ATOM 367 CG LYS A 45 -14.264 6.714 -10.337 1.00 0.00 C ATOM 368 CD LYS A 45 -13.633 7.593 -11.404 1.00 0.00 C ATOM 369 CE LYS A 45 -13.851 9.079 -11.130 1.00 0.00 C ATOM 370 NZ LYS A 45 -15.255 9.403 -10.791 1.00 0.00 N ATOM 0 H LYS A 45 -12.789 3.056 -10.693 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.746 5.656 -10.471 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.902 4.994 -11.557 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -14.558 4.626 -9.974 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -15.350 6.792 -10.394 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -13.970 7.069 -9.349 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.564 7.388 -11.456 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -14.054 7.339 -12.377 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.204 9.391 -10.310 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -13.553 9.653 -12.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -15.393 10.433 -10.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -15.892 8.941 -11.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -15.468 9.063 -9.832 1.00 0.00 H new ATOM 384 N VAL A 46 -11.497 5.890 -7.992 1.00 0.00 N ATOM 385 CA VAL A 46 -11.404 6.166 -6.592 1.00 0.00 C ATOM 386 C VAL A 46 -11.988 7.523 -6.308 1.00 0.00 C ATOM 387 O VAL A 46 -11.490 8.555 -6.762 1.00 0.00 O ATOM 388 CB VAL A 46 -9.955 6.076 -6.092 1.00 0.00 C ATOM 389 CG1 VAL A 46 -9.861 6.347 -4.603 1.00 0.00 C ATOM 390 CG2 VAL A 46 -9.383 4.721 -6.432 1.00 0.00 C ATOM 0 H VAL A 46 -10.766 6.322 -8.556 1.00 0.00 H new ATOM 0 HA VAL A 46 -11.974 5.410 -6.052 1.00 0.00 H new ATOM 0 HB VAL A 46 -9.369 6.846 -6.594 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -8.821 6.275 -4.285 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -10.236 7.348 -4.391 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -10.458 5.613 -4.061 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.355 4.660 -6.076 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -9.979 3.944 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -9.402 4.579 -7.513 1.00 0.00 H new ATOM 400 N GLU A 47 -13.056 7.501 -5.626 1.00 0.00 N ATOM 401 CA GLU A 47 -13.760 8.687 -5.246 1.00 0.00 C ATOM 402 C GLU A 47 -13.180 9.196 -3.940 1.00 0.00 C ATOM 403 O GLU A 47 -12.925 10.391 -3.761 1.00 0.00 O ATOM 404 CB GLU A 47 -15.221 8.337 -5.059 1.00 0.00 C ATOM 405 CG GLU A 47 -15.862 7.776 -6.261 1.00 0.00 C ATOM 406 CD GLU A 47 -16.156 8.788 -7.334 1.00 0.00 C ATOM 407 OE1 GLU A 47 -15.265 9.108 -8.139 1.00 0.00 O ATOM 408 OE2 GLU A 47 -17.306 9.272 -7.403 1.00 0.00 O ATOM 0 H GLU A 47 -13.493 6.640 -5.298 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.664 9.458 -6.011 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -15.310 7.619 -4.244 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -15.763 9.233 -4.756 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -15.216 7.002 -6.675 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.794 7.292 -5.969 1.00 0.00 H new ATOM 415 N SER A 48 -12.931 8.274 -3.075 1.00 0.00 N ATOM 416 CA SER A 48 -12.424 8.515 -1.784 1.00 0.00 C ATOM 417 C SER A 48 -11.480 7.432 -1.465 1.00 0.00 C ATOM 418 O SER A 48 -11.481 6.419 -2.140 1.00 0.00 O ATOM 419 CB SER A 48 -13.552 8.511 -0.780 1.00 0.00 C ATOM 420 OG SER A 48 -14.350 9.682 -0.890 1.00 0.00 O ATOM 0 H SER A 48 -13.086 7.284 -3.267 1.00 0.00 H new ATOM 0 HA SER A 48 -11.928 9.485 -1.746 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.174 7.629 -0.934 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.143 8.441 0.228 1.00 0.00 H new ATOM 0 HG SER A 48 -13.885 10.436 -0.470 1.00 0.00 H new ATOM 426 N ILE A 49 -10.684 7.593 -0.444 1.00 0.00 N ATOM 427 CA ILE A 49 -9.753 6.581 -0.103 1.00 0.00 C ATOM 428 C ILE A 49 -10.478 5.290 0.325 1.00 0.00 C ATOM 429 O ILE A 49 -9.972 4.207 0.204 1.00 0.00 O ATOM 430 CB ILE A 49 -8.762 7.050 0.942 1.00 0.00 C ATOM 431 CG1 ILE A 49 -7.727 6.003 1.155 1.00 0.00 C ATOM 432 CG2 ILE A 49 -9.461 7.350 2.203 1.00 0.00 C ATOM 433 CD1 ILE A 49 -6.570 6.455 2.027 1.00 0.00 C ATOM 0 H ILE A 49 -10.669 8.416 0.158 1.00 0.00 H new ATOM 0 HA ILE A 49 -9.172 6.352 -0.996 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.275 7.961 0.594 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.195 5.130 1.611 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -7.338 5.687 0.187 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -8.740 7.686 2.948 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -10.199 8.134 2.032 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.963 6.452 2.563 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.856 5.638 2.137 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.076 7.308 1.563 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.945 6.743 3.009 1.00 0.00 H new ATOM 445 N GLU A 50 -11.671 5.445 0.751 1.00 0.00 N ATOM 446 CA GLU A 50 -12.548 4.316 1.063 1.00 0.00 C ATOM 447 C GLU A 50 -12.745 3.438 -0.203 1.00 0.00 C ATOM 448 O GLU A 50 -12.893 2.235 -0.106 1.00 0.00 O ATOM 449 CB GLU A 50 -13.911 4.795 1.514 1.00 0.00 C ATOM 450 CG GLU A 50 -13.926 5.726 2.704 1.00 0.00 C ATOM 451 CD GLU A 50 -13.538 5.079 4.005 1.00 0.00 C ATOM 452 OE1 GLU A 50 -14.244 4.170 4.460 1.00 0.00 O ATOM 453 OE2 GLU A 50 -12.586 5.533 4.632 1.00 0.00 O ATOM 0 H GLU A 50 -12.100 6.358 0.905 1.00 0.00 H new ATOM 0 HA GLU A 50 -12.079 3.743 1.863 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -14.392 5.300 0.676 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -14.520 3.923 1.752 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -13.247 6.556 2.509 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.925 6.149 2.806 1.00 0.00 H new ATOM 460 N ASP A 51 -12.693 4.058 -1.370 1.00 0.00 N ATOM 461 CA ASP A 51 -12.878 3.398 -2.638 1.00 0.00 C ATOM 462 C ASP A 51 -11.700 2.572 -3.007 1.00 0.00 C ATOM 463 O ASP A 51 -11.829 1.512 -3.567 1.00 0.00 O ATOM 464 CB ASP A 51 -13.080 4.421 -3.717 1.00 0.00 C ATOM 465 CG ASP A 51 -14.414 5.080 -3.668 1.00 0.00 C ATOM 466 OD1 ASP A 51 -14.560 6.045 -2.928 1.00 0.00 O ATOM 467 OD2 ASP A 51 -15.322 4.654 -4.388 1.00 0.00 O ATOM 0 H ASP A 51 -12.516 5.059 -1.457 1.00 0.00 H new ATOM 0 HA ASP A 51 -13.750 2.751 -2.541 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -12.304 5.182 -3.635 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -12.955 3.942 -4.688 1.00 0.00 H new ATOM 472 N VAL A 52 -10.559 3.040 -2.656 1.00 0.00 N ATOM 473 CA VAL A 52 -9.340 2.379 -3.006 1.00 0.00 C ATOM 474 C VAL A 52 -9.050 1.329 -2.005 1.00 0.00 C ATOM 475 O VAL A 52 -8.527 0.271 -2.302 1.00 0.00 O ATOM 476 CB VAL A 52 -8.180 3.383 -3.112 1.00 0.00 C ATOM 477 CG1 VAL A 52 -8.248 4.428 -2.081 1.00 0.00 C ATOM 478 CG2 VAL A 52 -6.829 2.709 -3.215 1.00 0.00 C ATOM 0 H VAL A 52 -10.435 3.896 -2.115 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.453 1.913 -3.985 1.00 0.00 H new ATOM 0 HB VAL A 52 -8.304 3.906 -4.060 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.407 5.111 -2.199 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -9.182 4.981 -2.184 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.206 3.968 -1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.049 3.467 -3.287 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.659 2.097 -2.329 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.804 2.077 -4.103 1.00 0.00 H new ATOM 488 N ARG A 53 -9.483 1.595 -0.834 1.00 0.00 N ATOM 489 CA ARG A 53 -9.301 0.728 0.239 1.00 0.00 C ATOM 490 C ARG A 53 -10.235 -0.498 0.045 1.00 0.00 C ATOM 491 O ARG A 53 -9.987 -1.593 0.556 1.00 0.00 O ATOM 492 CB ARG A 53 -9.487 1.579 1.519 1.00 0.00 C ATOM 493 CG ARG A 53 -10.824 1.847 2.017 1.00 0.00 C ATOM 494 CD ARG A 53 -11.349 0.672 2.711 1.00 0.00 C ATOM 495 NE ARG A 53 -12.098 1.013 3.898 1.00 0.00 N ATOM 496 CZ ARG A 53 -13.436 0.966 4.006 1.00 0.00 C ATOM 497 NH1 ARG A 53 -14.201 0.829 2.911 1.00 0.00 N ATOM 498 NH2 ARG A 53 -14.006 1.085 5.200 1.00 0.00 N ATOM 0 H ARG A 53 -9.988 2.450 -0.599 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.310 0.282 0.320 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.934 1.088 2.320 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.006 2.541 1.343 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.803 2.700 2.695 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.482 2.114 1.190 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.990 0.110 2.031 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.522 0.017 2.984 1.00 0.00 H new ATOM 0 HE ARG A 53 -11.570 1.313 4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.767 0.760 1.991 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -15.217 0.794 2.999 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -13.428 1.212 6.031 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -15.022 1.050 5.286 1.00 0.00 H new ATOM 512 N ASN A 54 -11.250 -0.282 -0.790 1.00 0.00 N ATOM 513 CA ASN A 54 -12.217 -1.310 -1.222 1.00 0.00 C ATOM 514 C ASN A 54 -11.539 -2.420 -1.968 1.00 0.00 C ATOM 515 O ASN A 54 -11.976 -3.565 -1.915 1.00 0.00 O ATOM 516 CB ASN A 54 -13.283 -0.730 -2.140 1.00 0.00 C ATOM 517 CG ASN A 54 -14.378 0.016 -1.420 1.00 0.00 C ATOM 518 OD1 ASN A 54 -14.702 -0.277 -0.260 1.00 0.00 O ATOM 519 ND2 ASN A 54 -14.984 0.950 -2.097 1.00 0.00 N ATOM 0 H ASN A 54 -11.434 0.634 -1.200 1.00 0.00 H new ATOM 0 HA ASN A 54 -12.676 -1.691 -0.310 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -12.806 -0.056 -2.852 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -13.729 -1.540 -2.718 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -15.754 1.469 -1.674 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -14.689 1.163 -3.050 1.00 0.00 H new ATOM 526 N GLN A 55 -10.459 -2.084 -2.657 1.00 0.00 N ATOM 527 CA GLN A 55 -9.695 -3.056 -3.432 1.00 0.00 C ATOM 528 C GLN A 55 -9.180 -4.126 -2.507 1.00 0.00 C ATOM 529 O GLN A 55 -9.145 -5.295 -2.841 1.00 0.00 O ATOM 530 CB GLN A 55 -8.529 -2.374 -4.131 1.00 0.00 C ATOM 531 CG GLN A 55 -8.953 -1.242 -5.029 1.00 0.00 C ATOM 532 CD GLN A 55 -7.786 -0.487 -5.651 1.00 0.00 C ATOM 533 OE1 GLN A 55 -6.713 -1.031 -5.876 1.00 0.00 O ATOM 534 NE2 GLN A 55 -8.000 0.775 -5.936 1.00 0.00 N ATOM 0 H GLN A 55 -10.087 -1.135 -2.696 1.00 0.00 H new ATOM 0 HA GLN A 55 -10.341 -3.501 -4.189 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -7.837 -1.993 -3.380 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -7.986 -3.112 -4.721 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.584 -1.638 -5.825 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.563 -0.543 -4.456 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -8.907 1.197 -5.735 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -7.260 1.335 -6.359 1.00 0.00 H new ATOM 543 N CYS A 56 -8.842 -3.720 -1.313 1.00 0.00 N ATOM 544 CA CYS A 56 -8.362 -4.607 -0.337 1.00 0.00 C ATOM 545 C CYS A 56 -9.473 -5.308 0.375 1.00 0.00 C ATOM 546 O CYS A 56 -9.392 -6.525 0.608 1.00 0.00 O ATOM 547 CB CYS A 56 -7.503 -3.882 0.639 1.00 0.00 C ATOM 548 SG CYS A 56 -6.046 -3.168 -0.106 1.00 0.00 S ATOM 0 H CYS A 56 -8.900 -2.749 -1.006 1.00 0.00 H new ATOM 0 HA CYS A 56 -7.768 -5.366 -0.847 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -8.087 -3.092 1.111 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.200 -4.570 1.429 1.00 0.00 H new ATOM 553 N THR A 57 -10.533 -4.581 0.686 1.00 0.00 N ATOM 554 CA THR A 57 -11.652 -5.141 1.422 1.00 0.00 C ATOM 555 C THR A 57 -12.359 -6.194 0.615 1.00 0.00 C ATOM 556 O THR A 57 -13.001 -7.092 1.157 1.00 0.00 O ATOM 557 CB THR A 57 -12.617 -4.061 1.918 1.00 0.00 C ATOM 558 OG1 THR A 57 -13.160 -3.343 0.813 1.00 0.00 O ATOM 559 CG2 THR A 57 -11.883 -3.092 2.817 1.00 0.00 C ATOM 0 H THR A 57 -10.641 -3.597 0.439 1.00 0.00 H new ATOM 0 HA THR A 57 -11.245 -5.623 2.311 1.00 0.00 H new ATOM 0 HB THR A 57 -13.423 -4.543 2.472 1.00 0.00 H new ATOM 0 HG1 THR A 57 -12.747 -3.659 -0.017 1.00 0.00 H new ATOM 0 HG21 THR A 57 -12.574 -2.325 3.167 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.473 -3.629 3.672 1.00 0.00 H new ATOM 0 HG23 THR A 57 -11.072 -2.622 2.260 1.00 0.00 H new ATOM 567 N ASP A 58 -12.149 -6.126 -0.677 1.00 0.00 N ATOM 568 CA ASP A 58 -12.670 -7.108 -1.618 1.00 0.00 C ATOM 569 C ASP A 58 -12.052 -8.472 -1.348 1.00 0.00 C ATOM 570 O ASP A 58 -12.663 -9.502 -1.578 1.00 0.00 O ATOM 571 CB ASP A 58 -12.374 -6.687 -3.060 1.00 0.00 C ATOM 572 CG ASP A 58 -12.806 -7.727 -4.077 1.00 0.00 C ATOM 573 OD1 ASP A 58 -14.010 -7.867 -4.331 1.00 0.00 O ATOM 574 OD2 ASP A 58 -11.925 -8.430 -4.632 1.00 0.00 O ATOM 0 H ASP A 58 -11.607 -5.382 -1.117 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.750 -7.168 -1.485 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -12.883 -5.746 -3.271 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -11.305 -6.502 -3.168 1.00 0.00 H new ATOM 579 N HIS A 59 -10.863 -8.464 -0.775 1.00 0.00 N ATOM 580 CA HIS A 59 -10.129 -9.682 -0.513 1.00 0.00 C ATOM 581 C HIS A 59 -10.253 -10.055 0.941 1.00 0.00 C ATOM 582 O HIS A 59 -9.596 -10.978 1.406 1.00 0.00 O ATOM 583 CB HIS A 59 -8.632 -9.543 -0.850 1.00 0.00 C ATOM 584 CG HIS A 59 -8.292 -9.247 -2.287 1.00 0.00 C ATOM 585 ND1 HIS A 59 -8.330 -8.098 -2.970 1.00 0.00 N flip ATOM 586 CD2 HIS A 59 -7.815 -10.183 -3.174 1.00 0.00 C flip ATOM 587 CE1 HIS A 59 -7.890 -8.342 -4.232 1.00 0.00 C flip ATOM 588 NE2 HIS A 59 -7.584 -9.605 -4.331 1.00 0.00 N flip ATOM 0 H HIS A 59 -10.382 -7.614 -0.480 1.00 0.00 H new ATOM 0 HA HIS A 59 -10.559 -10.454 -1.151 1.00 0.00 H new ATOM 0 HB2 HIS A 59 -8.215 -8.749 -0.230 1.00 0.00 H new ATOM 0 HB3 HIS A 59 -8.131 -10.468 -0.564 1.00 0.00 H new ATOM 0 HD1 HIS A 59 -8.636 -7.195 -2.607 1.00 0.00 H new ATOM 0 HD2 HIS A 59 -7.655 -11.228 -2.954 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -7.807 -7.611 -5.022 1.00 0.00 H new ATOM 597 N GLY A 60 -11.097 -9.337 1.660 1.00 0.00 N ATOM 598 CA GLY A 60 -11.220 -9.574 3.078 1.00 0.00 C ATOM 599 C GLY A 60 -10.084 -8.925 3.836 1.00 0.00 C ATOM 600 O GLY A 60 -9.779 -9.276 4.968 1.00 0.00 O ATOM 0 H GLY A 60 -11.696 -8.599 1.290 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.172 -9.181 3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.226 -10.647 3.272 1.00 0.00 H new ATOM 604 N ALA A 61 -9.463 -7.981 3.192 1.00 0.00 N ATOM 605 CA ALA A 61 -8.341 -7.261 3.747 1.00 0.00 C ATOM 606 C ALA A 61 -8.711 -5.809 3.837 1.00 0.00 C ATOM 607 O ALA A 61 -9.830 -5.460 3.560 1.00 0.00 O ATOM 608 CB ALA A 61 -7.113 -7.445 2.867 1.00 0.00 C ATOM 0 H ALA A 61 -9.721 -7.681 2.252 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.103 -7.643 4.740 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -6.273 -6.898 3.295 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -6.863 -8.504 2.808 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -7.322 -7.065 1.867 1.00 0.00 H new ATOM 614 N ASP A 62 -7.831 -4.995 4.287 1.00 0.00 N ATOM 615 CA ASP A 62 -8.043 -3.561 4.264 1.00 0.00 C ATOM 616 C ASP A 62 -6.704 -2.972 3.909 1.00 0.00 C ATOM 617 O ASP A 62 -5.748 -3.731 3.792 1.00 0.00 O ATOM 618 CB ASP A 62 -8.574 -3.004 5.591 1.00 0.00 C ATOM 619 CG ASP A 62 -9.430 -1.760 5.376 1.00 0.00 C ATOM 620 OD1 ASP A 62 -9.054 -0.898 4.563 1.00 0.00 O ATOM 621 OD2 ASP A 62 -10.511 -1.646 6.024 1.00 0.00 O ATOM 0 H ASP A 62 -6.938 -5.284 4.685 1.00 0.00 H new ATOM 0 HA ASP A 62 -8.816 -3.298 3.541 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.163 -3.769 6.097 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.737 -2.761 6.245 1.00 0.00 H new ATOM 626 N MET A 63 -6.614 -1.706 3.635 1.00 0.00 N ATOM 627 CA MET A 63 -5.324 -1.125 3.240 1.00 0.00 C ATOM 628 C MET A 63 -4.255 -1.252 4.338 1.00 0.00 C ATOM 629 O MET A 63 -4.565 -1.361 5.537 1.00 0.00 O ATOM 630 CB MET A 63 -5.424 0.327 2.749 1.00 0.00 C ATOM 631 CG MET A 63 -6.199 0.511 1.474 1.00 0.00 C ATOM 632 SD MET A 63 -6.302 2.244 0.934 1.00 0.00 S ATOM 633 CE MET A 63 -4.587 2.643 0.590 1.00 0.00 C ATOM 0 H MET A 63 -7.392 -1.048 3.670 1.00 0.00 H new ATOM 0 HA MET A 63 -5.005 -1.725 2.388 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.889 0.928 3.530 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.416 0.717 2.604 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.733 -0.080 0.686 1.00 0.00 H new ATOM 0 HG3 MET A 63 -7.207 0.121 1.611 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.425 3.711 0.739 1.00 0.00 H new ATOM 0 HE2 MET A 63 -3.940 2.080 1.263 1.00 0.00 H new ATOM 0 HE3 MET A 63 -4.352 2.381 -0.442 1.00 0.00 H new ATOM 643 N ILE A 64 -3.023 -1.336 3.875 1.00 0.00 N ATOM 644 CA ILE A 64 -1.779 -1.390 4.673 1.00 0.00 C ATOM 645 C ILE A 64 -1.782 -0.430 5.910 1.00 0.00 C ATOM 646 O ILE A 64 -2.393 0.618 5.890 1.00 0.00 O ATOM 647 CB ILE A 64 -0.580 -1.052 3.734 1.00 0.00 C ATOM 648 CG1 ILE A 64 0.669 -0.701 4.521 1.00 0.00 C ATOM 649 CG2 ILE A 64 -0.939 0.024 2.715 1.00 0.00 C ATOM 650 CD1 ILE A 64 1.813 -0.196 3.698 1.00 0.00 C ATOM 0 H ILE A 64 -2.835 -1.371 2.873 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.692 -2.397 5.082 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.353 -1.955 3.167 1.00 0.00 H new ATOM 0 HG12 ILE A 64 0.413 0.055 5.263 1.00 0.00 H new ATOM 0 HG13 ILE A 64 0.997 -1.585 5.068 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.075 0.228 2.082 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.768 -0.322 2.097 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.231 0.936 3.236 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.658 0.028 4.349 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.104 -0.957 2.974 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.511 0.709 3.172 1.00 0.00 H new ATOM 662 N SER A 65 -1.060 -0.783 6.958 1.00 0.00 N ATOM 663 CA SER A 65 -1.043 -0.016 8.179 1.00 0.00 C ATOM 664 C SER A 65 0.230 -0.284 8.962 1.00 0.00 C ATOM 665 O SER A 65 0.481 -1.408 9.424 1.00 0.00 O ATOM 666 CB SER A 65 -2.279 -0.289 9.019 1.00 0.00 C ATOM 667 OG SER A 65 -3.472 0.141 8.349 1.00 0.00 O ATOM 0 H SER A 65 -0.469 -1.614 6.981 1.00 0.00 H new ATOM 0 HA SER A 65 -1.058 1.041 7.915 1.00 0.00 H new ATOM 0 HB2 SER A 65 -2.346 -1.355 9.235 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.192 0.226 9.976 1.00 0.00 H new ATOM 0 HG SER A 65 -3.243 0.484 7.460 1.00 0.00 H new ATOM 673 N ILE A 66 0.974 0.764 9.162 1.00 0.00 N ATOM 674 CA ILE A 66 2.290 0.697 9.717 1.00 0.00 C ATOM 675 C ILE A 66 2.297 1.048 11.173 1.00 0.00 C ATOM 676 O ILE A 66 1.843 2.112 11.584 1.00 0.00 O ATOM 677 CB ILE A 66 3.210 1.671 8.968 1.00 0.00 C ATOM 678 CG1 ILE A 66 3.085 1.384 7.467 1.00 0.00 C ATOM 679 CG2 ILE A 66 4.625 1.511 9.458 1.00 0.00 C ATOM 680 CD1 ILE A 66 3.967 2.161 6.545 1.00 0.00 C ATOM 0 H ILE A 66 0.673 1.712 8.937 1.00 0.00 H new ATOM 0 HA ILE A 66 2.644 -0.328 9.610 1.00 0.00 H new ATOM 0 HB ILE A 66 2.922 2.706 9.153 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.282 0.324 7.309 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.050 1.563 7.174 1.00 0.00 H new ATOM 0 HG21 ILE A 66 5.275 2.204 8.924 1.00 0.00 H new ATOM 0 HG22 ILE A 66 4.666 1.724 10.526 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.959 0.489 9.279 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.774 1.858 5.516 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.760 3.226 6.655 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.011 1.967 6.791 1.00 0.00 H new ATOM 692 N HIS A 67 2.777 0.153 11.955 1.00 0.00 N ATOM 693 CA HIS A 67 2.909 0.404 13.348 1.00 0.00 C ATOM 694 C HIS A 67 4.348 0.365 13.757 1.00 0.00 C ATOM 695 O HIS A 67 4.659 0.594 14.917 1.00 0.00 O ATOM 696 CB HIS A 67 2.076 -0.570 14.181 1.00 0.00 C ATOM 697 CG HIS A 67 0.599 -0.399 14.010 1.00 0.00 C ATOM 698 ND1 HIS A 67 -0.193 0.197 14.947 1.00 0.00 N ATOM 699 CD2 HIS A 67 -0.231 -0.768 13.007 1.00 0.00 C ATOM 700 CE1 HIS A 67 -1.435 0.189 14.543 1.00 0.00 C ATOM 701 NE2 HIS A 67 -1.499 -0.397 13.363 1.00 0.00 N ATOM 0 H HIS A 67 3.089 -0.770 11.654 1.00 0.00 H new ATOM 0 HA HIS A 67 2.523 1.405 13.541 1.00 0.00 H new ATOM 0 HB2 HIS A 67 2.348 -1.590 13.910 1.00 0.00 H new ATOM 0 HB3 HIS A 67 2.328 -0.441 15.234 1.00 0.00 H new ATOM 0 HD1 HIS A 67 0.135 0.589 15.829 1.00 0.00 H new ATOM 0 HD2 HIS A 67 0.055 -1.265 12.092 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.274 0.596 15.087 1.00 0.00 H new ATOM 710 N ASN A 68 5.262 0.110 12.789 1.00 0.00 N ATOM 711 CA ASN A 68 6.700 0.033 13.099 1.00 0.00 C ATOM 712 C ASN A 68 7.430 0.165 11.806 1.00 0.00 C ATOM 713 O ASN A 68 6.846 -0.075 10.760 1.00 0.00 O ATOM 714 CB ASN A 68 7.122 -1.337 13.699 1.00 0.00 C ATOM 715 CG ASN A 68 6.337 -1.831 14.888 1.00 0.00 C ATOM 716 OD1 ASN A 68 6.664 -1.564 16.044 1.00 0.00 O ATOM 717 ND2 ASN A 68 5.299 -2.561 14.613 1.00 0.00 N ATOM 0 H ASN A 68 5.030 -0.042 11.807 1.00 0.00 H new ATOM 0 HA ASN A 68 6.926 0.812 13.827 1.00 0.00 H new ATOM 0 HB2 ASN A 68 7.054 -2.088 12.912 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.171 -1.272 13.988 1.00 0.00 H new ATOM 0 HD21 ASN A 68 4.724 -2.934 15.368 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.059 -2.761 13.642 1.00 0.00 H new ATOM 724 N GLU A 69 8.718 0.488 11.852 1.00 0.00 N ATOM 725 CA GLU A 69 9.492 0.570 10.648 1.00 0.00 C ATOM 726 C GLU A 69 9.711 -0.791 10.079 1.00 0.00 C ATOM 727 O GLU A 69 10.045 -0.927 8.923 1.00 0.00 O ATOM 728 CB GLU A 69 10.809 1.265 10.840 1.00 0.00 C ATOM 729 CG GLU A 69 11.761 0.650 11.820 1.00 0.00 C ATOM 730 CD GLU A 69 13.008 1.485 11.944 1.00 0.00 C ATOM 731 OE1 GLU A 69 13.935 1.325 11.122 1.00 0.00 O ATOM 732 OE2 GLU A 69 13.077 2.350 12.837 1.00 0.00 O ATOM 0 H GLU A 69 9.232 0.693 12.709 1.00 0.00 H new ATOM 0 HA GLU A 69 8.914 1.175 9.949 1.00 0.00 H new ATOM 0 HB2 GLU A 69 11.307 1.322 9.872 1.00 0.00 H new ATOM 0 HB3 GLU A 69 10.610 2.289 11.157 1.00 0.00 H new ATOM 0 HG2 GLU A 69 11.280 0.558 12.794 1.00 0.00 H new ATOM 0 HG3 GLU A 69 12.022 -0.358 11.498 1.00 0.00 H new ATOM 739 N GLU A 70 9.509 -1.792 10.915 1.00 0.00 N ATOM 740 CA GLU A 70 9.560 -3.151 10.525 1.00 0.00 C ATOM 741 C GLU A 70 8.568 -3.340 9.383 1.00 0.00 C ATOM 742 O GLU A 70 8.923 -3.853 8.343 1.00 0.00 O ATOM 743 CB GLU A 70 9.148 -3.964 11.727 1.00 0.00 C ATOM 744 CG GLU A 70 10.110 -5.039 12.185 1.00 0.00 C ATOM 745 CD GLU A 70 10.089 -6.275 11.342 1.00 0.00 C ATOM 746 OE1 GLU A 70 10.791 -6.328 10.309 1.00 0.00 O ATOM 747 OE2 GLU A 70 9.386 -7.239 11.718 1.00 0.00 O ATOM 0 H GLU A 70 9.301 -1.658 11.905 1.00 0.00 H new ATOM 0 HA GLU A 70 10.551 -3.458 10.191 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.981 -3.280 12.559 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.191 -4.436 11.506 1.00 0.00 H new ATOM 0 HG2 GLU A 70 11.121 -4.631 12.187 1.00 0.00 H new ATOM 0 HG3 GLU A 70 9.873 -5.310 13.214 1.00 0.00 H new ATOM 754 N GLU A 71 7.346 -2.832 9.590 1.00 0.00 N ATOM 755 CA GLU A 71 6.271 -2.881 8.595 1.00 0.00 C ATOM 756 C GLU A 71 6.679 -1.997 7.450 1.00 0.00 C ATOM 757 O GLU A 71 6.813 -2.457 6.352 1.00 0.00 O ATOM 758 CB GLU A 71 4.965 -2.336 9.224 1.00 0.00 C ATOM 759 CG GLU A 71 3.608 -2.713 8.578 1.00 0.00 C ATOM 760 CD GLU A 71 3.263 -2.110 7.295 1.00 0.00 C ATOM 761 OE1 GLU A 71 3.973 -1.256 6.856 1.00 0.00 O ATOM 762 OE2 GLU A 71 2.165 -2.449 6.776 1.00 0.00 O ATOM 0 H GLU A 71 7.075 -2.373 10.460 1.00 0.00 H new ATOM 0 HA GLU A 71 6.101 -3.903 8.256 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.938 -2.664 10.263 1.00 0.00 H new ATOM 0 HB3 GLU A 71 5.034 -1.248 9.235 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.588 -3.796 8.453 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.820 -2.460 9.287 1.00 0.00 H new ATOM 769 N ASN A 72 7.014 -0.750 7.775 1.00 0.00 N ATOM 770 CA ASN A 72 7.277 0.286 6.800 1.00 0.00 C ATOM 771 C ASN A 72 8.301 -0.174 5.781 1.00 0.00 C ATOM 772 O ASN A 72 8.076 -0.177 4.571 1.00 0.00 O ATOM 773 CB ASN A 72 7.818 1.520 7.520 1.00 0.00 C ATOM 774 CG ASN A 72 8.096 2.659 6.588 1.00 0.00 C ATOM 775 OD1 ASN A 72 7.256 3.462 6.351 1.00 0.00 O ATOM 776 ND2 ASN A 72 9.277 2.721 6.054 1.00 0.00 N ATOM 0 H ASN A 72 7.110 -0.434 8.740 1.00 0.00 H new ATOM 0 HA ASN A 72 6.347 0.518 6.281 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.098 1.840 8.274 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.735 1.255 8.047 1.00 0.00 H new ATOM 0 HD21 ASN A 72 9.506 3.477 5.409 1.00 0.00 H new ATOM 0 HD22 ASN A 72 9.976 2.014 6.280 1.00 0.00 H new ATOM 783 N ALA A 73 9.404 -0.615 6.298 1.00 0.00 N ATOM 784 CA ALA A 73 10.516 -1.038 5.510 1.00 0.00 C ATOM 785 C ALA A 73 10.301 -2.446 4.916 1.00 0.00 C ATOM 786 O ALA A 73 10.986 -2.837 3.962 1.00 0.00 O ATOM 787 CB ALA A 73 11.758 -0.936 6.338 1.00 0.00 C ATOM 0 H ALA A 73 9.559 -0.692 7.303 1.00 0.00 H new ATOM 0 HA ALA A 73 10.622 -0.382 4.646 1.00 0.00 H new ATOM 0 HB1 ALA A 73 12.616 -1.257 5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 73 11.901 0.097 6.654 1.00 0.00 H new ATOM 0 HB3 ALA A 73 11.663 -1.574 7.216 1.00 0.00 H new ATOM 793 N PHE A 74 9.366 -3.199 5.489 1.00 0.00 N ATOM 794 CA PHE A 74 8.937 -4.490 4.943 1.00 0.00 C ATOM 795 C PHE A 74 8.294 -4.255 3.611 1.00 0.00 C ATOM 796 O PHE A 74 8.760 -4.731 2.595 1.00 0.00 O ATOM 797 CB PHE A 74 7.887 -5.126 5.863 1.00 0.00 C ATOM 798 CG PHE A 74 7.033 -6.146 5.302 1.00 0.00 C ATOM 799 CD1 PHE A 74 7.495 -7.378 4.883 1.00 0.00 C ATOM 800 CD2 PHE A 74 5.746 -5.864 5.211 1.00 0.00 C ATOM 801 CE1 PHE A 74 6.605 -8.293 4.370 1.00 0.00 C ATOM 802 CE2 PHE A 74 4.879 -6.711 4.728 1.00 0.00 C ATOM 803 CZ PHE A 74 5.274 -7.949 4.290 1.00 0.00 C ATOM 0 H PHE A 74 8.882 -2.934 6.347 1.00 0.00 H new ATOM 0 HA PHE A 74 9.803 -5.147 4.856 1.00 0.00 H new ATOM 0 HB2 PHE A 74 8.407 -5.557 6.718 1.00 0.00 H new ATOM 0 HB3 PHE A 74 7.250 -4.329 6.246 1.00 0.00 H new ATOM 0 HD1 PHE A 74 8.545 -7.621 4.957 1.00 0.00 H new ATOM 0 HD2 PHE A 74 5.399 -4.898 5.548 1.00 0.00 H new ATOM 0 HE1 PHE A 74 6.944 -9.263 4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.837 -6.433 4.672 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.552 -8.644 3.888 1.00 0.00 H new ATOM 813 N ILE A 75 7.294 -3.395 3.648 1.00 0.00 N ATOM 814 CA ILE A 75 6.356 -3.081 2.548 1.00 0.00 C ATOM 815 C ILE A 75 7.137 -2.607 1.432 1.00 0.00 C ATOM 816 O ILE A 75 6.966 -3.003 0.297 1.00 0.00 O ATOM 817 CB ILE A 75 5.448 -1.919 2.989 1.00 0.00 C ATOM 818 CG1 ILE A 75 4.803 -2.206 4.281 1.00 0.00 C ATOM 819 CG2 ILE A 75 4.400 -1.607 2.004 1.00 0.00 C ATOM 820 CD1 ILE A 75 3.868 -3.359 4.282 1.00 0.00 C ATOM 0 H ILE A 75 7.089 -2.857 4.490 1.00 0.00 H new ATOM 0 HA ILE A 75 5.765 -3.960 2.289 1.00 0.00 H new ATOM 0 HB ILE A 75 6.105 -1.054 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.580 -2.389 5.023 1.00 0.00 H new ATOM 0 HG13 ILE A 75 4.259 -1.318 4.602 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.791 -0.780 2.370 1.00 0.00 H new ATOM 0 HG22 ILE A 75 4.862 -1.327 1.057 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.769 -2.483 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 75 3.447 -3.485 5.280 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.064 -3.176 3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 75 4.406 -4.264 3.998 1.00 0.00 H new ATOM 832 N LEU A 76 8.053 -1.837 1.816 1.00 0.00 N ATOM 833 CA LEU A 76 8.928 -1.163 1.007 1.00 0.00 C ATOM 834 C LEU A 76 9.672 -2.077 0.060 1.00 0.00 C ATOM 835 O LEU A 76 9.754 -1.817 -1.106 1.00 0.00 O ATOM 836 CB LEU A 76 9.878 -0.454 1.897 1.00 0.00 C ATOM 837 CG LEU A 76 10.110 0.931 1.480 1.00 0.00 C ATOM 838 CD1 LEU A 76 8.925 1.707 1.905 1.00 0.00 C ATOM 839 CD2 LEU A 76 11.378 1.532 1.985 1.00 0.00 C ATOM 0 H LEU A 76 8.217 -1.651 2.805 1.00 0.00 H new ATOM 0 HA LEU A 76 8.374 -0.470 0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 76 9.492 -0.463 2.916 1.00 0.00 H new ATOM 0 HB3 LEU A 76 10.827 -0.990 1.911 1.00 0.00 H new ATOM 0 HG LEU A 76 10.240 0.952 0.398 1.00 0.00 H new ATOM 0 HD11 LEU A 76 9.050 2.750 1.616 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.034 1.302 1.426 1.00 0.00 H new ATOM 0 HD13 LEU A 76 8.816 1.641 2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 76 11.463 2.557 1.625 1.00 0.00 H new ATOM 0 HD22 LEU A 76 11.373 1.529 3.075 1.00 0.00 H new ATOM 0 HD23 LEU A 76 12.226 0.949 1.624 1.00 0.00 H new ATOM 851 N ASP A 77 10.217 -3.118 0.566 1.00 0.00 N ATOM 852 CA ASP A 77 10.941 -4.079 -0.290 1.00 0.00 C ATOM 853 C ASP A 77 10.007 -5.075 -0.850 1.00 0.00 C ATOM 854 O ASP A 77 10.135 -5.485 -1.979 1.00 0.00 O ATOM 855 CB ASP A 77 11.970 -4.828 0.508 1.00 0.00 C ATOM 856 CG ASP A 77 12.815 -5.757 -0.349 1.00 0.00 C ATOM 857 OD1 ASP A 77 13.736 -5.266 -1.039 1.00 0.00 O ATOM 858 OD2 ASP A 77 12.589 -6.976 -0.346 1.00 0.00 O ATOM 0 H ASP A 77 10.196 -3.357 1.557 1.00 0.00 H new ATOM 0 HA ASP A 77 11.419 -3.509 -1.087 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.621 -4.115 1.014 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.470 -5.409 1.283 1.00 0.00 H new ATOM 863 N THR A 78 9.012 -5.360 -0.092 1.00 0.00 N ATOM 864 CA THR A 78 8.137 -6.466 -0.328 1.00 0.00 C ATOM 865 C THR A 78 7.298 -6.213 -1.517 1.00 0.00 C ATOM 866 O THR A 78 6.964 -7.134 -2.290 1.00 0.00 O ATOM 867 CB THR A 78 7.301 -6.695 0.914 1.00 0.00 C ATOM 868 OG1 THR A 78 8.153 -7.182 1.935 1.00 0.00 O ATOM 869 CG2 THR A 78 6.159 -7.629 0.694 1.00 0.00 C ATOM 0 H THR A 78 8.770 -4.818 0.737 1.00 0.00 H new ATOM 0 HA THR A 78 8.714 -7.368 -0.533 1.00 0.00 H new ATOM 0 HB THR A 78 6.851 -5.745 1.200 1.00 0.00 H new ATOM 0 HG1 THR A 78 7.623 -7.385 2.734 1.00 0.00 H new ATOM 0 HG21 THR A 78 5.602 -7.748 1.623 1.00 0.00 H new ATOM 0 HG22 THR A 78 5.500 -7.224 -0.074 1.00 0.00 H new ATOM 0 HG23 THR A 78 6.539 -8.598 0.372 1.00 0.00 H new ATOM 877 N LEU A 79 7.018 -4.967 -1.677 1.00 0.00 N ATOM 878 CA LEU A 79 6.286 -4.486 -2.730 1.00 0.00 C ATOM 879 C LEU A 79 6.939 -4.911 -4.031 1.00 0.00 C ATOM 880 O LEU A 79 6.367 -5.621 -4.831 1.00 0.00 O ATOM 881 CB LEU A 79 6.279 -2.996 -2.642 1.00 0.00 C ATOM 882 CG LEU A 79 4.964 -2.327 -2.837 1.00 0.00 C ATOM 883 CD1 LEU A 79 4.167 -2.999 -3.918 1.00 0.00 C ATOM 884 CD2 LEU A 79 4.211 -2.280 -1.504 1.00 0.00 C ATOM 0 H LEU A 79 7.322 -4.242 -1.028 1.00 0.00 H new ATOM 0 HA LEU A 79 5.268 -4.875 -2.698 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.666 -2.710 -1.664 1.00 0.00 H new ATOM 0 HB3 LEU A 79 6.974 -2.607 -3.386 1.00 0.00 H new ATOM 0 HG LEU A 79 5.128 -1.302 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.212 -2.488 -4.037 1.00 0.00 H new ATOM 0 HD12 LEU A 79 4.720 -2.958 -4.856 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.990 -4.040 -3.646 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.248 -1.790 -1.647 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.051 -3.295 -1.140 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.797 -1.721 -0.774 1.00 0.00 H new ATOM 896 N LYS A 80 8.147 -4.477 -4.186 1.00 0.00 N ATOM 897 CA LYS A 80 8.956 -4.784 -5.343 1.00 0.00 C ATOM 898 C LYS A 80 9.457 -6.246 -5.393 1.00 0.00 C ATOM 899 O LYS A 80 9.675 -6.787 -6.479 1.00 0.00 O ATOM 900 CB LYS A 80 10.110 -3.827 -5.366 1.00 0.00 C ATOM 901 CG LYS A 80 9.638 -2.406 -5.356 1.00 0.00 C ATOM 902 CD LYS A 80 9.965 -1.770 -4.051 1.00 0.00 C ATOM 903 CE LYS A 80 11.493 -1.634 -3.840 1.00 0.00 C ATOM 904 NZ LYS A 80 11.860 -0.900 -2.602 1.00 0.00 N ATOM 0 H LYS A 80 8.619 -3.885 -3.502 1.00 0.00 H new ATOM 0 HA LYS A 80 8.329 -4.673 -6.228 1.00 0.00 H new ATOM 0 HB2 LYS A 80 10.751 -4.006 -4.503 1.00 0.00 H new ATOM 0 HB3 LYS A 80 10.715 -4.005 -6.255 1.00 0.00 H new ATOM 0 HG2 LYS A 80 10.109 -1.852 -6.168 1.00 0.00 H new ATOM 0 HG3 LYS A 80 8.562 -2.370 -5.528 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.503 -0.784 -4.002 1.00 0.00 H new ATOM 0 HD3 LYS A 80 9.538 -2.362 -3.242 1.00 0.00 H new ATOM 0 HE2 LYS A 80 11.937 -2.629 -3.807 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.925 -1.120 -4.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.688 -1.351 -2.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 12.088 0.087 -2.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 11.061 -0.921 -1.936 1.00 0.00 H new ATOM 918 N LYS A 81 9.678 -6.866 -4.238 1.00 0.00 N ATOM 919 CA LYS A 81 10.166 -8.183 -4.164 1.00 0.00 C ATOM 920 C LYS A 81 9.158 -9.233 -4.705 1.00 0.00 C ATOM 921 O LYS A 81 9.544 -10.144 -5.432 1.00 0.00 O ATOM 922 CB LYS A 81 10.611 -8.454 -2.734 1.00 0.00 C ATOM 923 CG LYS A 81 9.588 -9.044 -1.876 1.00 0.00 C ATOM 924 CD LYS A 81 10.082 -9.242 -0.445 1.00 0.00 C ATOM 925 CE LYS A 81 11.165 -10.284 -0.408 1.00 0.00 C ATOM 926 NZ LYS A 81 11.472 -10.740 0.967 1.00 0.00 N ATOM 0 H LYS A 81 9.511 -6.435 -3.329 1.00 0.00 H new ATOM 0 HA LYS A 81 11.028 -8.284 -4.824 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.474 -9.119 -2.757 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.943 -7.517 -2.288 1.00 0.00 H new ATOM 0 HG2 LYS A 81 8.707 -8.402 -1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 81 9.279 -10.005 -2.289 1.00 0.00 H new ATOM 0 HD2 LYS A 81 10.461 -8.299 -0.050 1.00 0.00 H new ATOM 0 HD3 LYS A 81 9.253 -9.546 0.195 1.00 0.00 H new ATOM 0 HE2 LYS A 81 10.861 -11.140 -1.011 1.00 0.00 H new ATOM 0 HE3 LYS A 81 12.069 -9.879 -0.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 12.224 -11.457 0.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 11.789 -9.931 1.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 10.618 -11.153 1.395 1.00 0.00 H new ATOM 940 N GLN A 82 7.885 -9.092 -4.366 1.00 0.00 N ATOM 941 CA GLN A 82 6.871 -10.037 -4.807 1.00 0.00 C ATOM 942 C GLN A 82 6.095 -9.504 -5.974 1.00 0.00 C ATOM 943 O GLN A 82 5.837 -10.216 -6.954 1.00 0.00 O ATOM 944 CB GLN A 82 5.901 -10.274 -3.688 1.00 0.00 C ATOM 945 CG GLN A 82 4.781 -11.277 -4.020 1.00 0.00 C ATOM 946 CD GLN A 82 5.211 -12.731 -4.114 1.00 0.00 C ATOM 947 OE1 GLN A 82 6.130 -13.142 -3.290 1.00 0.00 O flip ATOM 948 NE2 GLN A 82 4.651 -13.499 -4.897 1.00 0.00 N flip ATOM 0 H GLN A 82 7.530 -8.331 -3.786 1.00 0.00 H new ATOM 0 HA GLN A 82 7.378 -10.956 -5.101 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.450 -10.635 -2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 82 5.449 -9.323 -3.407 1.00 0.00 H new ATOM 0 HG2 GLN A 82 4.006 -11.194 -3.258 1.00 0.00 H new ATOM 0 HG3 GLN A 82 4.328 -10.988 -4.969 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.934 -13.147 -5.531 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.904 -14.487 -4.911 1.00 0.00 H new ATOM 957 N TRP A 83 5.735 -8.259 -5.875 1.00 0.00 N ATOM 958 CA TRP A 83 4.847 -7.643 -6.812 1.00 0.00 C ATOM 959 C TRP A 83 5.640 -6.662 -7.688 1.00 0.00 C ATOM 960 O TRP A 83 6.864 -6.777 -7.777 1.00 0.00 O ATOM 961 CB TRP A 83 3.707 -6.947 -6.029 1.00 0.00 C ATOM 962 CG TRP A 83 3.038 -7.833 -4.973 1.00 0.00 C ATOM 963 CD1 TRP A 83 2.278 -8.958 -5.148 1.00 0.00 C ATOM 964 CD2 TRP A 83 3.066 -7.604 -3.575 1.00 0.00 C ATOM 965 NE1 TRP A 83 1.864 -9.432 -3.910 1.00 0.00 N ATOM 966 CE2 TRP A 83 2.336 -8.608 -2.944 1.00 0.00 C ATOM 967 CE3 TRP A 83 3.650 -6.645 -2.824 1.00 0.00 C ATOM 968 CZ2 TRP A 83 2.181 -8.658 -1.562 1.00 0.00 C ATOM 969 CZ3 TRP A 83 3.512 -6.662 -1.458 1.00 0.00 C ATOM 970 CH2 TRP A 83 2.780 -7.664 -0.826 1.00 0.00 C ATOM 0 H TRP A 83 6.054 -7.637 -5.133 1.00 0.00 H new ATOM 0 HA TRP A 83 4.397 -8.382 -7.475 1.00 0.00 H new ATOM 0 HB2 TRP A 83 4.107 -6.058 -5.541 1.00 0.00 H new ATOM 0 HB3 TRP A 83 2.950 -6.609 -6.736 1.00 0.00 H new ATOM 0 HD1 TRP A 83 2.038 -9.407 -6.100 1.00 0.00 H new ATOM 0 HE1 TRP A 83 1.297 -10.265 -3.754 1.00 0.00 H new ATOM 0 HE3 TRP A 83 4.226 -5.864 -3.298 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 1.614 -9.445 -1.088 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 3.977 -5.888 -0.866 1.00 0.00 H new ATOM 0 HH2 TRP A 83 2.682 -7.660 0.250 1.00 0.00 H new ATOM 981 N LYS A 84 4.965 -5.740 -8.350 1.00 0.00 N ATOM 982 CA LYS A 84 5.649 -4.779 -9.220 1.00 0.00 C ATOM 983 C LYS A 84 6.454 -3.784 -8.406 1.00 0.00 C ATOM 984 O LYS A 84 7.684 -3.877 -8.299 1.00 0.00 O ATOM 985 CB LYS A 84 4.655 -4.022 -10.102 1.00 0.00 C ATOM 986 CG LYS A 84 3.806 -4.878 -11.026 1.00 0.00 C ATOM 987 CD LYS A 84 2.719 -4.031 -11.687 1.00 0.00 C ATOM 988 CE LYS A 84 3.299 -2.955 -12.602 1.00 0.00 C ATOM 989 NZ LYS A 84 2.255 -2.059 -13.145 1.00 0.00 N ATOM 0 H LYS A 84 3.952 -5.630 -8.308 1.00 0.00 H new ATOM 0 HA LYS A 84 6.324 -5.350 -9.858 1.00 0.00 H new ATOM 0 HB2 LYS A 84 3.990 -3.447 -9.457 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.209 -3.305 -10.708 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.435 -5.334 -11.790 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.350 -5.691 -10.462 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.058 -4.678 -12.264 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.110 -3.559 -10.916 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.029 -2.365 -12.048 1.00 0.00 H new ATOM 0 HE3 LYS A 84 3.832 -3.430 -13.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 2.704 -1.276 -13.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 1.640 -2.594 -13.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 1.686 -1.676 -12.364 1.00 0.00 H new ATOM 1003 N GLY A 85 5.759 -2.857 -7.844 1.00 0.00 N ATOM 1004 CA GLY A 85 6.324 -1.862 -7.071 1.00 0.00 C ATOM 1005 C GLY A 85 6.377 -0.574 -7.762 1.00 0.00 C ATOM 1006 O GLY A 85 7.025 -0.419 -8.788 1.00 0.00 O ATOM 0 H GLY A 85 4.745 -2.789 -7.927 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.751 -1.753 -6.150 1.00 0.00 H new ATOM 0 HA3 GLY A 85 7.333 -2.158 -6.785 1.00 0.00 H new ATOM 1010 N PRO A 86 5.661 0.327 -7.250 1.00 0.00 N ATOM 1011 CA PRO A 86 5.638 1.682 -7.688 1.00 0.00 C ATOM 1012 C PRO A 86 6.704 2.476 -6.947 1.00 0.00 C ATOM 1013 O PRO A 86 7.488 1.891 -6.212 1.00 0.00 O ATOM 1014 CB PRO A 86 4.245 2.084 -7.332 1.00 0.00 C ATOM 1015 CG PRO A 86 3.862 1.253 -6.161 1.00 0.00 C ATOM 1016 CD PRO A 86 4.811 0.132 -6.090 1.00 0.00 C ATOM 0 HA PRO A 86 5.859 1.846 -8.743 1.00 0.00 H new ATOM 0 HB2 PRO A 86 4.196 3.145 -7.089 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.566 1.916 -8.168 1.00 0.00 H new ATOM 0 HG2 PRO A 86 3.895 1.842 -5.245 1.00 0.00 H new ATOM 0 HG3 PRO A 86 2.841 0.886 -6.268 1.00 0.00 H new ATOM 0 HD2 PRO A 86 5.386 0.152 -5.164 1.00 0.00 H new ATOM 0 HD3 PRO A 86 4.299 -0.829 -6.126 1.00 0.00 H new ATOM 1024 N ASP A 87 6.808 3.756 -7.187 1.00 0.00 N ATOM 1025 CA ASP A 87 7.797 4.562 -6.432 1.00 0.00 C ATOM 1026 C ASP A 87 7.273 4.791 -5.058 1.00 0.00 C ATOM 1027 O ASP A 87 8.013 4.942 -4.101 1.00 0.00 O ATOM 1028 CB ASP A 87 8.030 5.894 -7.071 1.00 0.00 C ATOM 1029 CG ASP A 87 9.320 6.544 -6.608 1.00 0.00 C ATOM 1030 OD1 ASP A 87 10.395 6.115 -7.064 1.00 0.00 O ATOM 1031 OD2 ASP A 87 9.277 7.497 -5.789 1.00 0.00 O ATOM 0 H ASP A 87 6.252 4.271 -7.870 1.00 0.00 H new ATOM 0 HA ASP A 87 8.740 4.015 -6.417 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.056 5.774 -8.154 1.00 0.00 H new ATOM 0 HB3 ASP A 87 7.193 6.554 -6.843 1.00 0.00 H new ATOM 1036 N ASP A 88 5.988 4.842 -4.986 1.00 0.00 N ATOM 1037 CA ASP A 88 5.261 4.972 -3.747 1.00 0.00 C ATOM 1038 C ASP A 88 3.924 4.284 -3.817 1.00 0.00 C ATOM 1039 O ASP A 88 3.214 4.352 -4.827 1.00 0.00 O ATOM 1040 CB ASP A 88 5.131 6.430 -3.275 1.00 0.00 C ATOM 1041 CG ASP A 88 4.548 7.393 -4.319 1.00 0.00 C ATOM 1042 OD1 ASP A 88 5.264 7.757 -5.280 1.00 0.00 O ATOM 1043 OD2 ASP A 88 3.410 7.848 -4.176 1.00 0.00 O ATOM 0 H ASP A 88 5.385 4.794 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 88 5.855 4.464 -2.988 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.501 6.455 -2.386 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.116 6.791 -2.978 1.00 0.00 H new ATOM 1048 N ILE A 89 3.622 3.580 -2.762 1.00 0.00 N ATOM 1049 CA ILE A 89 2.384 2.816 -2.600 1.00 0.00 C ATOM 1050 C ILE A 89 1.491 3.544 -1.672 1.00 0.00 C ATOM 1051 O ILE A 89 1.977 4.264 -0.806 1.00 0.00 O ATOM 1052 CB ILE A 89 2.622 1.445 -1.975 1.00 0.00 C ATOM 1053 CG1 ILE A 89 3.229 1.593 -0.579 1.00 0.00 C ATOM 1054 CG2 ILE A 89 3.506 0.670 -2.868 1.00 0.00 C ATOM 1055 CD1 ILE A 89 4.728 1.546 -0.478 1.00 0.00 C ATOM 0 H ILE A 89 4.242 3.510 -1.955 1.00 0.00 H new ATOM 0 HA ILE A 89 1.956 2.692 -3.595 1.00 0.00 H new ATOM 0 HB ILE A 89 1.676 0.915 -1.860 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.891 2.541 -0.161 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.822 0.803 0.053 1.00 0.00 H new ATOM 0 HG21 ILE A 89 3.687 -0.314 -2.436 1.00 0.00 H new ATOM 0 HG22 ILE A 89 3.030 0.557 -3.842 1.00 0.00 H new ATOM 0 HG23 ILE A 89 4.454 1.194 -2.986 1.00 0.00 H new ATOM 0 HD11 ILE A 89 5.026 1.663 0.564 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.088 0.588 -0.854 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.158 2.353 -1.071 1.00 0.00 H new ATOM 1067 N LEU A 90 0.213 3.389 -1.804 1.00 0.00 N ATOM 1068 CA LEU A 90 -0.640 4.099 -0.938 1.00 0.00 C ATOM 1069 C LEU A 90 -0.591 3.469 0.425 1.00 0.00 C ATOM 1070 O LEU A 90 -0.557 2.245 0.549 1.00 0.00 O ATOM 1071 CB LEU A 90 -2.081 4.170 -1.475 1.00 0.00 C ATOM 1072 CG LEU A 90 -2.780 5.517 -1.535 1.00 0.00 C ATOM 1073 CD1 LEU A 90 -4.088 5.343 -2.201 1.00 0.00 C ATOM 1074 CD2 LEU A 90 -3.015 6.086 -0.179 1.00 0.00 C ATOM 0 H LEU A 90 -0.245 2.789 -2.490 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.291 5.129 -0.871 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.077 3.757 -2.484 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.693 3.509 -0.862 1.00 0.00 H new ATOM 0 HG LEU A 90 -2.137 6.204 -2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.601 6.303 -2.251 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.934 4.961 -3.210 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.694 4.637 -1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.517 7.049 -0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.640 5.405 0.398 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.060 6.221 0.329 1.00 0.00 H new ATOM 1086 N LEU A 91 -0.549 4.306 1.427 1.00 0.00 N ATOM 1087 CA LEU A 91 -0.628 3.846 2.756 1.00 0.00 C ATOM 1088 C LEU A 91 -2.047 3.709 3.052 1.00 0.00 C ATOM 1089 O LEU A 91 -2.884 4.401 2.481 1.00 0.00 O ATOM 1090 CB LEU A 91 -0.097 4.825 3.786 1.00 0.00 C ATOM 1091 CG LEU A 91 1.298 4.616 4.411 1.00 0.00 C ATOM 1092 CD1 LEU A 91 2.017 3.398 3.920 1.00 0.00 C ATOM 1093 CD2 LEU A 91 2.152 5.829 4.321 1.00 0.00 C ATOM 0 H LEU A 91 -0.459 5.317 1.329 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.037 2.933 2.820 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.099 5.812 3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.816 4.854 4.604 1.00 0.00 H new ATOM 0 HG LEU A 91 1.098 4.432 5.467 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.988 3.327 4.410 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.428 2.510 4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.159 3.469 2.842 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.122 5.626 4.776 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.292 6.099 3.274 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.670 6.653 4.847 1.00 0.00 H new ATOM 1105 N GLY A 92 -2.314 2.929 3.990 1.00 0.00 N ATOM 1106 CA GLY A 92 -3.661 2.670 4.332 1.00 0.00 C ATOM 1107 C GLY A 92 -4.073 3.583 5.411 1.00 0.00 C ATOM 1108 O GLY A 92 -4.559 3.162 6.460 1.00 0.00 O ATOM 0 H GLY A 92 -1.620 2.441 4.556 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.302 2.805 3.461 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.774 1.635 4.653 1.00 0.00 H new ATOM 1112 N MET A 93 -3.873 4.835 5.158 1.00 0.00 N ATOM 1113 CA MET A 93 -4.086 5.824 6.092 1.00 0.00 C ATOM 1114 C MET A 93 -4.955 6.850 5.515 1.00 0.00 C ATOM 1115 O MET A 93 -4.763 7.259 4.367 1.00 0.00 O ATOM 1116 CB MET A 93 -2.789 6.389 6.642 1.00 0.00 C ATOM 1117 CG MET A 93 -2.645 7.904 6.553 1.00 0.00 C ATOM 1118 SD MET A 93 -1.135 8.510 7.302 1.00 0.00 S ATOM 1119 CE MET A 93 0.062 7.415 6.603 1.00 0.00 C ATOM 0 H MET A 93 -3.546 5.181 4.256 1.00 0.00 H new ATOM 0 HA MET A 93 -4.591 5.392 6.956 1.00 0.00 H new ATOM 0 HB2 MET A 93 -2.698 6.093 7.687 1.00 0.00 H new ATOM 0 HB3 MET A 93 -1.957 5.930 6.108 1.00 0.00 H new ATOM 0 HG2 MET A 93 -2.670 8.205 5.506 1.00 0.00 H new ATOM 0 HG3 MET A 93 -3.499 8.374 7.040 1.00 0.00 H new ATOM 0 HE1 MET A 93 1.004 7.946 6.466 1.00 0.00 H new ATOM 0 HE2 MET A 93 0.216 6.569 7.273 1.00 0.00 H new ATOM 0 HE3 MET A 93 -0.295 7.054 5.639 1.00 0.00 H new ATOM 1129 N PHE A 94 -5.885 7.280 6.266 1.00 0.00 N ATOM 1130 CA PHE A 94 -6.822 8.170 5.760 1.00 0.00 C ATOM 1131 C PHE A 94 -6.833 9.385 6.561 1.00 0.00 C ATOM 1132 O PHE A 94 -6.432 9.377 7.719 1.00 0.00 O ATOM 1133 CB PHE A 94 -8.192 7.523 5.658 1.00 0.00 C ATOM 1134 CG PHE A 94 -8.873 7.123 6.912 1.00 0.00 C ATOM 1135 CD1 PHE A 94 -8.524 5.988 7.477 1.00 0.00 C ATOM 1136 CD2 PHE A 94 -9.895 7.860 7.465 1.00 0.00 C ATOM 1137 CE1 PHE A 94 -9.109 5.504 8.573 1.00 0.00 C ATOM 1138 CE2 PHE A 94 -10.511 7.398 8.601 1.00 0.00 C ATOM 1139 CZ PHE A 94 -10.095 6.195 9.145 1.00 0.00 C ATOM 0 H PHE A 94 -6.012 7.022 7.245 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.541 8.449 4.744 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -8.848 8.214 5.129 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -8.095 6.635 5.034 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -7.722 5.419 7.030 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -10.208 8.789 7.011 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -8.787 4.562 8.993 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -11.307 7.963 9.063 1.00 0.00 H new ATOM 0 HZ PHE A 94 -10.571 5.815 10.037 1.00 0.00 H new ATOM 1149 N TYR A 95 -7.266 10.411 5.971 1.00 0.00 N ATOM 1150 CA TYR A 95 -7.280 11.660 6.618 1.00 0.00 C ATOM 1151 C TYR A 95 -8.689 12.018 6.976 1.00 0.00 C ATOM 1152 O TYR A 95 -9.509 12.352 6.121 1.00 0.00 O ATOM 1153 CB TYR A 95 -6.563 12.752 5.791 1.00 0.00 C ATOM 1154 CG TYR A 95 -6.520 14.103 6.453 1.00 0.00 C ATOM 1155 CD1 TYR A 95 -5.987 14.238 7.701 1.00 0.00 C ATOM 1156 CD2 TYR A 95 -7.007 15.229 5.823 1.00 0.00 C ATOM 1157 CE1 TYR A 95 -5.925 15.444 8.333 1.00 0.00 C ATOM 1158 CE2 TYR A 95 -6.955 16.461 6.440 1.00 0.00 C ATOM 1159 CZ TYR A 95 -6.410 16.564 7.700 1.00 0.00 C ATOM 1160 OH TYR A 95 -6.335 17.791 8.319 1.00 0.00 O ATOM 0 H TYR A 95 -7.626 10.419 5.017 1.00 0.00 H new ATOM 0 HA TYR A 95 -6.708 11.590 7.543 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.542 12.427 5.589 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -7.063 12.848 4.827 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.602 13.363 8.204 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -7.434 15.145 4.835 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -5.499 15.519 9.322 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -7.339 17.338 5.939 1.00 0.00 H new ATOM 0 HH TYR A 95 -6.721 18.476 7.735 1.00 0.00 H new ATOM 1170 N ASP A 96 -8.973 11.873 8.235 1.00 0.00 N ATOM 1171 CA ASP A 96 -10.239 12.226 8.778 1.00 0.00 C ATOM 1172 C ASP A 96 -10.170 13.697 8.922 1.00 0.00 C ATOM 1173 O ASP A 96 -9.330 14.173 9.653 1.00 0.00 O ATOM 1174 CB ASP A 96 -10.374 11.633 10.155 1.00 0.00 C ATOM 1175 CG ASP A 96 -11.745 11.805 10.767 1.00 0.00 C ATOM 1176 OD1 ASP A 96 -12.047 12.892 11.274 1.00 0.00 O ATOM 1177 OD2 ASP A 96 -12.523 10.825 10.785 1.00 0.00 O ATOM 0 H ASP A 96 -8.317 11.499 8.921 1.00 0.00 H new ATOM 0 HA ASP A 96 -11.069 11.881 8.161 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -10.140 10.569 10.106 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -9.634 12.092 10.811 1.00 0.00 H new ATOM 1182 N THR A 97 -10.957 14.415 8.219 1.00 0.00 N ATOM 1183 CA THR A 97 -10.836 15.852 8.219 1.00 0.00 C ATOM 1184 C THR A 97 -11.488 16.502 9.419 1.00 0.00 C ATOM 1185 O THR A 97 -11.225 17.664 9.739 1.00 0.00 O ATOM 1186 CB THR A 97 -11.378 16.423 6.932 1.00 0.00 C ATOM 1187 OG1 THR A 97 -12.719 15.940 6.725 1.00 0.00 O ATOM 1188 CG2 THR A 97 -10.511 15.971 5.790 1.00 0.00 C ATOM 0 H THR A 97 -11.701 14.046 7.627 1.00 0.00 H new ATOM 0 HA THR A 97 -9.773 16.081 8.292 1.00 0.00 H new ATOM 0 HB THR A 97 -11.383 17.512 6.986 1.00 0.00 H new ATOM 0 HG1 THR A 97 -13.075 16.310 5.890 1.00 0.00 H new ATOM 0 HG21 THR A 97 -10.897 16.380 4.856 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.491 16.323 5.946 1.00 0.00 H new ATOM 0 HG23 THR A 97 -10.516 14.882 5.738 1.00 0.00 H new ATOM 1196 N ASP A 98 -12.316 15.761 10.082 1.00 0.00 N ATOM 1197 CA ASP A 98 -12.987 16.246 11.279 1.00 0.00 C ATOM 1198 C ASP A 98 -12.030 16.243 12.437 1.00 0.00 C ATOM 1199 O ASP A 98 -11.867 17.246 13.148 1.00 0.00 O ATOM 1200 CB ASP A 98 -14.179 15.376 11.595 1.00 0.00 C ATOM 1201 CG ASP A 98 -14.883 15.779 12.872 1.00 0.00 C ATOM 1202 OD1 ASP A 98 -15.699 16.745 12.848 1.00 0.00 O ATOM 1203 OD2 ASP A 98 -14.659 15.129 13.916 1.00 0.00 O ATOM 0 H ASP A 98 -12.556 14.804 9.823 1.00 0.00 H new ATOM 0 HA ASP A 98 -13.332 17.265 11.103 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -14.886 15.423 10.767 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -13.853 14.339 11.678 1.00 0.00 H new ATOM 1208 N ASP A 99 -11.351 15.138 12.576 1.00 0.00 N ATOM 1209 CA ASP A 99 -10.382 14.940 13.649 1.00 0.00 C ATOM 1210 C ASP A 99 -9.102 15.573 13.218 1.00 0.00 C ATOM 1211 O ASP A 99 -8.256 15.971 14.035 1.00 0.00 O ATOM 1212 CB ASP A 99 -10.121 13.445 13.845 1.00 0.00 C ATOM 1213 CG ASP A 99 -9.439 13.114 15.143 1.00 0.00 C ATOM 1214 OD1 ASP A 99 -9.892 13.592 16.200 1.00 0.00 O ATOM 1215 OD2 ASP A 99 -8.487 12.313 15.139 1.00 0.00 O ATOM 0 H ASP A 99 -11.446 14.338 11.951 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.759 15.371 14.576 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.070 12.911 13.797 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.508 13.081 13.020 1.00 0.00 H new ATOM 1220 N ALA A 100 -8.998 15.690 11.901 1.00 0.00 N ATOM 1221 CA ALA A 100 -7.835 16.149 11.207 1.00 0.00 C ATOM 1222 C ALA A 100 -6.677 15.235 11.539 1.00 0.00 C ATOM 1223 O ALA A 100 -5.600 15.666 11.948 1.00 0.00 O ATOM 1224 CB ALA A 100 -7.544 17.614 11.467 1.00 0.00 C ATOM 0 H ALA A 100 -9.765 15.453 11.272 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.012 16.099 10.133 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.651 17.911 10.917 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -8.390 18.217 11.138 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.381 17.769 12.534 1.00 0.00 H new ATOM 1230 N SER A 101 -6.912 13.951 11.365 1.00 0.00 N ATOM 1231 CA SER A 101 -5.940 12.988 11.705 1.00 0.00 C ATOM 1232 C SER A 101 -5.783 11.979 10.657 1.00 0.00 C ATOM 1233 O SER A 101 -6.708 11.701 9.876 1.00 0.00 O ATOM 1234 CB SER A 101 -6.319 12.332 13.003 1.00 0.00 C ATOM 1235 OG SER A 101 -5.509 11.223 13.356 1.00 0.00 O ATOM 0 H SER A 101 -7.779 13.570 10.987 1.00 0.00 H new ATOM 0 HA SER A 101 -4.982 13.497 11.813 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.266 13.074 13.800 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.357 12.004 12.941 1.00 0.00 H new ATOM 0 HG SER A 101 -5.674 10.982 14.292 1.00 0.00 H new ATOM 1241 N PHE A 102 -4.624 11.447 10.636 1.00 0.00 N ATOM 1242 CA PHE A 102 -4.314 10.382 9.797 1.00 0.00 C ATOM 1243 C PHE A 102 -4.546 9.109 10.544 1.00 0.00 C ATOM 1244 O PHE A 102 -4.032 8.909 11.652 1.00 0.00 O ATOM 1245 CB PHE A 102 -2.925 10.450 9.278 1.00 0.00 C ATOM 1246 CG PHE A 102 -2.648 11.625 8.470 1.00 0.00 C ATOM 1247 CD1 PHE A 102 -3.106 11.688 7.185 1.00 0.00 C ATOM 1248 CD2 PHE A 102 -1.923 12.680 8.995 1.00 0.00 C ATOM 1249 CE1 PHE A 102 -2.843 12.798 6.422 1.00 0.00 C ATOM 1250 CE2 PHE A 102 -1.657 13.784 8.245 1.00 0.00 C ATOM 1251 CZ PHE A 102 -2.112 13.850 6.960 1.00 0.00 C ATOM 0 H PHE A 102 -3.849 11.756 11.222 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.962 10.429 8.922 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -2.233 10.431 10.120 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -2.728 9.559 8.683 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -3.673 10.867 6.771 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -1.564 12.627 10.012 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -3.203 12.854 5.405 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -1.090 14.602 8.664 1.00 0.00 H new ATOM 0 HZ PHE A 102 -1.903 14.723 6.359 1.00 0.00 H new ATOM 1261 N LYS A 103 -5.314 8.266 9.959 1.00 0.00 N ATOM 1262 CA LYS A 103 -5.801 7.104 10.621 1.00 0.00 C ATOM 1263 C LYS A 103 -5.535 5.909 9.788 1.00 0.00 C ATOM 1264 O LYS A 103 -5.580 5.997 8.593 1.00 0.00 O ATOM 1265 CB LYS A 103 -7.302 7.274 10.797 1.00 0.00 C ATOM 1266 CG LYS A 103 -7.642 8.643 11.302 1.00 0.00 C ATOM 1267 CD LYS A 103 -9.031 8.831 11.706 1.00 0.00 C ATOM 1268 CE LYS A 103 -9.112 9.982 12.685 1.00 0.00 C ATOM 1269 NZ LYS A 103 -8.287 9.801 13.917 1.00 0.00 N ATOM 0 H LYS A 103 -5.629 8.361 8.994 1.00 0.00 H new ATOM 0 HA LYS A 103 -5.309 6.976 11.585 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -7.803 7.101 9.845 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.675 6.524 11.495 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.000 8.868 12.153 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -7.406 9.369 10.524 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -9.652 9.035 10.834 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -9.416 7.920 12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -8.795 10.895 12.181 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -10.153 10.123 12.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -8.584 10.489 14.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -8.418 8.837 14.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -7.284 9.951 13.688 1.00 0.00 H new ATOM 1283 N TRP A 104 -5.251 4.816 10.399 1.00 0.00 N ATOM 1284 CA TRP A 104 -5.048 3.605 9.681 1.00 0.00 C ATOM 1285 C TRP A 104 -6.368 2.950 9.413 1.00 0.00 C ATOM 1286 O TRP A 104 -7.249 2.938 10.283 1.00 0.00 O ATOM 1287 CB TRP A 104 -4.179 2.638 10.478 1.00 0.00 C ATOM 1288 CG TRP A 104 -2.754 3.043 10.637 1.00 0.00 C ATOM 1289 CD1 TRP A 104 -2.087 3.199 11.804 1.00 0.00 C ATOM 1290 CD2 TRP A 104 -1.813 3.344 9.594 1.00 0.00 C ATOM 1291 NE1 TRP A 104 -0.793 3.549 11.555 1.00 0.00 N ATOM 1292 CE2 TRP A 104 -0.605 3.663 10.213 1.00 0.00 C ATOM 1293 CE3 TRP A 104 -1.877 3.370 8.200 1.00 0.00 C ATOM 1294 CZ2 TRP A 104 0.532 4.009 9.495 1.00 0.00 C ATOM 1295 CZ3 TRP A 104 -0.748 3.712 7.490 1.00 0.00 C ATOM 1296 CH2 TRP A 104 0.442 4.029 8.139 1.00 0.00 C ATOM 0 H TRP A 104 -5.152 4.733 11.411 1.00 0.00 H new ATOM 0 HA TRP A 104 -4.547 3.848 8.744 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -4.617 2.514 11.469 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -4.210 1.663 9.992 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -2.516 3.066 12.786 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -0.077 3.702 12.265 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -2.796 3.126 7.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 1.456 4.254 9.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -0.786 3.735 6.411 1.00 0.00 H new ATOM 0 HH2 TRP A 104 1.310 4.296 7.554 1.00 0.00 H new ATOM 1307 N PHE A 105 -6.510 2.382 8.231 1.00 0.00 N ATOM 1308 CA PHE A 105 -7.686 1.599 7.917 1.00 0.00 C ATOM 1309 C PHE A 105 -7.702 0.315 8.741 1.00 0.00 C ATOM 1310 O PHE A 105 -8.720 -0.365 8.843 1.00 0.00 O ATOM 1311 CB PHE A 105 -7.825 1.286 6.421 1.00 0.00 C ATOM 1312 CG PHE A 105 -8.392 2.402 5.624 1.00 0.00 C ATOM 1313 CD1 PHE A 105 -9.669 2.823 5.885 1.00 0.00 C ATOM 1314 CD2 PHE A 105 -7.674 3.041 4.619 1.00 0.00 C ATOM 1315 CE1 PHE A 105 -10.220 3.835 5.177 1.00 0.00 C ATOM 1316 CE2 PHE A 105 -8.222 4.040 3.926 1.00 0.00 C ATOM 1317 CZ PHE A 105 -9.497 4.446 4.194 1.00 0.00 C ATOM 0 H PHE A 105 -5.828 2.448 7.476 1.00 0.00 H new ATOM 0 HA PHE A 105 -8.549 2.211 8.181 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -6.844 1.028 6.021 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -8.459 0.408 6.301 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -10.242 2.342 6.664 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -6.665 2.726 4.398 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.228 4.158 5.389 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -7.654 4.530 3.149 1.00 0.00 H new ATOM 0 HZ PHE A 105 -9.935 5.253 3.626 1.00 0.00 H new ATOM 1327 N ASP A 106 -6.554 0.017 9.365 1.00 0.00 N ATOM 1328 CA ASP A 106 -6.415 -1.129 10.307 1.00 0.00 C ATOM 1329 C ASP A 106 -7.265 -0.865 11.555 1.00 0.00 C ATOM 1330 O ASP A 106 -7.507 -1.765 12.359 1.00 0.00 O ATOM 1331 CB ASP A 106 -4.936 -1.294 10.707 1.00 0.00 C ATOM 1332 CG ASP A 106 -4.606 -2.484 11.608 1.00 0.00 C ATOM 1333 OD1 ASP A 106 -4.461 -3.626 11.098 1.00 0.00 O ATOM 1334 OD2 ASP A 106 -4.378 -2.280 12.828 1.00 0.00 O ATOM 0 H ASP A 106 -5.695 0.552 9.240 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.757 -2.044 9.823 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -4.343 -1.380 9.796 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.615 -0.383 11.212 1.00 0.00 H new ATOM 1339 N ASN A 107 -7.714 0.405 11.689 1.00 0.00 N ATOM 1340 CA ASN A 107 -8.593 0.891 12.778 1.00 0.00 C ATOM 1341 C ASN A 107 -7.834 1.017 14.068 1.00 0.00 C ATOM 1342 O ASN A 107 -8.421 1.128 15.152 1.00 0.00 O ATOM 1343 CB ASN A 107 -9.836 0.002 12.976 1.00 0.00 C ATOM 1344 CG ASN A 107 -10.779 -0.068 11.778 1.00 0.00 C ATOM 1345 OD1 ASN A 107 -10.937 1.017 11.047 1.00 0.00 O flip ATOM 1346 ND2 ASN A 107 -11.400 -1.103 11.544 1.00 0.00 N flip ATOM 0 H ASN A 107 -7.468 1.139 11.025 1.00 0.00 H new ATOM 0 HA ASN A 107 -8.944 1.877 12.475 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.506 -1.008 13.219 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.394 0.371 13.837 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.256 -1.927 12.128 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -12.059 -1.138 10.766 1.00 0.00 H new ATOM 1353 N SER A 108 -6.543 1.053 13.951 1.00 0.00 N ATOM 1354 CA SER A 108 -5.695 1.137 15.086 1.00 0.00 C ATOM 1355 C SER A 108 -4.883 2.414 15.019 1.00 0.00 C ATOM 1356 O SER A 108 -4.648 2.938 13.923 1.00 0.00 O ATOM 1357 CB SER A 108 -4.803 -0.083 15.129 1.00 0.00 C ATOM 1358 OG SER A 108 -5.575 -1.268 15.008 1.00 0.00 O ATOM 0 H SER A 108 -6.051 1.024 13.058 1.00 0.00 H new ATOM 0 HA SER A 108 -6.288 1.163 16.000 1.00 0.00 H new ATOM 0 HB2 SER A 108 -4.072 -0.035 14.322 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.245 -0.100 16.065 1.00 0.00 H new ATOM 0 HG SER A 108 -5.196 -1.835 14.304 1.00 0.00 H new ATOM 1364 N ASN A 109 -4.471 2.902 16.178 1.00 0.00 N ATOM 1365 CA ASN A 109 -3.718 4.159 16.322 1.00 0.00 C ATOM 1366 C ASN A 109 -2.465 4.164 15.476 1.00 0.00 C ATOM 1367 O ASN A 109 -1.807 3.127 15.303 1.00 0.00 O ATOM 1368 CB ASN A 109 -3.269 4.350 17.780 1.00 0.00 C ATOM 1369 CG ASN A 109 -2.622 5.664 18.046 1.00 0.00 C ATOM 1370 OD1 ASN A 109 -2.924 6.675 17.416 1.00 0.00 O ATOM 1371 ND2 ASN A 109 -1.773 5.681 18.996 1.00 0.00 N ATOM 0 H ASN A 109 -4.649 2.435 17.067 1.00 0.00 H new ATOM 0 HA ASN A 109 -4.388 4.957 16.002 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -4.135 4.244 18.433 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.573 3.554 18.042 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -1.317 6.555 19.257 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -1.549 4.820 19.495 1.00 0.00 H new ATOM 1378 N MET A 110 -2.136 5.306 14.949 1.00 0.00 N ATOM 1379 CA MET A 110 -0.897 5.464 14.258 1.00 0.00 C ATOM 1380 C MET A 110 0.202 5.632 15.288 1.00 0.00 C ATOM 1381 O MET A 110 0.481 6.735 15.761 1.00 0.00 O ATOM 1382 CB MET A 110 -0.966 6.640 13.300 1.00 0.00 C ATOM 1383 CG MET A 110 0.286 6.873 12.477 1.00 0.00 C ATOM 1384 SD MET A 110 0.009 8.078 11.175 1.00 0.00 S ATOM 1385 CE MET A 110 -1.341 7.266 10.312 1.00 0.00 C ATOM 0 H MET A 110 -2.715 6.145 14.987 1.00 0.00 H new ATOM 0 HA MET A 110 -0.683 4.583 13.652 1.00 0.00 H new ATOM 0 HB2 MET A 110 -1.805 6.487 12.621 1.00 0.00 H new ATOM 0 HB3 MET A 110 -1.179 7.543 13.872 1.00 0.00 H new ATOM 0 HG2 MET A 110 1.090 7.218 13.127 1.00 0.00 H new ATOM 0 HG3 MET A 110 0.613 5.931 12.037 1.00 0.00 H new ATOM 0 HE1 MET A 110 -0.970 6.828 9.385 1.00 0.00 H new ATOM 0 HE2 MET A 110 -1.756 6.480 10.943 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.118 7.996 10.083 1.00 0.00 H new ATOM 1395 N THR A 111 0.768 4.521 15.670 1.00 0.00 N ATOM 1396 CA THR A 111 1.757 4.466 16.702 1.00 0.00 C ATOM 1397 C THR A 111 3.182 4.602 16.149 1.00 0.00 C ATOM 1398 O THR A 111 4.151 4.670 16.905 1.00 0.00 O ATOM 1399 CB THR A 111 1.591 3.144 17.457 1.00 0.00 C ATOM 1400 OG1 THR A 111 1.464 2.068 16.503 1.00 0.00 O ATOM 1401 CG2 THR A 111 0.350 3.175 18.352 1.00 0.00 C ATOM 0 H THR A 111 0.548 3.612 15.262 1.00 0.00 H new ATOM 0 HA THR A 111 1.609 5.309 17.377 1.00 0.00 H new ATOM 0 HB THR A 111 2.467 2.991 18.087 1.00 0.00 H new ATOM 0 HG1 THR A 111 1.677 1.217 16.940 1.00 0.00 H new ATOM 0 HG21 THR A 111 0.256 2.224 18.877 1.00 0.00 H new ATOM 0 HG22 THR A 111 0.445 3.982 19.078 1.00 0.00 H new ATOM 0 HG23 THR A 111 -0.536 3.341 17.740 1.00 0.00 H new ATOM 1409 N PHE A 112 3.296 4.638 14.837 1.00 0.00 N ATOM 1410 CA PHE A 112 4.565 4.807 14.185 1.00 0.00 C ATOM 1411 C PHE A 112 4.343 5.595 12.953 1.00 0.00 C ATOM 1412 O PHE A 112 3.259 5.504 12.360 1.00 0.00 O ATOM 1413 CB PHE A 112 5.170 3.481 13.787 1.00 0.00 C ATOM 1414 CG PHE A 112 6.608 3.601 13.403 1.00 0.00 C ATOM 1415 CD1 PHE A 112 7.592 3.786 14.356 1.00 0.00 C ATOM 1416 CD2 PHE A 112 6.955 3.564 12.094 1.00 0.00 C ATOM 1417 CE1 PHE A 112 8.911 3.925 13.987 1.00 0.00 C ATOM 1418 CE2 PHE A 112 8.266 3.707 11.701 1.00 0.00 C ATOM 1419 CZ PHE A 112 9.250 3.889 12.654 1.00 0.00 C ATOM 0 H PHE A 112 2.506 4.550 14.198 1.00 0.00 H new ATOM 0 HA PHE A 112 5.246 5.304 14.876 1.00 0.00 H new ATOM 0 HB2 PHE A 112 5.076 2.779 14.616 1.00 0.00 H new ATOM 0 HB3 PHE A 112 4.608 3.065 12.951 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.323 3.822 15.401 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.189 3.420 11.346 1.00 0.00 H new ATOM 0 HE1 PHE A 112 9.674 4.061 14.739 1.00 0.00 H new ATOM 0 HE2 PHE A 112 8.525 3.677 10.653 1.00 0.00 H new ATOM 0 HZ PHE A 112 10.281 4.003 12.354 1.00 0.00 H new ATOM 1429 N ASP A 113 5.335 6.355 12.553 1.00 0.00 N ATOM 1430 CA ASP A 113 5.243 7.133 11.363 1.00 0.00 C ATOM 1431 C ASP A 113 6.572 7.460 10.780 1.00 0.00 C ATOM 1432 O ASP A 113 7.554 7.653 11.486 1.00 0.00 O ATOM 1433 CB ASP A 113 4.378 8.384 11.540 1.00 0.00 C ATOM 1434 CG ASP A 113 4.821 9.310 12.676 1.00 0.00 C ATOM 1435 OD1 ASP A 113 5.917 9.907 12.610 1.00 0.00 O ATOM 1436 OD2 ASP A 113 4.061 9.461 13.661 1.00 0.00 O ATOM 0 H ASP A 113 6.222 6.444 13.049 1.00 0.00 H new ATOM 0 HA ASP A 113 4.734 6.497 10.639 1.00 0.00 H new ATOM 0 HB2 ASP A 113 4.382 8.948 10.607 1.00 0.00 H new ATOM 0 HB3 ASP A 113 3.348 8.075 11.721 1.00 0.00 H new ATOM 1441 N LYS A 114 6.610 7.461 9.472 1.00 0.00 N ATOM 1442 CA LYS A 114 7.781 7.823 8.755 1.00 0.00 C ATOM 1443 C LYS A 114 7.450 9.023 7.911 1.00 0.00 C ATOM 1444 O LYS A 114 7.403 8.955 6.697 1.00 0.00 O ATOM 1445 CB LYS A 114 8.182 6.674 7.860 1.00 0.00 C ATOM 1446 CG LYS A 114 8.617 5.426 8.587 1.00 0.00 C ATOM 1447 CD LYS A 114 10.063 5.478 9.065 1.00 0.00 C ATOM 1448 CE LYS A 114 11.061 5.472 7.899 1.00 0.00 C ATOM 1449 NZ LYS A 114 12.448 5.319 8.372 1.00 0.00 N ATOM 0 H LYS A 114 5.818 7.207 8.881 1.00 0.00 H new ATOM 0 HA LYS A 114 8.600 8.052 9.437 1.00 0.00 H new ATOM 0 HB2 LYS A 114 7.341 6.426 7.213 1.00 0.00 H new ATOM 0 HB3 LYS A 114 8.996 7.003 7.213 1.00 0.00 H new ATOM 0 HG2 LYS A 114 7.964 5.268 9.445 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.491 4.567 7.928 1.00 0.00 H new ATOM 0 HD2 LYS A 114 10.213 6.376 9.665 1.00 0.00 H new ATOM 0 HD3 LYS A 114 10.260 4.625 9.714 1.00 0.00 H new ATOM 0 HE2 LYS A 114 10.818 4.659 7.215 1.00 0.00 H new ATOM 0 HE3 LYS A 114 10.969 6.401 7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 13.095 5.319 7.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 12.688 6.109 9.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 12.542 4.421 8.888 1.00 0.00 H new ATOM 1463 N TRP A 115 7.221 10.111 8.550 1.00 0.00 N ATOM 1464 CA TRP A 115 6.869 11.318 7.851 1.00 0.00 C ATOM 1465 C TRP A 115 8.101 12.045 7.385 1.00 0.00 C ATOM 1466 O TRP A 115 9.065 12.227 8.153 1.00 0.00 O ATOM 1467 CB TRP A 115 6.002 12.244 8.704 1.00 0.00 C ATOM 1468 CG TRP A 115 4.654 11.735 8.999 1.00 0.00 C ATOM 1469 CD1 TRP A 115 4.197 11.364 10.177 1.00 0.00 C ATOM 1470 CD2 TRP A 115 3.598 11.571 8.090 1.00 0.00 C ATOM 1471 NE1 TRP A 115 2.891 10.964 10.093 1.00 0.00 N ATOM 1472 CE2 TRP A 115 2.498 11.084 8.806 1.00 0.00 C ATOM 1473 CE3 TRP A 115 3.476 11.788 6.747 1.00 0.00 C ATOM 1474 CZ2 TRP A 115 1.286 10.812 8.205 1.00 0.00 C ATOM 1475 CZ3 TRP A 115 2.293 11.520 6.156 1.00 0.00 C ATOM 1476 CH2 TRP A 115 1.201 11.039 6.871 1.00 0.00 C ATOM 0 H TRP A 115 7.268 10.203 9.565 1.00 0.00 H new ATOM 0 HA TRP A 115 6.281 11.022 6.982 1.00 0.00 H new ATOM 0 HB2 TRP A 115 6.517 12.434 9.646 1.00 0.00 H new ATOM 0 HB3 TRP A 115 5.909 13.202 8.193 1.00 0.00 H new ATOM 0 HD1 TRP A 115 4.776 11.374 11.089 1.00 0.00 H new ATOM 0 HE1 TRP A 115 2.315 10.633 10.867 1.00 0.00 H new ATOM 0 HE3 TRP A 115 4.308 12.166 6.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 0.446 10.436 8.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 2.191 11.684 5.093 1.00 0.00 H new ATOM 0 HH2 TRP A 115 0.272 10.844 6.356 1.00 0.00 H new ATOM 1487 N THR A 116 8.091 12.434 6.148 1.00 0.00 N ATOM 1488 CA THR A 116 9.164 13.194 5.591 1.00 0.00 C ATOM 1489 C THR A 116 8.743 14.655 5.626 1.00 0.00 C ATOM 1490 O THR A 116 7.558 14.951 5.898 1.00 0.00 O ATOM 1491 CB THR A 116 9.470 12.739 4.133 1.00 0.00 C ATOM 1492 OG1 THR A 116 10.616 13.403 3.596 1.00 0.00 O ATOM 1493 CG2 THR A 116 8.273 12.870 3.193 1.00 0.00 C ATOM 0 H THR A 116 7.335 12.232 5.494 1.00 0.00 H new ATOM 0 HA THR A 116 10.078 13.044 6.166 1.00 0.00 H new ATOM 0 HB THR A 116 9.695 11.675 4.203 1.00 0.00 H new ATOM 0 HG1 THR A 116 11.394 12.810 3.652 1.00 0.00 H new ATOM 0 HG21 THR A 116 8.556 12.536 2.195 1.00 0.00 H new ATOM 0 HG22 THR A 116 7.452 12.256 3.562 1.00 0.00 H new ATOM 0 HG23 THR A 116 7.956 13.912 3.151 1.00 0.00 H new ATOM 1501 N ASP A 117 9.653 15.561 5.401 1.00 0.00 N ATOM 1502 CA ASP A 117 9.266 16.953 5.392 1.00 0.00 C ATOM 1503 C ASP A 117 8.742 17.292 4.022 1.00 0.00 C ATOM 1504 O ASP A 117 9.470 17.231 3.025 1.00 0.00 O ATOM 1505 CB ASP A 117 10.393 17.892 5.806 1.00 0.00 C ATOM 1506 CG ASP A 117 9.905 19.321 5.916 1.00 0.00 C ATOM 1507 OD1 ASP A 117 9.189 19.638 6.890 1.00 0.00 O ATOM 1508 OD2 ASP A 117 10.221 20.148 5.044 1.00 0.00 O ATOM 0 H ASP A 117 10.640 15.375 5.226 1.00 0.00 H new ATOM 0 HA ASP A 117 8.486 17.098 6.140 1.00 0.00 H new ATOM 0 HB2 ASP A 117 10.804 17.571 6.763 1.00 0.00 H new ATOM 0 HB3 ASP A 117 11.202 17.837 5.077 1.00 0.00 H new ATOM 1513 N GLN A 118 7.489 17.613 3.971 1.00 0.00 N ATOM 1514 CA GLN A 118 6.775 17.820 2.811 1.00 0.00 C ATOM 1515 C GLN A 118 6.198 19.219 2.898 1.00 0.00 C ATOM 1516 O GLN A 118 6.307 19.887 3.932 1.00 0.00 O ATOM 1517 CB GLN A 118 5.647 16.852 2.927 1.00 0.00 C ATOM 1518 CG GLN A 118 4.633 16.872 1.873 1.00 0.00 C ATOM 1519 CD GLN A 118 3.489 15.913 2.137 1.00 0.00 C ATOM 1520 OE1 GLN A 118 3.678 14.849 2.695 1.00 0.00 O ATOM 1521 NE2 GLN A 118 2.290 16.340 1.870 1.00 0.00 N ATOM 0 H GLN A 118 6.925 17.739 4.811 1.00 0.00 H new ATOM 0 HA GLN A 118 7.355 17.704 1.895 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.068 15.848 2.971 1.00 0.00 H new ATOM 0 HB3 GLN A 118 5.147 17.030 3.879 1.00 0.00 H new ATOM 0 HG2 GLN A 118 4.238 17.883 1.775 1.00 0.00 H new ATOM 0 HG3 GLN A 118 5.100 16.619 0.921 1.00 0.00 H new ATOM 0 HE21 GLN A 118 2.161 17.236 1.401 1.00 0.00 H new ATOM 0 HE22 GLN A 118 1.479 15.778 2.130 1.00 0.00 H new ATOM 1530 N ASP A 119 5.583 19.625 1.863 1.00 0.00 N ATOM 1531 CA ASP A 119 4.872 20.837 1.817 1.00 0.00 C ATOM 1532 C ASP A 119 3.473 20.560 2.333 1.00 0.00 C ATOM 1533 O ASP A 119 2.903 19.491 2.079 1.00 0.00 O ATOM 1534 CB ASP A 119 4.892 21.297 0.409 1.00 0.00 C ATOM 1535 CG ASP A 119 3.961 20.561 -0.548 1.00 0.00 C ATOM 1536 OD1 ASP A 119 4.324 19.462 -1.022 1.00 0.00 O ATOM 1537 OD2 ASP A 119 2.875 21.076 -0.864 1.00 0.00 O ATOM 0 H ASP A 119 5.559 19.102 0.987 1.00 0.00 H new ATOM 0 HA ASP A 119 5.304 21.624 2.436 1.00 0.00 H new ATOM 0 HB2 ASP A 119 4.636 22.356 0.390 1.00 0.00 H new ATOM 0 HB3 ASP A 119 5.911 21.208 0.033 1.00 0.00 H new ATOM 1542 N ASP A 120 2.937 21.472 3.054 1.00 0.00 N ATOM 1543 CA ASP A 120 1.699 21.241 3.773 1.00 0.00 C ATOM 1544 C ASP A 120 0.938 22.544 3.917 1.00 0.00 C ATOM 1545 O ASP A 120 1.443 23.520 4.477 1.00 0.00 O ATOM 1546 CB ASP A 120 2.070 20.596 5.136 1.00 0.00 C ATOM 1547 CG ASP A 120 0.946 20.391 6.150 1.00 0.00 C ATOM 1548 OD1 ASP A 120 0.550 21.362 6.826 1.00 0.00 O ATOM 1549 OD2 ASP A 120 0.543 19.236 6.383 1.00 0.00 O ATOM 0 H ASP A 120 3.328 22.406 3.176 1.00 0.00 H new ATOM 0 HA ASP A 120 1.035 20.563 3.237 1.00 0.00 H new ATOM 0 HB2 ASP A 120 2.523 19.625 4.936 1.00 0.00 H new ATOM 0 HB3 ASP A 120 2.836 21.215 5.604 1.00 0.00 H new ATOM 1554 N ASP A 121 -0.234 22.581 3.332 1.00 0.00 N ATOM 1555 CA ASP A 121 -1.091 23.758 3.360 1.00 0.00 C ATOM 1556 C ASP A 121 -2.084 23.559 4.511 1.00 0.00 C ATOM 1557 O ASP A 121 -1.728 22.929 5.498 1.00 0.00 O ATOM 1558 CB ASP A 121 -1.802 23.895 1.995 1.00 0.00 C ATOM 1559 CG ASP A 121 -2.466 25.243 1.788 1.00 0.00 C ATOM 1560 OD1 ASP A 121 -1.794 26.192 1.356 1.00 0.00 O ATOM 1561 OD2 ASP A 121 -3.673 25.367 2.038 1.00 0.00 O ATOM 0 H ASP A 121 -0.630 21.794 2.818 1.00 0.00 H new ATOM 0 HA ASP A 121 -0.529 24.677 3.524 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -1.076 23.731 1.199 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -2.555 23.111 1.907 1.00 0.00 H new ATOM 1566 N GLU A 122 -3.278 24.107 4.440 1.00 0.00 N ATOM 1567 CA GLU A 122 -4.251 23.902 5.493 1.00 0.00 C ATOM 1568 C GLU A 122 -4.695 22.487 5.411 1.00 0.00 C ATOM 1569 O GLU A 122 -4.544 21.687 6.336 1.00 0.00 O ATOM 1570 CB GLU A 122 -5.480 24.736 5.248 1.00 0.00 C ATOM 1571 CG GLU A 122 -5.218 26.098 4.758 1.00 0.00 C ATOM 1572 CD GLU A 122 -6.464 26.902 4.763 1.00 0.00 C ATOM 1573 OE1 GLU A 122 -7.272 26.771 3.814 1.00 0.00 O ATOM 1574 OE2 GLU A 122 -6.687 27.658 5.717 1.00 0.00 O ATOM 0 H GLU A 122 -3.598 24.694 3.670 1.00 0.00 H new ATOM 0 HA GLU A 122 -3.801 24.163 6.451 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -6.112 24.221 4.525 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -6.047 24.803 6.177 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -4.466 26.578 5.385 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -4.810 26.055 3.748 1.00 0.00 H new ATOM 1581 N ASP A 123 -5.229 22.204 4.280 1.00 0.00 N ATOM 1582 CA ASP A 123 -5.737 20.911 3.951 1.00 0.00 C ATOM 1583 C ASP A 123 -4.762 20.227 3.095 1.00 0.00 C ATOM 1584 O ASP A 123 -4.252 20.800 2.134 1.00 0.00 O ATOM 1585 CB ASP A 123 -7.040 20.986 3.169 1.00 0.00 C ATOM 1586 CG ASP A 123 -8.160 21.680 3.879 1.00 0.00 C ATOM 1587 OD1 ASP A 123 -8.852 21.030 4.672 1.00 0.00 O ATOM 1588 OD2 ASP A 123 -8.406 22.885 3.628 1.00 0.00 O ATOM 0 H ASP A 123 -5.331 22.885 3.528 1.00 0.00 H new ATOM 0 HA ASP A 123 -5.914 20.383 4.888 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -6.852 21.500 2.226 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.358 19.973 2.922 1.00 0.00 H new ATOM 1593 N LEU A 124 -4.504 19.019 3.415 1.00 0.00 N ATOM 1594 CA LEU A 124 -3.664 18.205 2.627 1.00 0.00 C ATOM 1595 C LEU A 124 -4.510 17.122 1.995 1.00 0.00 C ATOM 1596 O LEU A 124 -4.068 16.029 1.718 1.00 0.00 O ATOM 1597 CB LEU A 124 -2.446 17.657 3.427 1.00 0.00 C ATOM 1598 CG LEU A 124 -2.617 17.213 4.898 1.00 0.00 C ATOM 1599 CD1 LEU A 124 -2.836 18.374 5.871 1.00 0.00 C ATOM 1600 CD2 LEU A 124 -3.686 16.169 5.030 1.00 0.00 C ATOM 0 H LEU A 124 -4.876 18.559 4.246 1.00 0.00 H new ATOM 0 HA LEU A 124 -3.212 18.800 1.833 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.055 16.802 2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.675 18.427 3.410 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.666 16.767 5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.948 17.985 6.883 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.979 19.047 5.833 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -3.737 18.919 5.590 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -3.782 15.877 6.076 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.635 16.573 4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.419 15.297 4.433 1.00 0.00 H new ATOM 1612 N VAL A 125 -5.731 17.492 1.715 1.00 0.00 N ATOM 1613 CA VAL A 125 -6.720 16.603 1.150 1.00 0.00 C ATOM 1614 C VAL A 125 -6.445 16.419 -0.348 1.00 0.00 C ATOM 1615 O VAL A 125 -6.861 15.441 -0.960 1.00 0.00 O ATOM 1616 CB VAL A 125 -8.159 17.177 1.406 1.00 0.00 C ATOM 1617 CG1 VAL A 125 -9.259 16.336 0.781 1.00 0.00 C ATOM 1618 CG2 VAL A 125 -8.405 17.309 2.897 1.00 0.00 C ATOM 0 H VAL A 125 -6.076 18.438 1.875 1.00 0.00 H new ATOM 0 HA VAL A 125 -6.660 15.626 1.629 1.00 0.00 H new ATOM 0 HB VAL A 125 -8.194 18.155 0.926 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -10.228 16.787 0.995 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -9.111 16.288 -0.298 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.228 15.329 1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -9.405 17.708 3.067 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.320 16.330 3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -7.667 17.985 3.329 1.00 0.00 H new ATOM 1628 N ASP A 126 -5.690 17.354 -0.889 1.00 0.00 N ATOM 1629 CA ASP A 126 -5.287 17.382 -2.315 1.00 0.00 C ATOM 1630 C ASP A 126 -4.341 16.235 -2.666 1.00 0.00 C ATOM 1631 O ASP A 126 -4.249 15.801 -3.822 1.00 0.00 O ATOM 1632 CB ASP A 126 -4.635 18.745 -2.643 1.00 0.00 C ATOM 1633 CG ASP A 126 -3.991 18.811 -4.021 1.00 0.00 C ATOM 1634 OD1 ASP A 126 -4.695 19.035 -5.022 1.00 0.00 O ATOM 1635 OD2 ASP A 126 -2.755 18.663 -4.121 1.00 0.00 O ATOM 0 H ASP A 126 -5.322 18.140 -0.353 1.00 0.00 H new ATOM 0 HA ASP A 126 -6.183 17.252 -2.921 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -5.393 19.525 -2.570 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -3.879 18.964 -1.889 1.00 0.00 H new ATOM 1640 N THR A 127 -3.716 15.731 -1.671 1.00 0.00 N ATOM 1641 CA THR A 127 -2.730 14.703 -1.786 1.00 0.00 C ATOM 1642 C THR A 127 -3.168 13.532 -0.920 1.00 0.00 C ATOM 1643 O THR A 127 -4.175 13.634 -0.205 1.00 0.00 O ATOM 1644 CB THR A 127 -1.338 15.263 -1.336 1.00 0.00 C ATOM 1645 OG1 THR A 127 -0.320 14.241 -1.250 1.00 0.00 O ATOM 1646 CG2 THR A 127 -1.447 15.986 -0.023 1.00 0.00 C ATOM 0 H THR A 127 -3.877 16.030 -0.709 1.00 0.00 H new ATOM 0 HA THR A 127 -2.632 14.365 -2.818 1.00 0.00 H new ATOM 0 HB THR A 127 -1.030 15.964 -2.112 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.218 13.958 -0.317 1.00 0.00 H new ATOM 0 HG21 THR A 127 -0.467 16.365 0.266 1.00 0.00 H new ATOM 0 HG22 THR A 127 -2.143 16.819 -0.123 1.00 0.00 H new ATOM 0 HG23 THR A 127 -1.811 15.299 0.741 1.00 0.00 H new ATOM 1654 N CYS A 128 -2.449 12.445 -0.974 1.00 0.00 N ATOM 1655 CA CYS A 128 -2.782 11.291 -0.184 1.00 0.00 C ATOM 1656 C CYS A 128 -1.552 10.847 0.559 1.00 0.00 C ATOM 1657 O CYS A 128 -0.520 11.515 0.500 1.00 0.00 O ATOM 1658 CB CYS A 128 -3.255 10.133 -1.026 1.00 0.00 C ATOM 1659 SG CYS A 128 -4.039 10.532 -2.607 1.00 0.00 S ATOM 0 H CYS A 128 -1.623 12.334 -1.561 1.00 0.00 H new ATOM 0 HA CYS A 128 -3.590 11.577 0.490 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -2.399 9.488 -1.226 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.962 9.551 -0.435 1.00 0.00 H new ATOM 1664 N ALA A 129 -1.603 9.683 1.178 1.00 0.00 N ATOM 1665 CA ALA A 129 -0.470 9.247 1.896 1.00 0.00 C ATOM 1666 C ALA A 129 0.097 8.087 1.205 1.00 0.00 C ATOM 1667 O ALA A 129 -0.540 7.066 1.076 1.00 0.00 O ATOM 1668 CB ALA A 129 -0.879 8.798 3.307 1.00 0.00 C ATOM 0 H ALA A 129 -2.404 9.052 1.187 1.00 0.00 H new ATOM 0 HA ALA A 129 0.249 10.064 1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 129 0.003 8.463 3.852 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -1.337 9.633 3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -1.594 7.978 3.235 1.00 0.00 H new ATOM 1674 N PHE A 130 1.298 8.201 0.794 1.00 0.00 N ATOM 1675 CA PHE A 130 1.923 7.095 0.184 1.00 0.00 C ATOM 1676 C PHE A 130 3.231 6.907 0.792 1.00 0.00 C ATOM 1677 O PHE A 130 3.946 7.874 1.063 1.00 0.00 O ATOM 1678 CB PHE A 130 2.140 7.204 -1.334 1.00 0.00 C ATOM 1679 CG PHE A 130 0.927 7.220 -2.270 1.00 0.00 C ATOM 1680 CD1 PHE A 130 -0.132 8.084 -2.110 1.00 0.00 C ATOM 1681 CD2 PHE A 130 0.898 6.352 -3.356 1.00 0.00 C ATOM 1682 CE1 PHE A 130 -1.183 8.077 -3.009 1.00 0.00 C ATOM 1683 CE2 PHE A 130 -0.149 6.343 -4.242 1.00 0.00 C ATOM 1684 CZ PHE A 130 -1.191 7.206 -4.070 1.00 0.00 C ATOM 0 H PHE A 130 1.868 9.044 0.867 1.00 0.00 H new ATOM 0 HA PHE A 130 1.238 6.262 0.341 1.00 0.00 H new ATOM 0 HB2 PHE A 130 2.707 8.117 -1.518 1.00 0.00 H new ATOM 0 HB3 PHE A 130 2.773 6.369 -1.634 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -0.143 8.772 -1.277 1.00 0.00 H new ATOM 0 HD2 PHE A 130 1.720 5.668 -3.506 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -2.006 8.764 -2.875 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -0.148 5.654 -5.074 1.00 0.00 H new ATOM 0 HZ PHE A 130 -2.018 7.204 -4.765 1.00 0.00 H new ATOM 1694 N LEU A 131 3.495 5.715 1.083 1.00 0.00 N ATOM 1695 CA LEU A 131 4.796 5.300 1.476 1.00 0.00 C ATOM 1696 C LEU A 131 5.734 5.189 0.268 1.00 0.00 C ATOM 1697 O LEU A 131 5.434 4.530 -0.720 1.00 0.00 O ATOM 1698 CB LEU A 131 4.670 3.993 2.160 1.00 0.00 C ATOM 1699 CG LEU A 131 5.924 3.244 2.432 1.00 0.00 C ATOM 1700 CD1 LEU A 131 6.813 3.984 3.346 1.00 0.00 C ATOM 1701 CD2 LEU A 131 5.617 1.887 2.943 1.00 0.00 C ATOM 0 H LEU A 131 2.807 4.962 1.060 1.00 0.00 H new ATOM 0 HA LEU A 131 5.230 6.040 2.148 1.00 0.00 H new ATOM 0 HB2 LEU A 131 4.162 4.157 3.110 1.00 0.00 H new ATOM 0 HB3 LEU A 131 4.021 3.358 1.557 1.00 0.00 H new ATOM 0 HG LEU A 131 6.463 3.135 1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.719 3.404 3.521 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.076 4.943 2.900 1.00 0.00 H new ATOM 0 HD13 LEU A 131 6.302 4.152 4.294 1.00 0.00 H new ATOM 0 HD21 LEU A 131 6.547 1.352 3.137 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.045 1.967 3.867 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.033 1.342 2.201 1.00 0.00 H new ATOM 1713 N HIS A 132 6.849 5.862 0.367 1.00 0.00 N ATOM 1714 CA HIS A 132 7.875 5.879 -0.657 1.00 0.00 C ATOM 1715 C HIS A 132 8.634 4.582 -0.647 1.00 0.00 C ATOM 1716 O HIS A 132 9.296 4.278 0.294 1.00 0.00 O ATOM 1717 CB HIS A 132 8.851 7.017 -0.377 1.00 0.00 C ATOM 1718 CG HIS A 132 9.724 7.443 -1.513 1.00 0.00 C ATOM 1719 ND1 HIS A 132 10.607 8.470 -1.413 1.00 0.00 N ATOM 1720 CD2 HIS A 132 9.836 6.986 -2.765 1.00 0.00 C ATOM 1721 CE1 HIS A 132 11.224 8.633 -2.542 1.00 0.00 C ATOM 1722 NE2 HIS A 132 10.772 7.740 -3.394 1.00 0.00 N ATOM 0 H HIS A 132 7.081 6.431 1.181 1.00 0.00 H new ATOM 0 HA HIS A 132 7.401 6.018 -1.629 1.00 0.00 H new ATOM 0 HB2 HIS A 132 8.279 7.883 -0.044 1.00 0.00 H new ATOM 0 HB3 HIS A 132 9.492 6.720 0.453 1.00 0.00 H new ATOM 0 HD1 HIS A 132 10.762 9.030 -0.575 1.00 0.00 H new ATOM 0 HD2 HIS A 132 9.282 6.166 -3.197 1.00 0.00 H new ATOM 0 HE1 HIS A 132 11.980 9.376 -2.747 1.00 0.00 H new ATOM 1731 N ILE A 133 8.599 3.916 -1.744 1.00 0.00 N ATOM 1732 CA ILE A 133 9.243 2.646 -1.971 1.00 0.00 C ATOM 1733 C ILE A 133 10.744 2.735 -1.866 1.00 0.00 C ATOM 1734 O ILE A 133 11.419 1.759 -1.524 1.00 0.00 O ATOM 1735 CB ILE A 133 8.803 2.085 -3.357 1.00 0.00 C ATOM 1736 CG1 ILE A 133 7.552 1.225 -3.243 1.00 0.00 C ATOM 1737 CG2 ILE A 133 9.910 1.427 -4.189 1.00 0.00 C ATOM 1738 CD1 ILE A 133 7.634 0.174 -2.210 1.00 0.00 C ATOM 0 H ILE A 133 8.094 4.251 -2.564 1.00 0.00 H new ATOM 0 HA ILE A 133 8.927 1.959 -1.186 1.00 0.00 H new ATOM 0 HB ILE A 133 8.549 2.968 -3.944 1.00 0.00 H new ATOM 0 HG12 ILE A 133 6.700 1.869 -3.024 1.00 0.00 H new ATOM 0 HG13 ILE A 133 7.357 0.757 -4.208 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.494 1.072 -5.132 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.696 2.155 -4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.328 0.585 -3.637 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.703 -0.393 -2.193 1.00 0.00 H new ATOM 0 HD12 ILE A 133 8.463 -0.496 -2.438 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.796 0.634 -1.235 1.00 0.00 H new ATOM 1750 N LYS A 134 11.252 3.888 -2.134 1.00 0.00 N ATOM 1751 CA LYS A 134 12.680 4.063 -2.118 1.00 0.00 C ATOM 1752 C LYS A 134 13.215 4.235 -0.710 1.00 0.00 C ATOM 1753 O LYS A 134 14.044 3.449 -0.257 1.00 0.00 O ATOM 1754 CB LYS A 134 13.120 5.200 -3.031 1.00 0.00 C ATOM 1755 CG LYS A 134 12.819 4.948 -4.510 1.00 0.00 C ATOM 1756 CD LYS A 134 13.266 6.082 -5.416 1.00 0.00 C ATOM 1757 CE LYS A 134 14.736 6.311 -5.302 1.00 0.00 C ATOM 1758 NZ LYS A 134 15.205 7.427 -6.158 1.00 0.00 N ATOM 0 H LYS A 134 10.714 4.723 -2.366 1.00 0.00 H new ATOM 0 HA LYS A 134 13.116 3.146 -2.513 1.00 0.00 H new ATOM 0 HB2 LYS A 134 12.623 6.119 -2.719 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.191 5.360 -2.909 1.00 0.00 H new ATOM 0 HG2 LYS A 134 13.312 4.027 -4.822 1.00 0.00 H new ATOM 0 HG3 LYS A 134 11.747 4.794 -4.634 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.010 5.849 -6.450 1.00 0.00 H new ATOM 0 HD3 LYS A 134 12.731 6.995 -5.153 1.00 0.00 H new ATOM 0 HE2 LYS A 134 14.988 6.524 -4.263 1.00 0.00 H new ATOM 0 HE3 LYS A 134 15.265 5.399 -5.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 16.232 7.545 -6.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.991 7.215 -7.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 14.722 8.305 -5.879 1.00 0.00 H new ATOM 1772 N THR A 135 12.692 5.203 -0.002 1.00 0.00 N ATOM 1773 CA THR A 135 13.229 5.547 1.301 1.00 0.00 C ATOM 1774 C THR A 135 12.338 5.095 2.449 1.00 0.00 C ATOM 1775 O THR A 135 12.816 4.806 3.542 1.00 0.00 O ATOM 1776 CB THR A 135 13.461 7.050 1.385 1.00 0.00 C ATOM 1777 OG1 THR A 135 12.265 7.732 0.971 1.00 0.00 O ATOM 1778 CG2 THR A 135 14.615 7.467 0.494 1.00 0.00 C ATOM 0 H THR A 135 11.897 5.769 -0.300 1.00 0.00 H new ATOM 0 HA THR A 135 14.174 5.014 1.405 1.00 0.00 H new ATOM 0 HB THR A 135 13.708 7.312 2.414 1.00 0.00 H new ATOM 0 HG1 THR A 135 12.257 8.636 1.348 1.00 0.00 H new ATOM 0 HG21 THR A 135 14.762 8.544 0.570 1.00 0.00 H new ATOM 0 HG22 THR A 135 15.523 6.953 0.810 1.00 0.00 H new ATOM 0 HG23 THR A 135 14.390 7.204 -0.540 1.00 0.00 H new ATOM 1786 N GLY A 136 11.058 5.019 2.200 1.00 0.00 N ATOM 1787 CA GLY A 136 10.144 4.618 3.243 1.00 0.00 C ATOM 1788 C GLY A 136 9.643 5.774 3.996 1.00 0.00 C ATOM 1789 O GLY A 136 9.584 5.751 5.205 1.00 0.00 O ATOM 0 H GLY A 136 10.626 5.225 1.299 1.00 0.00 H new ATOM 0 HA2 GLY A 136 9.305 4.077 2.805 1.00 0.00 H new ATOM 0 HA3 GLY A 136 10.646 3.930 3.923 1.00 0.00 H new ATOM 1793 N GLU A 137 9.294 6.777 3.273 1.00 0.00 N ATOM 1794 CA GLU A 137 8.808 7.993 3.827 1.00 0.00 C ATOM 1795 C GLU A 137 7.422 8.243 3.331 1.00 0.00 C ATOM 1796 O GLU A 137 7.067 7.784 2.250 1.00 0.00 O ATOM 1797 CB GLU A 137 9.708 9.105 3.446 1.00 0.00 C ATOM 1798 CG GLU A 137 11.073 9.009 4.083 1.00 0.00 C ATOM 1799 CD GLU A 137 11.989 10.088 3.590 1.00 0.00 C ATOM 1800 OE1 GLU A 137 12.648 9.878 2.557 1.00 0.00 O ATOM 1801 OE2 GLU A 137 12.066 11.161 4.205 1.00 0.00 O ATOM 0 H GLU A 137 9.339 6.777 2.254 1.00 0.00 H new ATOM 0 HA GLU A 137 8.784 7.923 4.914 1.00 0.00 H new ATOM 0 HB2 GLU A 137 9.820 9.118 2.362 1.00 0.00 H new ATOM 0 HB3 GLU A 137 9.247 10.051 3.730 1.00 0.00 H new ATOM 0 HG2 GLU A 137 10.975 9.081 5.166 1.00 0.00 H new ATOM 0 HG3 GLU A 137 11.509 8.034 3.866 1.00 0.00 H new ATOM 1808 N TRP A 138 6.644 8.928 4.110 1.00 0.00 N ATOM 1809 CA TRP A 138 5.250 9.097 3.821 1.00 0.00 C ATOM 1810 C TRP A 138 4.907 10.502 3.437 1.00 0.00 C ATOM 1811 O TRP A 138 5.568 11.461 3.831 1.00 0.00 O ATOM 1812 CB TRP A 138 4.411 8.724 5.036 1.00 0.00 C ATOM 1813 CG TRP A 138 4.717 7.395 5.615 1.00 0.00 C ATOM 1814 CD1 TRP A 138 5.440 6.390 5.062 1.00 0.00 C ATOM 1815 CD2 TRP A 138 4.265 6.900 6.854 1.00 0.00 C ATOM 1816 NE1 TRP A 138 5.509 5.365 5.919 1.00 0.00 N ATOM 1817 CE2 TRP A 138 4.802 5.634 7.001 1.00 0.00 C ATOM 1818 CE3 TRP A 138 3.484 7.408 7.853 1.00 0.00 C ATOM 1819 CZ2 TRP A 138 4.595 4.860 8.088 1.00 0.00 C ATOM 1820 CZ3 TRP A 138 3.262 6.615 8.961 1.00 0.00 C ATOM 1821 CH2 TRP A 138 3.825 5.349 9.065 1.00 0.00 C ATOM 0 H TRP A 138 6.956 9.387 4.966 1.00 0.00 H new ATOM 0 HA TRP A 138 5.032 8.442 2.977 1.00 0.00 H new ATOM 0 HB2 TRP A 138 4.554 9.482 5.806 1.00 0.00 H new ATOM 0 HB3 TRP A 138 3.358 8.749 4.755 1.00 0.00 H new ATOM 0 HD1 TRP A 138 5.891 6.413 4.081 1.00 0.00 H new ATOM 0 HE1 TRP A 138 6.031 4.503 5.760 1.00 0.00 H new ATOM 0 HE3 TRP A 138 3.055 8.396 7.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 5.037 3.878 8.165 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 2.639 6.986 9.762 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.638 4.753 9.946 1.00 0.00 H new ATOM 1832 N LYS A 139 3.838 10.590 2.722 1.00 0.00 N ATOM 1833 CA LYS A 139 3.225 11.819 2.299 1.00 0.00 C ATOM 1834 C LYS A 139 1.941 11.939 2.980 1.00 0.00 C ATOM 1835 O LYS A 139 1.327 10.954 3.320 1.00 0.00 O ATOM 1836 CB LYS A 139 2.993 11.820 0.805 1.00 0.00 C ATOM 1837 CG LYS A 139 4.258 11.965 0.060 1.00 0.00 C ATOM 1838 CD LYS A 139 4.093 11.845 -1.447 1.00 0.00 C ATOM 1839 CE LYS A 139 3.614 10.471 -1.874 1.00 0.00 C ATOM 1840 NZ LYS A 139 3.505 10.365 -3.348 1.00 0.00 N ATOM 0 H LYS A 139 3.335 9.765 2.395 1.00 0.00 H new ATOM 0 HA LYS A 139 3.882 12.654 2.544 1.00 0.00 H new ATOM 0 HB2 LYS A 139 2.501 10.892 0.512 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.319 12.635 0.541 1.00 0.00 H new ATOM 0 HG2 LYS A 139 4.698 12.934 0.293 1.00 0.00 H new ATOM 0 HG3 LYS A 139 4.961 11.205 0.402 1.00 0.00 H new ATOM 0 HD2 LYS A 139 3.383 12.597 -1.792 1.00 0.00 H new ATOM 0 HD3 LYS A 139 5.045 12.060 -1.931 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.305 9.713 -1.504 1.00 0.00 H new ATOM 0 HE3 LYS A 139 2.644 10.266 -1.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.127 9.430 -3.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 2.866 11.105 -3.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 4.446 10.485 -3.775 1.00 0.00 H new ATOM 1854 N LYS A 140 1.581 13.117 3.218 1.00 0.00 N ATOM 1855 CA LYS A 140 0.359 13.415 3.923 1.00 0.00 C ATOM 1856 C LYS A 140 -0.795 13.491 2.990 1.00 0.00 C ATOM 1857 O LYS A 140 -0.638 13.939 1.874 1.00 0.00 O ATOM 1858 CB LYS A 140 0.452 14.738 4.629 1.00 0.00 C ATOM 1859 CG LYS A 140 1.468 14.822 5.725 1.00 0.00 C ATOM 1860 CD LYS A 140 1.304 16.136 6.403 1.00 0.00 C ATOM 1861 CE LYS A 140 2.341 16.383 7.459 1.00 0.00 C ATOM 1862 NZ LYS A 140 2.060 17.642 8.163 1.00 0.00 N ATOM 0 H LYS A 140 2.114 13.940 2.937 1.00 0.00 H new ATOM 0 HA LYS A 140 0.211 12.609 4.642 1.00 0.00 H new ATOM 0 HB2 LYS A 140 0.678 15.507 3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -0.526 14.975 5.047 1.00 0.00 H new ATOM 0 HG2 LYS A 140 1.331 14.007 6.435 1.00 0.00 H new ATOM 0 HG3 LYS A 140 2.475 14.725 5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 140 1.354 16.931 5.659 1.00 0.00 H new ATOM 0 HD3 LYS A 140 0.314 16.184 6.856 1.00 0.00 H new ATOM 0 HE2 LYS A 140 2.352 15.556 8.169 1.00 0.00 H new ATOM 0 HE3 LYS A 140 3.331 16.426 7.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 2.956 18.114 8.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 1.493 18.263 7.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 1.532 17.441 9.036 1.00 0.00 H new ATOM 1876 N GLY A 141 -1.939 13.040 3.440 1.00 0.00 N ATOM 1877 CA GLY A 141 -3.134 13.209 2.694 1.00 0.00 C ATOM 1878 C GLY A 141 -4.084 12.050 2.808 1.00 0.00 C ATOM 1879 O GLY A 141 -3.939 11.184 3.666 1.00 0.00 O ATOM 0 H GLY A 141 -2.055 12.551 4.328 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.638 14.115 3.031 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -2.879 13.357 1.645 1.00 0.00 H new ATOM 1883 N ASN A 142 -5.026 12.048 1.916 1.00 0.00 N ATOM 1884 CA ASN A 142 -6.044 11.033 1.775 1.00 0.00 C ATOM 1885 C ASN A 142 -6.318 10.865 0.306 1.00 0.00 C ATOM 1886 O ASN A 142 -6.354 11.844 -0.422 1.00 0.00 O ATOM 1887 CB ASN A 142 -7.348 11.380 2.548 1.00 0.00 C ATOM 1888 CG ASN A 142 -7.897 12.816 2.371 1.00 0.00 C ATOM 1889 OD1 ASN A 142 -7.664 13.441 1.258 1.00 0.00 O flip ATOM 1890 ND2 ASN A 142 -8.531 13.348 3.260 1.00 0.00 N flip ATOM 0 H ASN A 142 -5.117 12.793 1.225 1.00 0.00 H new ATOM 0 HA ASN A 142 -5.683 10.102 2.212 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -8.123 10.678 2.240 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -7.169 11.212 3.610 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -8.708 12.847 4.131 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -8.887 14.296 3.136 1.00 0.00 H new ATOM 1897 N CYS A 143 -6.487 9.671 -0.159 1.00 0.00 N ATOM 1898 CA CYS A 143 -6.657 9.495 -1.568 1.00 0.00 C ATOM 1899 C CYS A 143 -8.046 9.648 -2.026 1.00 0.00 C ATOM 1900 O CYS A 143 -8.730 8.700 -2.343 1.00 0.00 O ATOM 1901 CB CYS A 143 -5.996 8.274 -2.127 1.00 0.00 C ATOM 1902 SG CYS A 143 -4.599 8.692 -3.222 1.00 0.00 S ATOM 0 H CYS A 143 -6.511 8.818 0.400 1.00 0.00 H new ATOM 0 HA CYS A 143 -6.109 10.334 -1.996 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.640 7.648 -1.309 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -6.728 7.688 -2.682 1.00 0.00 H new ATOM 1907 N GLU A 144 -8.449 10.861 -2.021 1.00 0.00 N ATOM 1908 CA GLU A 144 -9.736 11.277 -2.506 1.00 0.00 C ATOM 1909 C GLU A 144 -9.615 11.631 -3.996 1.00 0.00 C ATOM 1910 O GLU A 144 -10.365 12.448 -4.541 1.00 0.00 O ATOM 1911 CB GLU A 144 -10.213 12.465 -1.683 1.00 0.00 C ATOM 1912 CG GLU A 144 -10.328 12.183 -0.179 1.00 0.00 C ATOM 1913 CD GLU A 144 -11.378 11.180 0.168 1.00 0.00 C ATOM 1914 OE1 GLU A 144 -12.583 11.504 0.068 1.00 0.00 O ATOM 1915 OE2 GLU A 144 -11.030 10.056 0.566 1.00 0.00 O ATOM 0 H GLU A 144 -7.881 11.631 -1.669 1.00 0.00 H new ATOM 0 HA GLU A 144 -10.469 10.477 -2.404 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -9.525 13.297 -1.834 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -11.186 12.784 -2.057 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -9.365 11.829 0.189 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -10.545 13.116 0.341 1.00 0.00 H new ATOM 1922 N VAL A 145 -8.693 10.967 -4.636 1.00 0.00 N ATOM 1923 CA VAL A 145 -8.402 11.123 -6.042 1.00 0.00 C ATOM 1924 C VAL A 145 -8.572 9.789 -6.722 1.00 0.00 C ATOM 1925 O VAL A 145 -8.396 8.750 -6.101 1.00 0.00 O ATOM 1926 CB VAL A 145 -6.955 11.643 -6.299 1.00 0.00 C ATOM 1927 CG1 VAL A 145 -6.757 12.952 -5.611 1.00 0.00 C ATOM 1928 CG2 VAL A 145 -5.892 10.647 -5.845 1.00 0.00 C ATOM 0 H VAL A 145 -8.099 10.275 -4.179 1.00 0.00 H new ATOM 0 HA VAL A 145 -9.092 11.865 -6.444 1.00 0.00 H new ATOM 0 HB VAL A 145 -6.840 11.770 -7.375 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -5.744 13.310 -5.794 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -7.474 13.678 -5.996 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -6.909 12.826 -4.539 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -4.901 11.055 -6.045 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -5.999 10.463 -4.776 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -6.015 9.710 -6.389 1.00 0.00 H new ATOM 1938 N SER A 146 -8.884 9.819 -7.979 1.00 0.00 N ATOM 1939 CA SER A 146 -9.118 8.612 -8.738 1.00 0.00 C ATOM 1940 C SER A 146 -7.829 7.995 -9.250 1.00 0.00 C ATOM 1941 O SER A 146 -7.822 6.890 -9.773 1.00 0.00 O ATOM 1942 CB SER A 146 -10.070 8.896 -9.861 1.00 0.00 C ATOM 1943 OG SER A 146 -11.256 9.480 -9.345 1.00 0.00 O ATOM 0 H SER A 146 -8.986 10.679 -8.518 1.00 0.00 H new ATOM 0 HA SER A 146 -9.566 7.876 -8.070 1.00 0.00 H new ATOM 0 HB2 SER A 146 -9.606 9.568 -10.583 1.00 0.00 H new ATOM 0 HB3 SER A 146 -10.308 7.974 -10.391 1.00 0.00 H new ATOM 0 HG SER A 146 -11.350 9.247 -8.398 1.00 0.00 H new ATOM 1949 N SER A 147 -6.745 8.687 -9.026 1.00 0.00 N ATOM 1950 CA SER A 147 -5.438 8.342 -9.541 1.00 0.00 C ATOM 1951 C SER A 147 -4.759 7.161 -8.799 1.00 0.00 C ATOM 1952 O SER A 147 -3.536 7.000 -8.858 1.00 0.00 O ATOM 1953 CB SER A 147 -4.594 9.584 -9.448 1.00 0.00 C ATOM 1954 OG SER A 147 -5.341 10.711 -9.897 1.00 0.00 O ATOM 0 H SER A 147 -6.742 9.536 -8.461 1.00 0.00 H new ATOM 0 HA SER A 147 -5.547 7.995 -10.568 1.00 0.00 H new ATOM 0 HB2 SER A 147 -4.270 9.738 -8.419 1.00 0.00 H new ATOM 0 HB3 SER A 147 -3.694 9.469 -10.052 1.00 0.00 H new ATOM 0 HG SER A 147 -4.787 11.517 -9.833 1.00 0.00 H new ATOM 1960 N VAL A 148 -5.529 6.327 -8.147 1.00 0.00 N ATOM 1961 CA VAL A 148 -4.940 5.195 -7.457 1.00 0.00 C ATOM 1962 C VAL A 148 -5.215 3.934 -8.212 1.00 0.00 C ATOM 1963 O VAL A 148 -6.365 3.581 -8.480 1.00 0.00 O ATOM 1964 CB VAL A 148 -5.383 5.004 -6.010 1.00 0.00 C ATOM 1965 CG1 VAL A 148 -4.411 4.066 -5.327 1.00 0.00 C ATOM 1966 CG2 VAL A 148 -5.491 6.328 -5.304 1.00 0.00 C ATOM 0 H VAL A 148 -6.544 6.402 -8.076 1.00 0.00 H new ATOM 0 HA VAL A 148 -3.875 5.423 -7.418 1.00 0.00 H new ATOM 0 HB VAL A 148 -6.377 4.559 -5.978 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -4.714 3.919 -4.290 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -4.408 3.106 -5.844 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -3.410 4.496 -5.355 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -5.808 6.166 -4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -4.521 6.824 -5.311 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -6.222 6.954 -5.815 1.00 0.00 H new ATOM 1976 N GLU A 149 -4.166 3.289 -8.563 1.00 0.00 N ATOM 1977 CA GLU A 149 -4.199 2.092 -9.361 1.00 0.00 C ATOM 1978 C GLU A 149 -3.564 0.933 -8.655 1.00 0.00 C ATOM 1979 O GLU A 149 -3.240 -0.061 -9.283 1.00 0.00 O ATOM 1980 CB GLU A 149 -3.579 2.292 -10.720 1.00 0.00 C ATOM 1981 CG GLU A 149 -4.335 3.236 -11.615 1.00 0.00 C ATOM 1982 CD GLU A 149 -3.609 3.493 -12.893 1.00 0.00 C ATOM 1983 OE1 GLU A 149 -3.522 2.575 -13.745 1.00 0.00 O ATOM 1984 OE2 GLU A 149 -3.120 4.620 -13.080 1.00 0.00 O ATOM 0 H GLU A 149 -3.223 3.578 -8.301 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.253 1.858 -9.513 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -2.564 2.667 -10.591 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -3.501 1.325 -11.216 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -5.318 2.820 -11.834 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -4.497 4.179 -11.093 1.00 0.00 H new ATOM 1991 N GLY A 150 -3.296 1.090 -7.392 1.00 0.00 N ATOM 1992 CA GLY A 150 -2.749 0.017 -6.641 1.00 0.00 C ATOM 1993 C GLY A 150 -2.611 0.350 -5.199 1.00 0.00 C ATOM 1994 O GLY A 150 -2.157 1.437 -4.841 1.00 0.00 O ATOM 0 H GLY A 150 -3.450 1.952 -6.868 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -3.386 -0.861 -6.749 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -1.772 -0.246 -7.046 1.00 0.00 H new ATOM 1998 N THR A 151 -2.997 -0.564 -4.378 1.00 0.00 N ATOM 1999 CA THR A 151 -2.906 -0.408 -2.971 1.00 0.00 C ATOM 2000 C THR A 151 -2.392 -1.678 -2.360 1.00 0.00 C ATOM 2001 O THR A 151 -2.543 -2.774 -2.943 1.00 0.00 O ATOM 2002 CB THR A 151 -4.272 -0.024 -2.336 1.00 0.00 C ATOM 2003 OG1 THR A 151 -4.178 -0.052 -0.915 1.00 0.00 O ATOM 2004 CG2 THR A 151 -5.387 -0.950 -2.788 1.00 0.00 C ATOM 0 H THR A 151 -3.392 -1.457 -4.673 1.00 0.00 H new ATOM 0 HA THR A 151 -2.214 0.410 -2.768 1.00 0.00 H new ATOM 0 HB THR A 151 -4.514 0.985 -2.671 1.00 0.00 H new ATOM 0 HG1 THR A 151 -4.266 -0.976 -0.599 1.00 0.00 H new ATOM 0 HG21 THR A 151 -6.324 -0.646 -2.321 1.00 0.00 H new ATOM 0 HG22 THR A 151 -5.488 -0.896 -3.872 1.00 0.00 H new ATOM 0 HG23 THR A 151 -5.151 -1.973 -2.496 1.00 0.00 H new ATOM 2012 N LEU A 152 -1.728 -1.543 -1.243 1.00 0.00 N ATOM 2013 CA LEU A 152 -1.284 -2.671 -0.530 1.00 0.00 C ATOM 2014 C LEU A 152 -2.317 -2.989 0.491 1.00 0.00 C ATOM 2015 O LEU A 152 -2.853 -2.093 1.154 1.00 0.00 O ATOM 2016 CB LEU A 152 0.035 -2.457 0.169 1.00 0.00 C ATOM 2017 CG LEU A 152 0.530 -3.743 0.820 1.00 0.00 C ATOM 2018 CD1 LEU A 152 1.195 -4.687 -0.107 1.00 0.00 C ATOM 2019 CD2 LEU A 152 1.328 -3.522 2.003 1.00 0.00 C ATOM 0 H LEU A 152 -1.490 -0.647 -0.819 1.00 0.00 H new ATOM 0 HA LEU A 152 -1.133 -3.481 -1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 152 0.775 -2.101 -0.547 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -0.074 -1.681 0.927 1.00 0.00 H new ATOM 0 HG LEU A 152 -0.391 -4.232 1.138 1.00 0.00 H new ATOM 0 HD11 LEU A 152 1.514 -5.573 0.443 1.00 0.00 H new ATOM 0 HD12 LEU A 152 0.497 -4.979 -0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 152 2.064 -4.205 -0.555 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.645 -4.481 2.412 1.00 0.00 H new ATOM 0 HD22 LEU A 152 2.206 -2.930 1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 152 0.736 -2.988 2.747 1.00 0.00 H new ATOM 2031 N CYS A 153 -2.617 -4.208 0.610 1.00 0.00 N ATOM 2032 CA CYS A 153 -3.587 -4.625 1.531 1.00 0.00 C ATOM 2033 C CYS A 153 -2.946 -5.335 2.665 1.00 0.00 C ATOM 2034 O CYS A 153 -1.975 -6.072 2.487 1.00 0.00 O ATOM 2035 CB CYS A 153 -4.548 -5.529 0.843 1.00 0.00 C ATOM 2036 SG CYS A 153 -5.123 -4.831 -0.717 1.00 0.00 S ATOM 0 H CYS A 153 -2.194 -4.960 0.066 1.00 0.00 H new ATOM 0 HA CYS A 153 -4.115 -3.755 1.923 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -4.072 -6.492 0.657 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -5.402 -5.716 1.494 1.00 0.00 H new ATOM 2041 N LYS A 154 -3.474 -5.102 3.803 1.00 0.00 N ATOM 2042 CA LYS A 154 -3.059 -5.726 4.998 1.00 0.00 C ATOM 2043 C LYS A 154 -4.287 -6.273 5.679 1.00 0.00 C ATOM 2044 O LYS A 154 -5.297 -5.585 5.820 1.00 0.00 O ATOM 2045 CB LYS A 154 -2.332 -4.750 5.930 1.00 0.00 C ATOM 2046 CG LYS A 154 -2.002 -5.344 7.296 1.00 0.00 C ATOM 2047 CD LYS A 154 -1.340 -4.329 8.212 1.00 0.00 C ATOM 2048 CE LYS A 154 -1.018 -4.942 9.569 1.00 0.00 C ATOM 2049 NZ LYS A 154 -2.224 -5.267 10.375 1.00 0.00 N ATOM 0 H LYS A 154 -4.241 -4.442 3.934 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.353 -6.522 4.761 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.408 -4.423 5.452 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -2.950 -3.863 6.068 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -2.916 -5.711 7.762 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -1.342 -6.202 7.169 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -0.424 -3.960 7.750 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -1.998 -3.470 8.344 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -0.435 -5.851 9.419 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -0.391 -4.250 10.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -1.933 -5.616 11.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -2.805 -4.412 10.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -2.779 -6.000 9.889 1.00 0.00 H new ATOM 2063 N THR A 155 -4.215 -7.476 6.048 1.00 0.00 N ATOM 2064 CA THR A 155 -5.257 -8.126 6.751 1.00 0.00 C ATOM 2065 C THR A 155 -4.549 -8.879 7.825 1.00 0.00 C ATOM 2066 O THR A 155 -3.400 -9.264 7.620 1.00 0.00 O ATOM 2067 CB THR A 155 -6.039 -9.116 5.816 1.00 0.00 C ATOM 2068 OG1 THR A 155 -7.224 -9.615 6.464 1.00 0.00 O ATOM 2069 CG2 THR A 155 -5.154 -10.298 5.409 1.00 0.00 C ATOM 0 H THR A 155 -3.405 -8.070 5.869 1.00 0.00 H new ATOM 0 HA THR A 155 -5.997 -7.425 7.137 1.00 0.00 H new ATOM 0 HB THR A 155 -6.328 -8.559 4.925 1.00 0.00 H new ATOM 0 HG1 THR A 155 -8.001 -9.467 5.885 1.00 0.00 H new ATOM 0 HG21 THR A 155 -5.718 -10.969 4.762 1.00 0.00 H new ATOM 0 HG22 THR A 155 -4.278 -9.930 4.875 1.00 0.00 H new ATOM 0 HG23 THR A 155 -4.835 -10.837 6.301 1.00 0.00 H new ATOM 2077 N ALA A 156 -5.125 -9.036 8.943 1.00 0.00 N ATOM 2078 CA ALA A 156 -4.462 -9.793 9.947 1.00 0.00 C ATOM 2079 C ALA A 156 -4.940 -11.183 9.901 1.00 0.00 C ATOM 2080 O ALA A 156 -6.050 -11.453 9.429 1.00 0.00 O ATOM 2081 CB ALA A 156 -4.658 -9.232 11.322 1.00 0.00 C ATOM 0 H ALA A 156 -6.040 -8.663 9.197 1.00 0.00 H new ATOM 0 HA ALA A 156 -3.393 -9.749 9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -4.129 -9.851 12.046 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -4.267 -8.215 11.359 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -5.721 -9.220 11.562 1.00 0.00 H new ATOM 2087 N ILE A 157 -4.132 -12.063 10.374 1.00 0.00 N ATOM 2088 CA ILE A 157 -4.488 -13.404 10.410 1.00 0.00 C ATOM 2089 C ILE A 157 -4.839 -13.856 11.812 1.00 0.00 C ATOM 2090 O ILE A 157 -4.003 -13.912 12.713 1.00 0.00 O ATOM 2091 CB ILE A 157 -3.447 -14.282 9.819 1.00 0.00 C ATOM 2092 CG1 ILE A 157 -2.120 -13.930 10.383 1.00 0.00 C ATOM 2093 CG2 ILE A 157 -3.468 -14.138 8.313 1.00 0.00 C ATOM 2094 CD1 ILE A 157 -1.082 -14.808 9.915 1.00 0.00 C ATOM 0 H ILE A 157 -3.205 -11.855 10.745 1.00 0.00 H new ATOM 0 HA ILE A 157 -5.381 -13.498 9.793 1.00 0.00 H new ATOM 0 HB ILE A 157 -3.649 -15.325 10.064 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -1.874 -12.903 10.114 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -2.167 -13.972 11.471 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -2.705 -14.781 7.875 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -4.448 -14.428 7.933 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -3.267 -13.101 8.044 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -0.129 -14.512 10.354 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -1.313 -15.833 10.207 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -1.016 -14.746 8.829 1.00 0.00 H new ATOM 2106 N PRO A 158 -6.096 -14.170 11.997 1.00 0.00 N ATOM 2107 CA PRO A 158 -6.661 -14.683 13.254 1.00 0.00 C ATOM 2108 C PRO A 158 -6.064 -16.017 13.673 1.00 0.00 C ATOM 2109 O PRO A 158 -6.260 -16.492 14.776 1.00 0.00 O ATOM 2110 CB PRO A 158 -8.154 -14.796 12.967 1.00 0.00 C ATOM 2111 CG PRO A 158 -8.376 -13.914 11.786 1.00 0.00 C ATOM 2112 CD PRO A 158 -7.105 -13.949 10.998 1.00 0.00 C ATOM 0 HA PRO A 158 -6.440 -14.024 14.093 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -8.440 -15.826 12.752 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -8.748 -14.472 13.822 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -9.216 -14.268 11.188 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -8.613 -12.897 12.098 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -7.115 -14.746 10.255 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -6.940 -13.015 10.461 1.00 0.00 H new ATOM 2120 N TYR A 159 -5.304 -16.552 12.792 1.00 0.00 N ATOM 2121 CA TYR A 159 -4.579 -17.789 12.993 1.00 0.00 C ATOM 2122 C TYR A 159 -3.470 -17.532 14.003 1.00 0.00 C ATOM 2123 O TYR A 159 -3.151 -18.367 14.847 1.00 0.00 O ATOM 2124 CB TYR A 159 -3.931 -18.263 11.685 1.00 0.00 C ATOM 2125 CG TYR A 159 -4.855 -18.563 10.556 1.00 0.00 C ATOM 2126 CD1 TYR A 159 -5.427 -17.541 9.881 1.00 0.00 C ATOM 2127 CD2 TYR A 159 -5.100 -19.858 10.128 1.00 0.00 C ATOM 2128 CE1 TYR A 159 -6.223 -17.746 8.816 1.00 0.00 C ATOM 2129 CE2 TYR A 159 -5.921 -20.095 9.045 1.00 0.00 C ATOM 2130 CZ TYR A 159 -6.481 -19.023 8.388 1.00 0.00 C ATOM 2131 OH TYR A 159 -7.291 -19.225 7.290 1.00 0.00 O ATOM 0 H TYR A 159 -5.152 -16.140 11.871 1.00 0.00 H new ATOM 0 HA TYR A 159 -5.274 -18.552 13.343 1.00 0.00 H new ATOM 0 HB2 TYR A 159 -3.228 -17.498 11.356 1.00 0.00 H new ATOM 0 HB3 TYR A 159 -3.350 -19.160 11.898 1.00 0.00 H new ATOM 0 HD1 TYR A 159 -5.239 -16.529 10.207 1.00 0.00 H new ATOM 0 HD2 TYR A 159 -4.644 -20.689 10.647 1.00 0.00 H new ATOM 0 HE1 TYR A 159 -6.659 -16.905 8.298 1.00 0.00 H new ATOM 0 HE2 TYR A 159 -6.121 -21.105 8.718 1.00 0.00 H new ATOM 0 HH TYR A 159 -7.373 -20.186 7.116 1.00 0.00 H new ATOM 2141 N LYS A 160 -2.928 -16.331 13.917 1.00 0.00 N ATOM 2142 CA LYS A 160 -1.808 -15.888 14.725 1.00 0.00 C ATOM 2143 C LYS A 160 -2.228 -14.697 15.584 1.00 0.00 C ATOM 2144 O LYS A 160 -1.382 -13.913 16.050 1.00 0.00 O ATOM 2145 CB LYS A 160 -0.645 -15.477 13.805 1.00 0.00 C ATOM 2146 CG LYS A 160 -0.054 -16.608 12.960 1.00 0.00 C ATOM 2147 CD LYS A 160 0.642 -17.644 13.824 1.00 0.00 C ATOM 2148 CE LYS A 160 1.358 -18.700 12.988 1.00 0.00 C ATOM 2149 NZ LYS A 160 0.437 -19.555 12.211 1.00 0.00 N ATOM 0 H LYS A 160 -3.263 -15.620 13.267 1.00 0.00 H new ATOM 0 HA LYS A 160 -1.488 -16.702 15.376 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -0.992 -14.689 13.137 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.149 -15.049 14.418 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -0.847 -17.086 12.385 1.00 0.00 H new ATOM 0 HG3 LYS A 160 0.655 -16.195 12.243 1.00 0.00 H new ATOM 0 HD2 LYS A 160 1.362 -17.148 14.475 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.091 -18.129 14.470 1.00 0.00 H new ATOM 0 HE2 LYS A 160 2.047 -18.205 12.304 1.00 0.00 H new ATOM 0 HE3 LYS A 160 1.958 -19.329 13.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 0.980 -20.293 11.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -0.249 -20.000 12.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -0.070 -18.974 11.513 1.00 0.00 H new ATOM 2163 N ARG A 161 -3.514 -14.578 15.815 1.00 0.00 N ATOM 2164 CA ARG A 161 -4.046 -13.496 16.607 1.00 0.00 C ATOM 2165 C ARG A 161 -4.565 -14.085 17.898 1.00 0.00 C ATOM 2166 O ARG A 161 -5.734 -14.493 17.940 1.00 0.00 O ATOM 2167 CB ARG A 161 -5.188 -12.791 15.865 1.00 0.00 C ATOM 2168 CG ARG A 161 -5.656 -11.500 16.523 1.00 0.00 C ATOM 2169 CD ARG A 161 -6.843 -10.896 15.787 1.00 0.00 C ATOM 2170 NE ARG A 161 -8.019 -11.790 15.807 1.00 0.00 N ATOM 2171 CZ ARG A 161 -9.069 -11.720 14.973 1.00 0.00 C ATOM 2172 NH1 ARG A 161 -9.138 -10.768 14.041 1.00 0.00 N ATOM 2173 NH2 ARG A 161 -10.050 -12.609 15.080 1.00 0.00 N ATOM 2174 OXT ARG A 161 -3.793 -14.211 18.865 1.00 0.00 O ATOM 0 H ARG A 161 -4.218 -15.226 15.461 1.00 0.00 H new ATOM 0 HA ARG A 161 -3.267 -12.759 16.800 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -4.864 -12.571 14.848 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -6.034 -13.474 15.789 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -5.931 -11.698 17.559 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -4.836 -10.783 16.543 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -7.105 -9.942 16.243 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -6.562 -10.689 14.754 1.00 0.00 H new ATOM 0 HE ARG A 161 -8.035 -12.524 16.515 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -8.388 -10.082 13.956 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -9.941 -10.726 13.414 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -10.002 -13.338 15.792 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -10.851 -12.563 14.450 1.00 0.00 H new TER 2188 ARG A 161