USER MOD reduce.3.24.130724 H: found=0, std=0, add=1042, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 7 THR OG1 : rot 138:sc= 0.523 USER MOD Set 1.2: A 132 THR OG1 : rot -170:sc= 0.073 USER MOD Set 2.1: A 61 HIS : no HD1:sc= -1.94 K(o=-1.9,f=-5.5!) USER MOD Set 2.2: A 62 THR OG1 : rot 180:sc= 0.0356 USER MOD Set 3.1: A 52 GLN : amide:sc= -6.86! K(o=-17!,f=-9.7) USER MOD Set 3.2: A 56 THR OG1 : rot 180:sc= -1.67! USER MOD Set 3.3: A 107 MET CE :methyl -172:sc= -8.4! (180deg=-5.3!) USER MOD Single : A 1 SER N :NH3+ -178:sc= 0 (180deg=-0.00598) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 ASN : amide:sc= 0.00551 X(o=0.0055,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -2.54 K(o=-2.5,f=-0.99) USER MOD Single : A 16 GLN : amide:sc= -0.0399 X(o=-0.04,f=-0.27) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 110:sc= 0.487 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 146:sc= -1.35! USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.0411 X(o=-0.041,f=-0.0097) USER MOD Single : A 31 HIS : no HD1:sc= -0.429 X(o=-0.43,f=-0.012) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl -98:sc= -0.0166 (180deg=-1.84) USER MOD Single : A 42 GLN : amide:sc= -5.27! C(o=-5.3!,f=-2.3!) USER MOD Single : A 45 SER OG : rot -113:sc= 1.64 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HE2:sc= -0.649 K(o=-0.65,f=-1.8!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 84:sc= -0.172 USER MOD Single : A 70 ASN : amide:sc= -11.7! C(o=-12!,f=-17!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HD1:sc= 0.181 K(o=0.18,f=-2.1!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 170:sc= -1.03! USER MOD Single : A 89 ASN : amide:sc= -3.6! K(o=-3.6!,f=-1.9) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0206 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 MET CE :methyl 152:sc= 0 (180deg=-0.879) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.259 K(o=-0.26,f=-1.4!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -7.617 -24.359 -4.442 1.00 0.00 N ATOM 2 CA SER A 1 -8.785 -24.681 -3.580 1.00 0.00 C ATOM 3 C SER A 1 -8.908 -23.690 -2.427 1.00 0.00 C ATOM 4 O SER A 1 -9.999 -23.204 -2.128 1.00 0.00 O ATOM 5 CB SER A 1 -8.613 -26.102 -3.038 1.00 0.00 C ATOM 6 OG SER A 1 -8.405 -27.026 -4.092 1.00 0.00 O ATOM 0 H1 SER A 1 -7.577 -25.028 -5.237 1.00 0.00 H new ATOM 0 H2 SER A 1 -7.713 -23.391 -4.809 1.00 0.00 H new ATOM 0 H3 SER A 1 -6.743 -24.432 -3.884 1.00 0.00 H new ATOM 0 HA SER A 1 -9.698 -24.612 -4.172 1.00 0.00 H new ATOM 0 HB2 SER A 1 -7.768 -26.133 -2.350 1.00 0.00 H new ATOM 0 HB3 SER A 1 -9.498 -26.387 -2.469 1.00 0.00 H new ATOM 0 HG SER A 1 -8.296 -27.926 -3.721 1.00 0.00 H new ATOM 14 N GLY A 2 -7.783 -23.397 -1.783 1.00 0.00 N ATOM 15 CA GLY A 2 -7.785 -22.465 -0.669 1.00 0.00 C ATOM 16 C GLY A 2 -7.825 -21.019 -1.123 1.00 0.00 C ATOM 17 O GLY A 2 -7.429 -20.703 -2.245 1.00 0.00 O ATOM 0 H GLY A 2 -6.869 -23.788 -2.012 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -8.646 -22.667 -0.032 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.895 -22.627 -0.062 1.00 0.00 H new ATOM 21 N PHE A 3 -8.302 -20.140 -0.249 1.00 0.00 N ATOM 22 CA PHE A 3 -8.393 -18.719 -0.565 1.00 0.00 C ATOM 23 C PHE A 3 -7.046 -18.031 -0.369 1.00 0.00 C ATOM 24 O PHE A 3 -6.320 -18.322 0.583 1.00 0.00 O ATOM 25 CB PHE A 3 -9.454 -18.047 0.310 1.00 0.00 C ATOM 26 CG PHE A 3 -10.839 -18.584 0.093 1.00 0.00 C ATOM 27 CD1 PHE A 3 -11.653 -18.058 -0.900 1.00 0.00 C ATOM 28 CD2 PHE A 3 -11.329 -19.614 0.879 1.00 0.00 C ATOM 29 CE1 PHE A 3 -12.928 -18.551 -1.102 1.00 0.00 C ATOM 30 CE2 PHE A 3 -12.603 -20.111 0.680 1.00 0.00 C ATOM 31 CZ PHE A 3 -13.404 -19.578 -0.311 1.00 0.00 C ATOM 0 H PHE A 3 -8.632 -20.386 0.684 1.00 0.00 H new ATOM 0 HA PHE A 3 -8.681 -18.623 -1.612 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -9.183 -18.176 1.358 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -9.453 -16.976 0.110 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -11.286 -17.255 -1.522 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -10.708 -20.034 1.657 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -13.552 -18.133 -1.878 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -12.972 -20.916 1.299 1.00 0.00 H new ATOM 0 HZ PHE A 3 -14.401 -19.964 -0.467 1.00 0.00 H new ATOM 41 N VAL A 4 -6.717 -17.116 -1.276 1.00 0.00 N ATOM 42 CA VAL A 4 -5.457 -16.386 -1.204 1.00 0.00 C ATOM 43 C VAL A 4 -5.666 -14.903 -1.495 1.00 0.00 C ATOM 44 O VAL A 4 -4.913 -14.053 -1.019 1.00 0.00 O ATOM 45 CB VAL A 4 -4.421 -16.956 -2.195 1.00 0.00 C ATOM 46 CG1 VAL A 4 -4.904 -16.799 -3.629 1.00 0.00 C ATOM 47 CG2 VAL A 4 -3.069 -16.284 -2.002 1.00 0.00 C ATOM 0 H VAL A 4 -7.306 -16.863 -2.069 1.00 0.00 H new ATOM 0 HA VAL A 4 -5.078 -16.503 -0.189 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.304 -18.021 -1.993 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -4.158 -17.207 -4.311 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -5.845 -17.335 -3.757 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.056 -15.742 -3.848 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -2.352 -16.699 -2.710 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.168 -15.212 -2.173 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -2.718 -16.459 -0.985 1.00 0.00 H new ATOM 57 N CYS A 5 -6.697 -14.599 -2.279 1.00 0.00 N ATOM 58 CA CYS A 5 -7.008 -13.218 -2.633 1.00 0.00 C ATOM 59 C CYS A 5 -7.840 -12.551 -1.541 1.00 0.00 C ATOM 60 O CYS A 5 -9.017 -12.248 -1.740 1.00 0.00 O ATOM 61 CB CYS A 5 -7.757 -13.170 -3.966 1.00 0.00 C ATOM 62 SG CYS A 5 -7.327 -11.739 -5.010 1.00 0.00 S ATOM 0 H CYS A 5 -7.331 -15.290 -2.681 1.00 0.00 H new ATOM 0 HA CYS A 5 -6.070 -12.672 -2.732 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -7.550 -14.086 -4.520 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -8.829 -13.153 -3.768 1.00 0.00 H new ATOM 67 N ASN A 6 -7.219 -12.326 -0.387 1.00 0.00 N ATOM 68 CA ASN A 6 -7.901 -11.695 0.737 1.00 0.00 C ATOM 69 C ASN A 6 -6.897 -11.125 1.734 1.00 0.00 C ATOM 70 O ASN A 6 -7.159 -11.077 2.936 1.00 0.00 O ATOM 71 CB ASN A 6 -8.817 -12.703 1.435 1.00 0.00 C ATOM 72 CG ASN A 6 -10.172 -12.114 1.773 1.00 0.00 C ATOM 73 OD1 ASN A 6 -10.441 -11.764 2.922 1.00 0.00 O ATOM 74 ND2 ASN A 6 -11.037 -12.004 0.771 1.00 0.00 N ATOM 0 H ASN A 6 -6.246 -12.571 -0.206 1.00 0.00 H new ATOM 0 HA ASN A 6 -8.504 -10.874 0.349 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -8.952 -13.573 0.792 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -8.338 -13.053 2.349 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -11.966 -11.617 0.939 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -10.773 -12.307 -0.167 1.00 0.00 H new ATOM 81 N THR A 7 -5.747 -10.693 1.226 1.00 0.00 N ATOM 82 CA THR A 7 -4.704 -10.125 2.072 1.00 0.00 C ATOM 83 C THR A 7 -5.145 -8.787 2.653 1.00 0.00 C ATOM 84 O THR A 7 -4.531 -8.272 3.586 1.00 0.00 O ATOM 85 CB THR A 7 -3.408 -9.943 1.275 1.00 0.00 C ATOM 86 OG1 THR A 7 -2.283 -9.973 2.134 1.00 0.00 O ATOM 87 CG2 THR A 7 -3.353 -8.643 0.494 1.00 0.00 C ATOM 0 H THR A 7 -5.514 -10.726 0.233 1.00 0.00 H new ATOM 0 HA THR A 7 -4.523 -10.818 2.893 1.00 0.00 H new ATOM 0 HB THR A 7 -3.391 -10.772 0.567 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.568 -10.498 1.718 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.408 -8.582 -0.046 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.179 -8.610 -0.216 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.433 -7.801 1.182 1.00 0.00 H new ATOM 95 N CYS A 8 -6.207 -8.227 2.086 1.00 0.00 N ATOM 96 CA CYS A 8 -6.729 -6.943 2.536 1.00 0.00 C ATOM 97 C CYS A 8 -8.044 -7.120 3.299 1.00 0.00 C ATOM 98 O CYS A 8 -9.118 -7.181 2.699 1.00 0.00 O ATOM 99 CB CYS A 8 -6.929 -6.018 1.335 1.00 0.00 C ATOM 100 SG CYS A 8 -5.735 -6.297 -0.016 1.00 0.00 S ATOM 0 H CYS A 8 -6.724 -8.643 1.312 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.006 -6.495 3.218 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.939 -6.153 0.948 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -6.851 -4.983 1.668 1.00 0.00 H new ATOM 105 N PRO A 9 -7.972 -7.214 4.642 1.00 0.00 N ATOM 106 CA PRO A 9 -9.141 -7.393 5.494 1.00 0.00 C ATOM 107 C PRO A 9 -9.746 -6.070 5.965 1.00 0.00 C ATOM 108 O PRO A 9 -10.778 -5.634 5.454 1.00 0.00 O ATOM 109 CB PRO A 9 -8.567 -8.174 6.673 1.00 0.00 C ATOM 110 CG PRO A 9 -7.136 -7.744 6.776 1.00 0.00 C ATOM 111 CD PRO A 9 -6.737 -7.163 5.437 1.00 0.00 C ATOM 0 HA PRO A 9 -9.960 -7.891 4.975 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -9.110 -7.954 7.592 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.643 -9.249 6.507 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.014 -7.004 7.567 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.499 -8.591 7.032 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.370 -6.142 5.539 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.940 -7.743 4.972 1.00 0.00 H new ATOM 119 N GLU A 10 -9.096 -5.436 6.936 1.00 0.00 N ATOM 120 CA GLU A 10 -9.566 -4.164 7.470 1.00 0.00 C ATOM 121 C GLU A 10 -8.839 -3.016 6.790 1.00 0.00 C ATOM 122 O GLU A 10 -7.613 -3.032 6.689 1.00 0.00 O ATOM 123 CB GLU A 10 -9.344 -4.103 8.983 1.00 0.00 C ATOM 124 CG GLU A 10 -10.541 -3.568 9.753 1.00 0.00 C ATOM 125 CD GLU A 10 -11.084 -4.569 10.755 1.00 0.00 C ATOM 126 OE1 GLU A 10 -10.378 -4.862 11.743 1.00 0.00 O ATOM 127 OE2 GLU A 10 -12.214 -5.059 10.552 1.00 0.00 O ATOM 0 H GLU A 10 -8.241 -5.784 7.369 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.634 -4.077 7.273 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.105 -5.102 9.347 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.479 -3.473 9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -10.254 -2.655 10.276 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.330 -3.298 9.050 1.00 0.00 H new ATOM 134 N LYS A 11 -9.600 -2.036 6.308 1.00 0.00 N ATOM 135 CA LYS A 11 -9.025 -0.890 5.610 1.00 0.00 C ATOM 136 C LYS A 11 -8.446 -1.345 4.275 1.00 0.00 C ATOM 137 O LYS A 11 -9.024 -1.087 3.222 1.00 0.00 O ATOM 138 CB LYS A 11 -7.947 -0.220 6.462 1.00 0.00 C ATOM 139 CG LYS A 11 -8.413 0.133 7.864 1.00 0.00 C ATOM 140 CD LYS A 11 -7.364 -0.218 8.905 1.00 0.00 C ATOM 141 CE LYS A 11 -7.982 -0.387 10.284 1.00 0.00 C ATOM 142 NZ LYS A 11 -7.221 -1.359 11.117 1.00 0.00 N ATOM 0 H LYS A 11 -10.617 -2.013 6.388 1.00 0.00 H new ATOM 0 HA LYS A 11 -9.811 -0.157 5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.085 -0.884 6.531 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.611 0.688 5.960 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.637 1.198 7.917 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.339 -0.398 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.858 -1.139 8.617 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.606 0.565 8.938 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.013 0.578 10.789 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.013 -0.726 10.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.674 -1.446 12.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.213 -2.287 10.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.244 -1.023 11.237 1.00 0.00 H new ATOM 155 N TRP A 12 -7.310 -2.041 4.342 1.00 0.00 N ATOM 156 CA TRP A 12 -6.639 -2.573 3.152 1.00 0.00 C ATOM 157 C TRP A 12 -7.672 -3.003 2.106 1.00 0.00 C ATOM 158 O TRP A 12 -8.628 -3.709 2.429 1.00 0.00 O ATOM 159 CB TRP A 12 -5.748 -3.769 3.529 1.00 0.00 C ATOM 160 CG TRP A 12 -4.897 -3.566 4.759 1.00 0.00 C ATOM 161 CD1 TRP A 12 -4.785 -2.434 5.520 1.00 0.00 C ATOM 162 CD2 TRP A 12 -4.029 -4.533 5.364 1.00 0.00 C ATOM 163 NE1 TRP A 12 -3.915 -2.644 6.560 1.00 0.00 N ATOM 164 CE2 TRP A 12 -3.435 -3.923 6.486 1.00 0.00 C ATOM 165 CE3 TRP A 12 -3.700 -5.858 5.068 1.00 0.00 C ATOM 166 CZ2 TRP A 12 -2.532 -4.593 7.308 1.00 0.00 C ATOM 167 CZ3 TRP A 12 -2.803 -6.522 5.884 1.00 0.00 C ATOM 168 CH2 TRP A 12 -2.229 -5.889 6.993 1.00 0.00 C ATOM 0 H TRP A 12 -6.830 -2.252 5.217 1.00 0.00 H new ATOM 0 HA TRP A 12 -6.014 -1.787 2.729 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -6.383 -4.641 3.684 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -5.095 -3.996 2.687 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -5.307 -1.508 5.329 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -3.666 -1.958 7.273 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -4.139 -6.355 4.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -2.087 -4.107 8.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -2.541 -7.546 5.662 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -1.533 -6.435 7.612 1.00 0.00 H new ATOM 179 N ILE A 13 -7.492 -2.560 0.860 1.00 0.00 N ATOM 180 CA ILE A 13 -8.437 -2.895 -0.209 1.00 0.00 C ATOM 181 C ILE A 13 -7.736 -3.415 -1.465 1.00 0.00 C ATOM 182 O ILE A 13 -6.849 -2.763 -2.007 1.00 0.00 O ATOM 183 CB ILE A 13 -9.297 -1.675 -0.601 1.00 0.00 C ATOM 184 CG1 ILE A 13 -9.044 -0.504 0.363 1.00 0.00 C ATOM 185 CG2 ILE A 13 -10.766 -2.063 -0.626 1.00 0.00 C ATOM 186 CD1 ILE A 13 -10.294 0.257 0.768 1.00 0.00 C ATOM 0 H ILE A 13 -6.710 -1.975 0.567 1.00 0.00 H new ATOM 0 HA ILE A 13 -9.072 -3.685 0.193 1.00 0.00 H new ATOM 0 HB ILE A 13 -9.014 -1.346 -1.601 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.560 -0.887 1.261 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.346 0.191 -0.104 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -11.366 -1.197 -0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.920 -2.859 -1.354 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -11.067 -2.412 0.362 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -10.024 1.065 1.448 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -10.770 0.674 -0.120 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -10.987 -0.421 1.267 1.00 0.00 H new ATOM 198 N ASN A 14 -8.159 -4.588 -1.933 1.00 0.00 N ATOM 199 CA ASN A 14 -7.586 -5.194 -3.133 1.00 0.00 C ATOM 200 C ASN A 14 -8.534 -5.054 -4.322 1.00 0.00 C ATOM 201 O ASN A 14 -9.751 -4.981 -4.150 1.00 0.00 O ATOM 202 CB ASN A 14 -7.266 -6.670 -2.892 1.00 0.00 C ATOM 203 CG ASN A 14 -6.969 -7.418 -4.177 1.00 0.00 C ATOM 204 OD1 ASN A 14 -7.739 -8.280 -4.599 1.00 0.00 O ATOM 205 ND2 ASN A 14 -5.846 -7.091 -4.807 1.00 0.00 N ATOM 0 H ASN A 14 -8.899 -5.139 -1.498 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.661 -4.666 -3.363 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -6.408 -6.748 -2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.108 -7.143 -2.387 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.594 -7.561 -5.676 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.236 -6.370 -4.421 1.00 0.00 H new ATOM 212 N PHE A 15 -7.968 -5.012 -5.526 1.00 0.00 N ATOM 213 CA PHE A 15 -8.764 -4.876 -6.740 1.00 0.00 C ATOM 214 C PHE A 15 -8.402 -5.964 -7.752 1.00 0.00 C ATOM 215 O PHE A 15 -8.366 -7.146 -7.410 1.00 0.00 O ATOM 216 CB PHE A 15 -8.558 -3.487 -7.352 1.00 0.00 C ATOM 217 CG PHE A 15 -8.450 -2.390 -6.333 1.00 0.00 C ATOM 218 CD1 PHE A 15 -9.585 -1.757 -5.851 1.00 0.00 C ATOM 219 CD2 PHE A 15 -7.212 -1.992 -5.857 1.00 0.00 C ATOM 220 CE1 PHE A 15 -9.486 -0.747 -4.913 1.00 0.00 C ATOM 221 CE2 PHE A 15 -7.107 -0.982 -4.919 1.00 0.00 C ATOM 222 CZ PHE A 15 -8.246 -0.359 -4.446 1.00 0.00 C ATOM 0 H PHE A 15 -6.962 -5.070 -5.685 1.00 0.00 H new ATOM 0 HA PHE A 15 -9.816 -4.993 -6.478 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.653 -3.498 -7.959 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -9.389 -3.268 -8.022 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -10.558 -2.056 -6.213 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.319 -2.476 -6.223 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -10.378 -0.262 -4.545 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -6.136 -0.680 -4.556 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.166 0.430 -3.713 1.00 0.00 H new ATOM 232 N GLN A 16 -8.138 -5.561 -8.996 1.00 0.00 N ATOM 233 CA GLN A 16 -7.781 -6.507 -10.049 1.00 0.00 C ATOM 234 C GLN A 16 -6.670 -7.444 -9.586 1.00 0.00 C ATOM 235 O GLN A 16 -6.755 -8.659 -9.769 1.00 0.00 O ATOM 236 CB GLN A 16 -7.340 -5.759 -11.309 1.00 0.00 C ATOM 237 CG GLN A 16 -6.424 -4.579 -11.028 1.00 0.00 C ATOM 238 CD GLN A 16 -7.008 -3.263 -11.501 1.00 0.00 C ATOM 239 OE1 GLN A 16 -8.191 -2.987 -11.300 1.00 0.00 O ATOM 240 NE2 GLN A 16 -6.179 -2.441 -12.135 1.00 0.00 N ATOM 0 H GLN A 16 -8.165 -4.587 -9.297 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.663 -7.104 -10.279 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.828 -6.455 -11.974 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -8.224 -5.404 -11.838 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -6.229 -4.522 -9.957 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.464 -4.744 -11.518 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -5.206 -2.710 -12.280 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.516 -1.541 -12.477 1.00 0.00 H new ATOM 249 N ARG A 17 -5.631 -6.873 -8.983 1.00 0.00 N ATOM 250 CA ARG A 17 -4.509 -7.664 -8.491 1.00 0.00 C ATOM 251 C ARG A 17 -3.629 -6.848 -7.550 1.00 0.00 C ATOM 252 O ARG A 17 -2.640 -7.351 -7.018 1.00 0.00 O ATOM 253 CB ARG A 17 -3.676 -8.193 -9.660 1.00 0.00 C ATOM 254 CG ARG A 17 -3.391 -7.148 -10.726 1.00 0.00 C ATOM 255 CD ARG A 17 -2.020 -7.351 -11.353 1.00 0.00 C ATOM 256 NE ARG A 17 -1.782 -6.424 -12.456 1.00 0.00 N ATOM 257 CZ ARG A 17 -1.833 -6.773 -13.738 1.00 0.00 C ATOM 258 NH1 ARG A 17 -2.113 -8.024 -14.078 1.00 0.00 N ATOM 259 NH2 ARG A 17 -1.604 -5.870 -14.682 1.00 0.00 N ATOM 0 H ARG A 17 -5.543 -5.869 -8.824 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.915 -8.507 -7.933 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.730 -8.577 -9.277 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -4.199 -9.033 -10.117 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -4.157 -7.198 -11.500 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -3.447 -6.153 -10.285 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.250 -7.216 -10.593 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.935 -8.376 -11.715 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.564 -5.453 -12.230 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -2.290 -8.722 -13.355 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -2.151 -8.289 -15.062 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.388 -4.907 -14.425 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.643 -6.139 -15.665 1.00 0.00 H new ATOM 273 N LYS A 18 -4.001 -5.591 -7.339 1.00 0.00 N ATOM 274 CA LYS A 18 -3.261 -4.713 -6.458 1.00 0.00 C ATOM 275 C LYS A 18 -4.107 -4.365 -5.245 1.00 0.00 C ATOM 276 O LYS A 18 -5.331 -4.439 -5.292 1.00 0.00 O ATOM 277 CB LYS A 18 -2.858 -3.438 -7.196 1.00 0.00 C ATOM 278 CG LYS A 18 -3.989 -2.432 -7.313 1.00 0.00 C ATOM 279 CD LYS A 18 -3.888 -1.626 -8.598 1.00 0.00 C ATOM 280 CE LYS A 18 -4.003 -0.135 -8.328 1.00 0.00 C ATOM 281 NZ LYS A 18 -3.161 0.665 -9.260 1.00 0.00 N ATOM 0 H LYS A 18 -4.818 -5.160 -7.772 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.358 -5.226 -6.128 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.020 -2.974 -6.676 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.508 -3.699 -8.195 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.946 -2.954 -7.284 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.967 -1.758 -6.457 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -2.937 -1.836 -9.087 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.675 -1.935 -9.286 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.044 0.172 -8.425 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.704 0.072 -7.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.268 1.676 -9.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.164 0.390 -9.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.463 0.488 -10.239 1.00 0.00 H new ATOM 294 N CYS A 19 -3.451 -3.987 -4.166 1.00 0.00 N ATOM 295 CA CYS A 19 -4.150 -3.631 -2.945 1.00 0.00 C ATOM 296 C CYS A 19 -3.699 -2.272 -2.436 1.00 0.00 C ATOM 297 O CYS A 19 -2.647 -1.762 -2.823 1.00 0.00 O ATOM 298 CB CYS A 19 -3.931 -4.701 -1.871 1.00 0.00 C ATOM 299 SG CYS A 19 -4.927 -4.465 -0.360 1.00 0.00 S ATOM 0 H CYS A 19 -2.435 -3.918 -4.109 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.215 -3.574 -3.170 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.163 -5.678 -2.296 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -2.876 -4.714 -1.598 1.00 0.00 H new ATOM 304 N TYR A 20 -4.504 -1.706 -1.556 1.00 0.00 N ATOM 305 CA TYR A 20 -4.224 -0.418 -0.956 1.00 0.00 C ATOM 306 C TYR A 20 -4.237 -0.568 0.549 1.00 0.00 C ATOM 307 O TYR A 20 -4.877 -1.464 1.094 1.00 0.00 O ATOM 308 CB TYR A 20 -5.257 0.636 -1.385 1.00 0.00 C ATOM 309 CG TYR A 20 -4.956 1.305 -2.713 1.00 0.00 C ATOM 310 CD1 TYR A 20 -4.290 0.629 -3.730 1.00 0.00 C ATOM 311 CD2 TYR A 20 -5.343 2.619 -2.947 1.00 0.00 C ATOM 312 CE1 TYR A 20 -4.020 1.244 -4.937 1.00 0.00 C ATOM 313 CE2 TYR A 20 -5.077 3.239 -4.152 1.00 0.00 C ATOM 314 CZ TYR A 20 -4.415 2.549 -5.144 1.00 0.00 C ATOM 315 OH TYR A 20 -4.147 3.163 -6.346 1.00 0.00 O ATOM 0 H TYR A 20 -5.375 -2.131 -1.237 1.00 0.00 H new ATOM 0 HA TYR A 20 -3.245 -0.079 -1.294 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.237 0.163 -1.444 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.319 1.402 -0.612 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -3.979 -0.393 -3.573 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.861 3.165 -2.173 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.501 0.705 -5.716 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.387 4.261 -4.316 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.984 3.297 -6.839 1.00 0.00 H new ATOM 325 N TYR A 21 -3.514 0.303 1.203 1.00 0.00 N ATOM 326 CA TYR A 21 -3.408 0.287 2.646 1.00 0.00 C ATOM 327 C TYR A 21 -3.987 1.553 3.222 1.00 0.00 C ATOM 328 O TYR A 21 -3.476 2.627 2.971 1.00 0.00 O ATOM 329 CB TYR A 21 -1.943 0.182 3.073 1.00 0.00 C ATOM 330 CG TYR A 21 -1.401 -1.224 3.103 1.00 0.00 C ATOM 331 CD1 TYR A 21 -1.563 -2.018 4.226 1.00 0.00 C ATOM 332 CD2 TYR A 21 -0.718 -1.751 2.014 1.00 0.00 C ATOM 333 CE1 TYR A 21 -1.063 -3.300 4.270 1.00 0.00 C ATOM 334 CE2 TYR A 21 -0.213 -3.036 2.046 1.00 0.00 C ATOM 335 CZ TYR A 21 -0.387 -3.808 3.177 1.00 0.00 C ATOM 336 OH TYR A 21 0.114 -5.088 3.216 1.00 0.00 O ATOM 0 H TYR A 21 -2.980 1.046 0.753 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.960 -0.577 3.017 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.335 0.778 2.392 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.834 0.621 4.065 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.091 -1.625 5.082 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -0.580 -1.147 1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -1.198 -3.905 5.154 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.315 -3.434 1.192 1.00 0.00 H new ATOM 0 HH TYR A 21 0.560 -5.291 2.367 1.00 0.00 H new ATOM 346 N PHE A 22 -5.036 1.429 4.007 1.00 0.00 N ATOM 347 CA PHE A 22 -5.641 2.587 4.632 1.00 0.00 C ATOM 348 C PHE A 22 -5.684 2.351 6.134 1.00 0.00 C ATOM 349 O PHE A 22 -6.739 2.431 6.761 1.00 0.00 O ATOM 350 CB PHE A 22 -7.054 2.831 4.086 1.00 0.00 C ATOM 351 CG PHE A 22 -7.122 3.083 2.598 1.00 0.00 C ATOM 352 CD1 PHE A 22 -6.055 3.645 1.920 1.00 0.00 C ATOM 353 CD2 PHE A 22 -8.265 2.761 1.882 1.00 0.00 C ATOM 354 CE1 PHE A 22 -6.122 3.879 0.558 1.00 0.00 C ATOM 355 CE2 PHE A 22 -8.340 2.995 0.518 1.00 0.00 C ATOM 356 CZ PHE A 22 -7.264 3.555 -0.144 1.00 0.00 C ATOM 0 H PHE A 22 -5.487 0.541 4.227 1.00 0.00 H new ATOM 0 HA PHE A 22 -5.048 3.474 4.409 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.674 1.967 4.323 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -7.487 3.686 4.606 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.157 3.905 2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.108 2.322 2.394 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -5.279 4.316 0.044 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -9.237 2.740 -0.026 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.317 3.738 -1.207 1.00 0.00 H new ATOM 366 N GLY A 23 -4.521 2.028 6.696 1.00 0.00 N ATOM 367 CA GLY A 23 -4.433 1.745 8.111 1.00 0.00 C ATOM 368 C GLY A 23 -4.171 2.987 8.941 1.00 0.00 C ATOM 369 O GLY A 23 -4.104 4.093 8.403 1.00 0.00 O ATOM 0 H GLY A 23 -3.638 1.958 6.191 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -5.362 1.280 8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.635 1.022 8.284 1.00 0.00 H new ATOM 373 N LYS A 24 -4.027 2.810 10.250 1.00 0.00 N ATOM 374 CA LYS A 24 -3.775 3.932 11.148 1.00 0.00 C ATOM 375 C LYS A 24 -2.591 3.648 12.068 1.00 0.00 C ATOM 376 O LYS A 24 -2.371 2.509 12.479 1.00 0.00 O ATOM 377 CB LYS A 24 -5.021 4.236 11.981 1.00 0.00 C ATOM 378 CG LYS A 24 -5.601 3.015 12.676 1.00 0.00 C ATOM 379 CD LYS A 24 -5.948 3.313 14.125 1.00 0.00 C ATOM 380 CE LYS A 24 -7.442 3.529 14.307 1.00 0.00 C ATOM 381 NZ LYS A 24 -7.895 4.817 13.710 1.00 0.00 N ATOM 0 H LYS A 24 -4.080 1.902 10.712 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.532 4.801 10.537 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.772 4.987 12.731 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.783 4.672 11.334 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.495 2.684 12.147 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.884 2.195 12.633 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.619 2.487 14.756 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.408 4.201 14.454 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.987 2.704 13.847 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.684 3.517 15.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.919 4.926 13.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.394 5.606 14.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.688 4.819 12.691 1.00 0.00 H new ATOM 394 N GLY A 25 -1.832 4.694 12.385 1.00 0.00 N ATOM 395 CA GLY A 25 -0.679 4.542 13.254 1.00 0.00 C ATOM 396 C GLY A 25 0.600 5.050 12.615 1.00 0.00 C ATOM 397 O GLY A 25 1.401 4.265 12.106 1.00 0.00 O ATOM 0 H GLY A 25 -1.996 5.645 12.055 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.856 5.081 14.185 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.559 3.490 13.513 1.00 0.00 H new ATOM 401 N THR A 26 0.793 6.366 12.640 1.00 0.00 N ATOM 402 CA THR A 26 1.983 6.976 12.057 1.00 0.00 C ATOM 403 C THR A 26 2.260 8.341 12.681 1.00 0.00 C ATOM 404 O THR A 26 1.766 8.650 13.764 1.00 0.00 O ATOM 405 CB THR A 26 1.817 7.113 10.544 1.00 0.00 C ATOM 406 OG1 THR A 26 0.495 6.786 10.155 1.00 0.00 O ATOM 407 CG2 THR A 26 2.759 6.229 9.755 1.00 0.00 C ATOM 0 H THR A 26 0.141 7.030 13.058 1.00 0.00 H new ATOM 0 HA THR A 26 2.834 6.328 12.265 1.00 0.00 H new ATOM 0 HB THR A 26 2.050 8.154 10.321 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.228 7.349 9.399 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.588 6.376 8.689 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.790 6.489 9.996 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.579 5.185 10.011 1.00 0.00 H new ATOM 415 N LYS A 27 3.060 9.154 11.993 1.00 0.00 N ATOM 416 CA LYS A 27 3.406 10.484 12.485 1.00 0.00 C ATOM 417 C LYS A 27 3.219 11.542 11.400 1.00 0.00 C ATOM 418 O LYS A 27 2.288 12.346 11.457 1.00 0.00 O ATOM 419 CB LYS A 27 4.850 10.504 12.988 1.00 0.00 C ATOM 420 CG LYS A 27 5.001 11.078 14.387 1.00 0.00 C ATOM 421 CD LYS A 27 5.922 10.225 15.243 1.00 0.00 C ATOM 422 CE LYS A 27 7.285 10.877 15.414 1.00 0.00 C ATOM 423 NZ LYS A 27 7.541 11.266 16.828 1.00 0.00 N ATOM 0 H LYS A 27 3.480 8.914 11.095 1.00 0.00 H new ATOM 0 HA LYS A 27 2.734 10.720 13.310 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.243 9.487 12.977 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.458 11.088 12.297 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.396 12.092 14.325 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.022 11.146 14.861 1.00 0.00 H new ATOM 0 HD2 LYS A 27 5.468 10.066 16.221 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.042 9.244 14.784 1.00 0.00 H new ATOM 0 HE2 LYS A 27 8.061 10.188 15.081 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.348 11.760 14.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.480 11.707 16.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 6.815 11.943 17.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 7.507 10.420 17.432 1.00 0.00 H new ATOM 436 N GLN A 28 4.112 11.538 10.413 1.00 0.00 N ATOM 437 CA GLN A 28 4.050 12.497 9.317 1.00 0.00 C ATOM 438 C GLN A 28 4.081 11.779 7.972 1.00 0.00 C ATOM 439 O GLN A 28 3.816 10.579 7.895 1.00 0.00 O ATOM 440 CB GLN A 28 5.213 13.487 9.411 1.00 0.00 C ATOM 441 CG GLN A 28 5.241 14.270 10.713 1.00 0.00 C ATOM 442 CD GLN A 28 6.621 14.310 11.341 1.00 0.00 C ATOM 443 OE1 GLN A 28 7.611 14.607 10.671 1.00 0.00 O ATOM 444 NE2 GLN A 28 6.693 14.009 12.632 1.00 0.00 N ATOM 0 H GLN A 28 4.888 10.879 10.351 1.00 0.00 H new ATOM 0 HA GLN A 28 3.112 13.046 9.395 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.152 12.943 9.303 1.00 0.00 H new ATOM 0 HB3 GLN A 28 5.152 14.186 8.577 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.901 15.289 10.527 1.00 0.00 H new ATOM 0 HG3 GLN A 28 4.539 13.823 11.417 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.846 13.769 13.148 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.595 14.018 13.108 1.00 0.00 H new ATOM 453 N TRP A 29 4.403 12.518 6.915 1.00 0.00 N ATOM 454 CA TRP A 29 4.464 11.944 5.577 1.00 0.00 C ATOM 455 C TRP A 29 5.561 10.893 5.478 1.00 0.00 C ATOM 456 O TRP A 29 5.333 9.787 4.991 1.00 0.00 O ATOM 457 CB TRP A 29 4.701 13.031 4.534 1.00 0.00 C ATOM 458 CG TRP A 29 4.706 12.492 3.139 1.00 0.00 C ATOM 459 CD1 TRP A 29 3.627 12.334 2.321 1.00 0.00 C ATOM 460 CD2 TRP A 29 5.842 12.023 2.408 1.00 0.00 C ATOM 461 NE1 TRP A 29 4.022 11.791 1.123 1.00 0.00 N ATOM 462 CE2 TRP A 29 5.378 11.594 1.151 1.00 0.00 C ATOM 463 CE3 TRP A 29 7.208 11.925 2.693 1.00 0.00 C ATOM 464 CZ2 TRP A 29 6.229 11.074 0.180 1.00 0.00 C ATOM 465 CZ3 TRP A 29 8.053 11.408 1.728 1.00 0.00 C ATOM 466 CH2 TRP A 29 7.561 10.990 0.484 1.00 0.00 C ATOM 0 H TRP A 29 4.625 13.513 6.959 1.00 0.00 H new ATOM 0 HA TRP A 29 3.504 11.465 5.382 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.926 13.792 4.624 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.654 13.521 4.734 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.611 12.597 2.577 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.407 11.570 0.340 1.00 0.00 H new ATOM 0 HE3 TRP A 29 7.595 12.247 3.648 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 5.852 10.749 -0.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 9.109 11.325 1.936 1.00 0.00 H new ATOM 0 HH2 TRP A 29 8.247 10.593 -0.250 1.00 0.00 H new ATOM 477 N VAL A 30 6.751 11.251 5.941 1.00 0.00 N ATOM 478 CA VAL A 30 7.892 10.344 5.909 1.00 0.00 C ATOM 479 C VAL A 30 7.560 9.033 6.603 1.00 0.00 C ATOM 480 O VAL A 30 8.065 7.974 6.237 1.00 0.00 O ATOM 481 CB VAL A 30 9.126 10.973 6.579 1.00 0.00 C ATOM 482 CG1 VAL A 30 9.761 11.999 5.660 1.00 0.00 C ATOM 483 CG2 VAL A 30 8.744 11.604 7.907 1.00 0.00 C ATOM 0 H VAL A 30 6.952 12.166 6.345 1.00 0.00 H new ATOM 0 HA VAL A 30 8.120 10.151 4.861 1.00 0.00 H new ATOM 0 HB VAL A 30 9.856 10.187 6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.633 12.435 6.148 1.00 0.00 H new ATOM 0 HG12 VAL A 30 10.068 11.516 4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.039 12.785 5.438 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.628 12.044 8.368 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.997 12.380 7.740 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.332 10.841 8.567 1.00 0.00 H new ATOM 493 N HIS A 31 6.700 9.113 7.608 1.00 0.00 N ATOM 494 CA HIS A 31 6.289 7.932 8.351 1.00 0.00 C ATOM 495 C HIS A 31 5.386 7.051 7.496 1.00 0.00 C ATOM 496 O HIS A 31 5.341 5.834 7.677 1.00 0.00 O ATOM 497 CB HIS A 31 5.569 8.333 9.639 1.00 0.00 C ATOM 498 CG HIS A 31 6.211 7.791 10.878 1.00 0.00 C ATOM 499 ND1 HIS A 31 7.415 8.252 11.367 1.00 0.00 N ATOM 500 CD2 HIS A 31 5.809 6.817 11.731 1.00 0.00 C ATOM 501 CE1 HIS A 31 7.726 7.586 12.465 1.00 0.00 C ATOM 502 NE2 HIS A 31 6.768 6.712 12.708 1.00 0.00 N ATOM 0 H HIS A 31 6.274 9.983 7.927 1.00 0.00 H new ATOM 0 HA HIS A 31 7.182 7.365 8.613 1.00 0.00 H new ATOM 0 HB2 HIS A 31 5.536 9.421 9.703 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.537 7.985 9.592 1.00 0.00 H new ATOM 0 HD2 HIS A 31 4.904 6.233 11.656 1.00 0.00 H new ATOM 0 HE1 HIS A 31 8.614 7.732 13.062 1.00 0.00 H new ATOM 0 HE2 HIS A 31 6.744 6.063 13.495 1.00 0.00 H new ATOM 511 N ALA A 32 4.671 7.671 6.561 1.00 0.00 N ATOM 512 CA ALA A 32 3.777 6.932 5.681 1.00 0.00 C ATOM 513 C ALA A 32 4.568 6.092 4.688 1.00 0.00 C ATOM 514 O ALA A 32 4.310 4.899 4.533 1.00 0.00 O ATOM 515 CB ALA A 32 2.848 7.886 4.948 1.00 0.00 C ATOM 0 H ALA A 32 4.694 8.677 6.395 1.00 0.00 H new ATOM 0 HA ALA A 32 3.175 6.260 6.292 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.186 7.318 4.294 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.253 8.443 5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.438 8.582 4.351 1.00 0.00 H new ATOM 521 N ARG A 33 5.544 6.716 4.032 1.00 0.00 N ATOM 522 CA ARG A 33 6.380 6.014 3.069 1.00 0.00 C ATOM 523 C ARG A 33 7.123 4.871 3.745 1.00 0.00 C ATOM 524 O ARG A 33 7.247 3.781 3.185 1.00 0.00 O ATOM 525 CB ARG A 33 7.371 6.974 2.403 1.00 0.00 C ATOM 526 CG ARG A 33 8.371 7.591 3.366 1.00 0.00 C ATOM 527 CD ARG A 33 9.779 7.079 3.110 1.00 0.00 C ATOM 528 NE ARG A 33 10.676 8.141 2.664 1.00 0.00 N ATOM 529 CZ ARG A 33 11.815 8.451 3.277 1.00 0.00 C ATOM 530 NH1 ARG A 33 12.194 7.782 4.357 1.00 0.00 N ATOM 531 NH2 ARG A 33 12.576 9.430 2.809 1.00 0.00 N ATOM 0 H ARG A 33 5.773 7.703 4.151 1.00 0.00 H new ATOM 0 HA ARG A 33 5.733 5.601 2.295 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.914 6.438 1.625 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.814 7.772 1.912 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.353 8.676 3.265 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.080 7.362 4.391 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.173 6.631 4.022 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.747 6.292 2.357 1.00 0.00 H new ATOM 0 HE ARG A 33 10.414 8.675 1.836 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.612 7.027 4.720 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.068 8.022 4.825 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.288 9.947 1.978 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.449 9.667 3.280 1.00 0.00 H new ATOM 545 N TYR A 34 7.599 5.120 4.961 1.00 0.00 N ATOM 546 CA TYR A 34 8.310 4.097 5.718 1.00 0.00 C ATOM 547 C TYR A 34 7.385 2.918 5.976 1.00 0.00 C ATOM 548 O TYR A 34 7.809 1.762 5.950 1.00 0.00 O ATOM 549 CB TYR A 34 8.827 4.666 7.041 1.00 0.00 C ATOM 550 CG TYR A 34 10.304 4.436 7.262 1.00 0.00 C ATOM 551 CD1 TYR A 34 10.771 3.224 7.756 1.00 0.00 C ATOM 552 CD2 TYR A 34 11.233 5.429 6.979 1.00 0.00 C ATOM 553 CE1 TYR A 34 12.121 3.008 7.960 1.00 0.00 C ATOM 554 CE2 TYR A 34 12.584 5.222 7.180 1.00 0.00 C ATOM 555 CZ TYR A 34 13.023 4.010 7.671 1.00 0.00 C ATOM 556 OH TYR A 34 14.368 3.799 7.873 1.00 0.00 O ATOM 0 H TYR A 34 7.506 6.016 5.440 1.00 0.00 H new ATOM 0 HA TYR A 34 9.167 3.760 5.136 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.626 5.737 7.069 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.271 4.215 7.863 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.067 2.437 7.984 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.893 6.380 6.595 1.00 0.00 H new ATOM 0 HE1 TYR A 34 12.467 2.060 8.344 1.00 0.00 H new ATOM 0 HE2 TYR A 34 13.293 6.005 6.954 1.00 0.00 H new ATOM 0 HH TYR A 34 14.867 4.603 7.619 1.00 0.00 H new ATOM 566 N ALA A 35 6.111 3.222 6.200 1.00 0.00 N ATOM 567 CA ALA A 35 5.114 2.190 6.434 1.00 0.00 C ATOM 568 C ALA A 35 4.936 1.355 5.174 1.00 0.00 C ATOM 569 O ALA A 35 4.776 0.136 5.238 1.00 0.00 O ATOM 570 CB ALA A 35 3.791 2.811 6.858 1.00 0.00 C ATOM 0 H ALA A 35 5.747 4.175 6.224 1.00 0.00 H new ATOM 0 HA ALA A 35 5.456 1.543 7.242 1.00 0.00 H new ATOM 0 HB1 ALA A 35 3.057 2.023 7.029 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.934 3.379 7.777 1.00 0.00 H new ATOM 0 HB3 ALA A 35 3.433 3.476 6.072 1.00 0.00 H new ATOM 576 N CYS A 36 4.984 2.027 4.027 1.00 0.00 N ATOM 577 CA CYS A 36 4.852 1.365 2.743 1.00 0.00 C ATOM 578 C CYS A 36 5.925 0.303 2.592 1.00 0.00 C ATOM 579 O CYS A 36 5.643 -0.840 2.234 1.00 0.00 O ATOM 580 CB CYS A 36 4.977 2.378 1.608 1.00 0.00 C ATOM 581 SG CYS A 36 4.059 3.928 1.877 1.00 0.00 S ATOM 0 H CYS A 36 5.114 3.037 3.966 1.00 0.00 H new ATOM 0 HA CYS A 36 3.869 0.896 2.696 1.00 0.00 H new ATOM 0 HB2 CYS A 36 6.031 2.615 1.463 1.00 0.00 H new ATOM 0 HB3 CYS A 36 4.624 1.917 0.685 1.00 0.00 H new ATOM 586 N ASP A 37 7.161 0.698 2.872 1.00 0.00 N ATOM 587 CA ASP A 37 8.295 -0.208 2.776 1.00 0.00 C ATOM 588 C ASP A 37 8.071 -1.440 3.646 1.00 0.00 C ATOM 589 O ASP A 37 8.475 -2.547 3.289 1.00 0.00 O ATOM 590 CB ASP A 37 9.583 0.503 3.197 1.00 0.00 C ATOM 591 CG ASP A 37 10.378 1.010 2.010 1.00 0.00 C ATOM 592 OD1 ASP A 37 9.803 1.746 1.182 1.00 0.00 O ATOM 593 OD2 ASP A 37 11.575 0.671 1.910 1.00 0.00 O ATOM 0 H ASP A 37 7.402 1.644 3.168 1.00 0.00 H new ATOM 0 HA ASP A 37 8.392 -0.526 1.738 1.00 0.00 H new ATOM 0 HB2 ASP A 37 9.336 1.340 3.850 1.00 0.00 H new ATOM 0 HB3 ASP A 37 10.200 -0.183 3.778 1.00 0.00 H new ATOM 598 N ASP A 38 7.418 -1.238 4.786 1.00 0.00 N ATOM 599 CA ASP A 38 7.131 -2.332 5.708 1.00 0.00 C ATOM 600 C ASP A 38 6.104 -3.288 5.108 1.00 0.00 C ATOM 601 O ASP A 38 6.063 -4.468 5.453 1.00 0.00 O ATOM 602 CB ASP A 38 6.618 -1.783 7.041 1.00 0.00 C ATOM 603 CG ASP A 38 7.492 -2.194 8.210 1.00 0.00 C ATOM 604 OD1 ASP A 38 7.767 -3.404 8.350 1.00 0.00 O ATOM 605 OD2 ASP A 38 7.903 -1.304 8.985 1.00 0.00 O ATOM 0 H ASP A 38 7.078 -0.327 5.094 1.00 0.00 H new ATOM 0 HA ASP A 38 8.056 -2.881 5.883 1.00 0.00 H new ATOM 0 HB2 ASP A 38 6.573 -0.695 6.990 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.601 -2.137 7.209 1.00 0.00 H new ATOM 610 N MET A 39 5.280 -2.767 4.203 1.00 0.00 N ATOM 611 CA MET A 39 4.255 -3.568 3.544 1.00 0.00 C ATOM 612 C MET A 39 4.724 -3.998 2.160 1.00 0.00 C ATOM 613 O MET A 39 4.066 -4.789 1.485 1.00 0.00 O ATOM 614 CB MET A 39 2.951 -2.777 3.434 1.00 0.00 C ATOM 615 CG MET A 39 2.430 -2.273 4.771 1.00 0.00 C ATOM 616 SD MET A 39 2.040 -3.613 5.913 1.00 0.00 S ATOM 617 CE MET A 39 2.473 -2.858 7.479 1.00 0.00 C ATOM 0 H MET A 39 5.303 -1.791 3.909 1.00 0.00 H new ATOM 0 HA MET A 39 4.075 -4.460 4.145 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.107 -1.927 2.770 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.191 -3.407 2.972 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.176 -1.620 5.224 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.537 -1.671 4.605 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.472 -3.179 7.774 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.456 -1.773 7.377 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.755 -3.162 8.241 1.00 0.00 H new ATOM 627 N GLU A 40 5.872 -3.462 1.753 1.00 0.00 N ATOM 628 CA GLU A 40 6.465 -3.768 0.455 1.00 0.00 C ATOM 629 C GLU A 40 5.629 -3.193 -0.682 1.00 0.00 C ATOM 630 O GLU A 40 5.453 -3.828 -1.722 1.00 0.00 O ATOM 631 CB GLU A 40 6.621 -5.279 0.276 1.00 0.00 C ATOM 632 CG GLU A 40 7.825 -5.859 1.001 1.00 0.00 C ATOM 633 CD GLU A 40 8.628 -6.804 0.130 1.00 0.00 C ATOM 634 OE1 GLU A 40 8.074 -7.841 -0.290 1.00 0.00 O ATOM 635 OE2 GLU A 40 9.813 -6.506 -0.133 1.00 0.00 O ATOM 0 H GLU A 40 6.416 -2.805 2.313 1.00 0.00 H new ATOM 0 HA GLU A 40 7.451 -3.305 0.425 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.719 -5.774 0.635 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.706 -5.503 -0.787 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.468 -5.046 1.338 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.488 -6.389 1.892 1.00 0.00 H new ATOM 642 N GLY A 41 5.118 -1.985 -0.477 1.00 0.00 N ATOM 643 CA GLY A 41 4.305 -1.339 -1.490 1.00 0.00 C ATOM 644 C GLY A 41 4.874 -0.014 -1.952 1.00 0.00 C ATOM 645 O GLY A 41 6.028 0.064 -2.375 1.00 0.00 O ATOM 0 H GLY A 41 5.253 -1.440 0.375 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.207 -2.004 -2.348 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.302 -1.179 -1.095 1.00 0.00 H new ATOM 649 N GLN A 42 4.051 1.023 -1.891 1.00 0.00 N ATOM 650 CA GLN A 42 4.447 2.356 -2.324 1.00 0.00 C ATOM 651 C GLN A 42 3.537 3.374 -1.684 1.00 0.00 C ATOM 652 O GLN A 42 2.436 3.033 -1.266 1.00 0.00 O ATOM 653 CB GLN A 42 4.342 2.475 -3.845 1.00 0.00 C ATOM 654 CG GLN A 42 4.592 3.882 -4.367 1.00 0.00 C ATOM 655 CD GLN A 42 6.057 4.271 -4.323 1.00 0.00 C ATOM 656 OE1 GLN A 42 6.937 3.415 -4.246 1.00 0.00 O ATOM 657 NE2 GLN A 42 6.325 5.570 -4.372 1.00 0.00 N ATOM 0 H GLN A 42 3.094 0.965 -1.542 1.00 0.00 H new ATOM 0 HA GLN A 42 5.480 2.534 -2.025 1.00 0.00 H new ATOM 0 HB2 GLN A 42 5.059 1.794 -4.304 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.349 2.152 -4.158 1.00 0.00 H new ATOM 0 HG2 GLN A 42 4.232 3.954 -5.393 1.00 0.00 H new ATOM 0 HG3 GLN A 42 4.014 4.592 -3.776 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.564 6.246 -4.436 1.00 0.00 H new ATOM 0 HE22 GLN A 42 7.292 5.892 -4.346 1.00 0.00 H new ATOM 666 N LEU A 43 3.951 4.626 -1.615 1.00 0.00 N ATOM 667 CA LEU A 43 3.071 5.603 -1.035 1.00 0.00 C ATOM 668 C LEU A 43 2.007 5.915 -2.074 1.00 0.00 C ATOM 669 O LEU A 43 2.291 6.467 -3.137 1.00 0.00 O ATOM 670 CB LEU A 43 3.852 6.864 -0.642 1.00 0.00 C ATOM 671 CG LEU A 43 3.308 7.671 0.548 1.00 0.00 C ATOM 672 CD1 LEU A 43 2.545 6.795 1.522 1.00 0.00 C ATOM 673 CD2 LEU A 43 4.444 8.381 1.263 1.00 0.00 C ATOM 0 H LEU A 43 4.853 4.973 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 43 2.609 5.222 -0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.877 6.572 -0.415 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.893 7.523 -1.509 1.00 0.00 H new ATOM 0 HG LEU A 43 2.611 8.410 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.177 7.404 2.348 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.702 6.331 1.010 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.206 6.020 1.909 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.046 8.949 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.160 7.645 1.629 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.942 9.059 0.570 1.00 0.00 H new ATOM 685 N VAL A 44 0.790 5.507 -1.739 1.00 0.00 N ATOM 686 CA VAL A 44 -0.393 5.655 -2.585 1.00 0.00 C ATOM 687 C VAL A 44 -0.156 6.456 -3.855 1.00 0.00 C ATOM 688 O VAL A 44 -0.068 5.895 -4.947 1.00 0.00 O ATOM 689 CB VAL A 44 -1.541 6.299 -1.806 1.00 0.00 C ATOM 690 CG1 VAL A 44 -2.704 5.330 -1.692 1.00 0.00 C ATOM 691 CG2 VAL A 44 -1.062 6.742 -0.434 1.00 0.00 C ATOM 0 H VAL A 44 0.590 5.052 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.650 4.640 -2.888 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.886 7.182 -2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.515 5.799 -1.136 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.055 5.063 -2.689 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.378 4.431 -1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.889 7.199 0.110 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.696 5.878 0.120 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.257 7.468 -0.547 1.00 0.00 H new ATOM 701 N SER A 45 -0.096 7.767 -3.704 1.00 0.00 N ATOM 702 CA SER A 45 0.084 8.663 -4.840 1.00 0.00 C ATOM 703 C SER A 45 -1.152 8.601 -5.730 1.00 0.00 C ATOM 704 O SER A 45 -1.065 8.312 -6.924 1.00 0.00 O ATOM 705 CB SER A 45 1.333 8.283 -5.640 1.00 0.00 C ATOM 706 OG SER A 45 2.258 9.355 -5.682 1.00 0.00 O ATOM 0 H SER A 45 -0.169 8.240 -2.803 1.00 0.00 H new ATOM 0 HA SER A 45 0.217 9.680 -4.472 1.00 0.00 H new ATOM 0 HB2 SER A 45 1.805 7.409 -5.190 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.048 8.005 -6.655 1.00 0.00 H new ATOM 0 HG SER A 45 2.326 9.692 -6.600 1.00 0.00 H new ATOM 712 N ILE A 46 -2.309 8.856 -5.122 1.00 0.00 N ATOM 713 CA ILE A 46 -3.587 8.815 -5.828 1.00 0.00 C ATOM 714 C ILE A 46 -3.544 9.636 -7.110 1.00 0.00 C ATOM 715 O ILE A 46 -2.998 10.740 -7.138 1.00 0.00 O ATOM 716 CB ILE A 46 -4.759 9.317 -4.950 1.00 0.00 C ATOM 717 CG1 ILE A 46 -4.256 9.863 -3.604 1.00 0.00 C ATOM 718 CG2 ILE A 46 -5.774 8.204 -4.730 1.00 0.00 C ATOM 719 CD1 ILE A 46 -3.930 8.789 -2.585 1.00 0.00 C ATOM 0 H ILE A 46 -2.387 9.095 -4.133 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.759 7.767 -6.073 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.247 10.135 -5.479 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.365 10.466 -3.779 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -5.013 10.527 -3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.591 8.574 -4.111 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -6.168 7.875 -5.692 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -5.291 7.365 -4.230 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.582 9.255 -1.663 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.824 8.200 -2.379 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.149 8.138 -2.979 1.00 0.00 H new ATOM 731 N HIS A 47 -4.126 9.086 -8.172 1.00 0.00 N ATOM 732 CA HIS A 47 -4.159 9.758 -9.464 1.00 0.00 C ATOM 733 C HIS A 47 -5.575 9.788 -10.027 1.00 0.00 C ATOM 734 O HIS A 47 -5.820 10.370 -11.083 1.00 0.00 O ATOM 735 CB HIS A 47 -3.224 9.058 -10.450 1.00 0.00 C ATOM 736 CG HIS A 47 -3.399 7.572 -10.490 1.00 0.00 C ATOM 737 ND1 HIS A 47 -4.393 6.950 -11.215 1.00 0.00 N ATOM 738 CD2 HIS A 47 -2.699 6.580 -9.889 1.00 0.00 C ATOM 739 CE1 HIS A 47 -4.298 5.642 -11.058 1.00 0.00 C ATOM 740 NE2 HIS A 47 -3.277 5.392 -10.258 1.00 0.00 N ATOM 0 H HIS A 47 -4.582 8.174 -8.161 1.00 0.00 H new ATOM 0 HA HIS A 47 -3.823 10.785 -9.318 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.393 9.462 -11.448 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.192 9.287 -10.184 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.845 6.702 -9.240 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.945 4.903 -11.507 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.968 4.466 -9.963 1.00 0.00 H new ATOM 749 N SER A 48 -6.505 9.158 -9.317 1.00 0.00 N ATOM 750 CA SER A 48 -7.892 9.117 -9.747 1.00 0.00 C ATOM 751 C SER A 48 -8.791 9.768 -8.706 1.00 0.00 C ATOM 752 O SER A 48 -8.812 9.346 -7.551 1.00 0.00 O ATOM 753 CB SER A 48 -8.333 7.672 -9.988 1.00 0.00 C ATOM 754 OG SER A 48 -9.006 7.544 -11.228 1.00 0.00 O ATOM 0 H SER A 48 -6.320 8.669 -8.441 1.00 0.00 H new ATOM 0 HA SER A 48 -7.978 9.672 -10.681 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.463 7.016 -9.974 1.00 0.00 H new ATOM 0 HB3 SER A 48 -8.989 7.349 -9.180 1.00 0.00 H new ATOM 0 HG SER A 48 -9.276 6.611 -11.359 1.00 0.00 H new ATOM 760 N PRO A 49 -9.550 10.807 -9.100 1.00 0.00 N ATOM 761 CA PRO A 49 -10.454 11.502 -8.184 1.00 0.00 C ATOM 762 C PRO A 49 -11.284 10.520 -7.372 1.00 0.00 C ATOM 763 O PRO A 49 -11.679 10.806 -6.241 1.00 0.00 O ATOM 764 CB PRO A 49 -11.338 12.322 -9.124 1.00 0.00 C ATOM 765 CG PRO A 49 -10.471 12.591 -10.306 1.00 0.00 C ATOM 766 CD PRO A 49 -9.592 11.378 -10.461 1.00 0.00 C ATOM 0 HA PRO A 49 -9.928 12.110 -7.448 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -12.236 11.772 -9.406 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.667 13.248 -8.653 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.071 12.755 -11.201 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -9.873 13.490 -10.155 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -10.006 10.671 -11.180 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -8.596 11.646 -10.815 1.00 0.00 H new ATOM 774 N GLU A 50 -11.530 9.350 -7.954 1.00 0.00 N ATOM 775 CA GLU A 50 -12.294 8.309 -7.286 1.00 0.00 C ATOM 776 C GLU A 50 -11.471 7.665 -6.184 1.00 0.00 C ATOM 777 O GLU A 50 -11.959 7.460 -5.075 1.00 0.00 O ATOM 778 CB GLU A 50 -12.737 7.240 -8.282 1.00 0.00 C ATOM 779 CG GLU A 50 -13.422 6.056 -7.626 1.00 0.00 C ATOM 780 CD GLU A 50 -13.439 4.827 -8.513 1.00 0.00 C ATOM 781 OE1 GLU A 50 -14.242 4.795 -9.469 1.00 0.00 O ATOM 782 OE2 GLU A 50 -12.648 3.896 -8.252 1.00 0.00 O ATOM 0 H GLU A 50 -11.209 9.101 -8.890 1.00 0.00 H new ATOM 0 HA GLU A 50 -13.177 8.773 -6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -13.416 7.688 -9.007 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.867 6.887 -8.836 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -12.913 5.818 -6.692 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.446 6.329 -7.370 1.00 0.00 H new ATOM 789 N GLU A 51 -10.225 7.335 -6.504 1.00 0.00 N ATOM 790 CA GLU A 51 -9.340 6.704 -5.545 1.00 0.00 C ATOM 791 C GLU A 51 -9.084 7.630 -4.365 1.00 0.00 C ATOM 792 O GLU A 51 -9.176 7.217 -3.211 1.00 0.00 O ATOM 793 CB GLU A 51 -8.021 6.315 -6.214 1.00 0.00 C ATOM 794 CG GLU A 51 -8.169 5.228 -7.266 1.00 0.00 C ATOM 795 CD GLU A 51 -7.964 3.837 -6.701 1.00 0.00 C ATOM 796 OE1 GLU A 51 -8.787 3.408 -5.865 1.00 0.00 O ATOM 797 OE2 GLU A 51 -6.981 3.175 -7.094 1.00 0.00 O ATOM 0 H GLU A 51 -9.809 7.496 -7.421 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.822 5.799 -5.174 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -7.583 7.200 -6.677 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.322 5.976 -5.450 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.162 5.292 -7.712 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.449 5.401 -8.065 1.00 0.00 H new ATOM 804 N GLN A 52 -8.777 8.890 -4.661 1.00 0.00 N ATOM 805 CA GLN A 52 -8.524 9.874 -3.620 1.00 0.00 C ATOM 806 C GLN A 52 -9.751 10.021 -2.735 1.00 0.00 C ATOM 807 O GLN A 52 -9.645 10.087 -1.513 1.00 0.00 O ATOM 808 CB GLN A 52 -8.124 11.224 -4.234 1.00 0.00 C ATOM 809 CG GLN A 52 -9.298 12.062 -4.732 1.00 0.00 C ATOM 810 CD GLN A 52 -10.000 12.867 -3.643 1.00 0.00 C ATOM 811 OE1 GLN A 52 -11.056 13.451 -3.885 1.00 0.00 O ATOM 812 NE2 GLN A 52 -9.430 12.909 -2.441 1.00 0.00 N ATOM 0 H GLN A 52 -8.698 9.250 -5.612 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.693 9.529 -3.005 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.573 11.799 -3.490 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.443 11.044 -5.066 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.940 12.747 -5.501 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -10.025 11.403 -5.206 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.554 12.413 -2.274 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.869 13.437 -1.687 1.00 0.00 H new ATOM 821 N ASP A 53 -10.919 10.044 -3.368 1.00 0.00 N ATOM 822 CA ASP A 53 -12.180 10.154 -2.656 1.00 0.00 C ATOM 823 C ASP A 53 -12.435 8.880 -1.866 1.00 0.00 C ATOM 824 O ASP A 53 -13.008 8.907 -0.778 1.00 0.00 O ATOM 825 CB ASP A 53 -13.327 10.403 -3.636 1.00 0.00 C ATOM 826 CG ASP A 53 -14.605 10.824 -2.937 1.00 0.00 C ATOM 827 OD1 ASP A 53 -14.669 11.975 -2.459 1.00 0.00 O ATOM 828 OD2 ASP A 53 -15.543 10.001 -2.871 1.00 0.00 O ATOM 0 H ASP A 53 -11.015 9.987 -4.382 1.00 0.00 H new ATOM 0 HA ASP A 53 -12.124 10.998 -1.968 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.033 11.176 -4.346 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -13.513 9.496 -4.211 1.00 0.00 H new ATOM 833 N PHE A 54 -12.015 7.763 -2.446 1.00 0.00 N ATOM 834 CA PHE A 54 -12.194 6.457 -1.841 1.00 0.00 C ATOM 835 C PHE A 54 -11.501 6.373 -0.488 1.00 0.00 C ATOM 836 O PHE A 54 -12.111 5.995 0.512 1.00 0.00 O ATOM 837 CB PHE A 54 -11.609 5.402 -2.777 1.00 0.00 C ATOM 838 CG PHE A 54 -12.608 4.408 -3.277 1.00 0.00 C ATOM 839 CD1 PHE A 54 -12.945 3.305 -2.516 1.00 0.00 C ATOM 840 CD2 PHE A 54 -13.203 4.577 -4.513 1.00 0.00 C ATOM 841 CE1 PHE A 54 -13.862 2.383 -2.980 1.00 0.00 C ATOM 842 CE2 PHE A 54 -14.121 3.662 -4.987 1.00 0.00 C ATOM 843 CZ PHE A 54 -14.453 2.561 -4.218 1.00 0.00 C ATOM 0 H PHE A 54 -11.541 7.741 -3.349 1.00 0.00 H new ATOM 0 HA PHE A 54 -13.259 6.286 -1.684 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -11.152 5.902 -3.631 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.813 4.870 -2.256 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -12.487 3.163 -1.549 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.946 5.436 -5.115 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -14.118 1.524 -2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -14.579 3.805 -5.955 1.00 0.00 H new ATOM 0 HZ PHE A 54 -15.172 1.842 -4.583 1.00 0.00 H new ATOM 853 N LEU A 55 -10.229 6.742 -0.464 1.00 0.00 N ATOM 854 CA LEU A 55 -9.456 6.724 0.769 1.00 0.00 C ATOM 855 C LEU A 55 -9.864 7.876 1.671 1.00 0.00 C ATOM 856 O LEU A 55 -9.908 7.735 2.891 1.00 0.00 O ATOM 857 CB LEU A 55 -7.965 6.795 0.474 1.00 0.00 C ATOM 858 CG LEU A 55 -7.591 7.663 -0.716 1.00 0.00 C ATOM 859 CD1 LEU A 55 -6.954 8.951 -0.240 1.00 0.00 C ATOM 860 CD2 LEU A 55 -6.660 6.908 -1.646 1.00 0.00 C ATOM 0 H LEU A 55 -9.710 7.057 -1.284 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.663 5.785 1.283 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.452 7.174 1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.595 5.785 0.299 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.495 7.913 -1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.690 9.566 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.658 9.493 0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.055 8.722 0.332 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.400 7.542 -2.494 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.753 6.632 -1.108 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.157 6.007 -2.005 1.00 0.00 H new ATOM 872 N THR A 56 -10.162 9.019 1.059 1.00 0.00 N ATOM 873 CA THR A 56 -10.569 10.197 1.806 1.00 0.00 C ATOM 874 C THR A 56 -11.834 9.887 2.596 1.00 0.00 C ATOM 875 O THR A 56 -11.984 10.309 3.743 1.00 0.00 O ATOM 876 CB THR A 56 -10.799 11.380 0.856 1.00 0.00 C ATOM 877 OG1 THR A 56 -9.910 12.442 1.148 1.00 0.00 O ATOM 878 CG2 THR A 56 -12.204 11.939 0.903 1.00 0.00 C ATOM 0 H THR A 56 -10.128 9.151 0.048 1.00 0.00 H new ATOM 0 HA THR A 56 -9.776 10.472 2.502 1.00 0.00 H new ATOM 0 HB THR A 56 -10.624 10.974 -0.140 1.00 0.00 H new ATOM 0 HG1 THR A 56 -10.073 13.185 0.530 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.288 12.772 0.205 1.00 0.00 H new ATOM 0 HG22 THR A 56 -12.915 11.160 0.626 1.00 0.00 H new ATOM 0 HG23 THR A 56 -12.423 12.288 1.912 1.00 0.00 H new ATOM 886 N LYS A 57 -12.727 9.125 1.977 1.00 0.00 N ATOM 887 CA LYS A 57 -13.967 8.728 2.619 1.00 0.00 C ATOM 888 C LYS A 57 -13.682 7.650 3.653 1.00 0.00 C ATOM 889 O LYS A 57 -14.313 7.598 4.709 1.00 0.00 O ATOM 890 CB LYS A 57 -14.968 8.214 1.583 1.00 0.00 C ATOM 891 CG LYS A 57 -16.375 8.759 1.773 1.00 0.00 C ATOM 892 CD LYS A 57 -16.700 9.831 0.744 1.00 0.00 C ATOM 893 CE LYS A 57 -16.319 11.214 1.243 1.00 0.00 C ATOM 894 NZ LYS A 57 -17.479 11.928 1.845 1.00 0.00 N ATOM 0 H LYS A 57 -12.612 8.770 1.028 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.403 9.596 3.114 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.616 8.480 0.586 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.000 7.125 1.630 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -17.096 7.945 1.693 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -16.473 9.174 2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -16.169 9.619 -0.184 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -17.765 9.806 0.515 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -15.523 11.126 1.983 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -15.921 11.801 0.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -17.176 12.867 2.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -18.229 12.035 1.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -17.843 11.381 2.651 1.00 0.00 H new ATOM 907 N HIS A 58 -12.711 6.795 3.339 1.00 0.00 N ATOM 908 CA HIS A 58 -12.320 5.718 4.237 1.00 0.00 C ATOM 909 C HIS A 58 -11.583 6.276 5.450 1.00 0.00 C ATOM 910 O HIS A 58 -11.567 5.661 6.515 1.00 0.00 O ATOM 911 CB HIS A 58 -11.432 4.712 3.504 1.00 0.00 C ATOM 912 CG HIS A 58 -11.660 3.294 3.929 1.00 0.00 C ATOM 913 ND1 HIS A 58 -12.486 2.427 3.247 1.00 0.00 N ATOM 914 CD2 HIS A 58 -11.162 2.592 4.975 1.00 0.00 C ATOM 915 CE1 HIS A 58 -12.488 1.254 3.854 1.00 0.00 C ATOM 916 NE2 HIS A 58 -11.693 1.328 4.905 1.00 0.00 N ATOM 0 H HIS A 58 -12.182 6.830 2.468 1.00 0.00 H new ATOM 0 HA HIS A 58 -13.222 5.210 4.578 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -11.611 4.795 2.432 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -10.387 4.970 3.674 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -13.014 2.656 2.405 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -10.476 2.958 5.724 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -13.045 0.383 3.543 1.00 0.00 H new ATOM 925 N ALA A 59 -10.975 7.450 5.280 1.00 0.00 N ATOM 926 CA ALA A 59 -10.238 8.091 6.361 1.00 0.00 C ATOM 927 C ALA A 59 -11.152 8.389 7.545 1.00 0.00 C ATOM 928 O ALA A 59 -12.245 8.931 7.379 1.00 0.00 O ATOM 929 CB ALA A 59 -9.580 9.369 5.866 1.00 0.00 C ATOM 0 H ALA A 59 -10.980 7.973 4.404 1.00 0.00 H new ATOM 0 HA ALA A 59 -9.462 7.403 6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -9.033 9.837 6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -8.890 9.133 5.056 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -10.345 10.055 5.502 1.00 0.00 H new ATOM 935 N SER A 60 -10.696 8.031 8.742 1.00 0.00 N ATOM 936 CA SER A 60 -11.471 8.259 9.957 1.00 0.00 C ATOM 937 C SER A 60 -11.503 9.744 10.310 1.00 0.00 C ATOM 938 O SER A 60 -11.468 10.601 9.424 1.00 0.00 O ATOM 939 CB SER A 60 -10.881 7.453 11.117 1.00 0.00 C ATOM 940 OG SER A 60 -11.869 6.641 11.728 1.00 0.00 O ATOM 0 H SER A 60 -9.793 7.582 8.896 1.00 0.00 H new ATOM 0 HA SER A 60 -12.494 7.928 9.779 1.00 0.00 H new ATOM 0 HB2 SER A 60 -10.066 6.827 10.752 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.455 8.132 11.856 1.00 0.00 H new ATOM 0 HG SER A 60 -11.467 6.135 12.465 1.00 0.00 H new ATOM 946 N HIS A 61 -11.570 10.047 11.604 1.00 0.00 N ATOM 947 CA HIS A 61 -11.607 11.430 12.068 1.00 0.00 C ATOM 948 C HIS A 61 -10.413 12.215 11.531 1.00 0.00 C ATOM 949 O HIS A 61 -10.474 13.435 11.387 1.00 0.00 O ATOM 950 CB HIS A 61 -11.618 11.478 13.597 1.00 0.00 C ATOM 951 CG HIS A 61 -10.575 10.610 14.232 1.00 0.00 C ATOM 952 ND1 HIS A 61 -9.221 10.812 14.060 1.00 0.00 N ATOM 953 CD2 HIS A 61 -10.693 9.533 15.042 1.00 0.00 C ATOM 954 CE1 HIS A 61 -8.553 9.895 14.736 1.00 0.00 C ATOM 955 NE2 HIS A 61 -9.423 9.108 15.342 1.00 0.00 N ATOM 0 H HIS A 61 -11.600 9.352 12.350 1.00 0.00 H new ATOM 0 HA HIS A 61 -12.521 11.889 11.691 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -11.468 12.508 13.921 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -12.601 11.171 13.955 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -11.615 9.090 15.388 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -7.478 9.804 14.785 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -9.189 8.313 15.937 1.00 0.00 H new ATOM 964 N THR A 62 -9.330 11.502 11.235 1.00 0.00 N ATOM 965 CA THR A 62 -8.122 12.130 10.711 1.00 0.00 C ATOM 966 C THR A 62 -8.093 12.059 9.187 1.00 0.00 C ATOM 967 O THR A 62 -9.117 11.815 8.549 1.00 0.00 O ATOM 968 CB THR A 62 -6.879 11.451 11.290 1.00 0.00 C ATOM 969 OG1 THR A 62 -7.099 10.062 11.461 1.00 0.00 O ATOM 970 CG2 THR A 62 -6.457 12.018 12.630 1.00 0.00 C ATOM 0 H THR A 62 -9.265 10.491 11.349 1.00 0.00 H new ATOM 0 HA THR A 62 -8.126 13.179 11.008 1.00 0.00 H new ATOM 0 HB THR A 62 -6.085 11.638 10.567 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.292 9.646 11.831 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.570 11.493 12.984 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.231 13.079 12.521 1.00 0.00 H new ATOM 0 HG23 THR A 62 -7.266 11.891 13.350 1.00 0.00 H new ATOM 978 N GLY A 63 -6.914 12.271 8.610 1.00 0.00 N ATOM 979 CA GLY A 63 -6.777 12.226 7.165 1.00 0.00 C ATOM 980 C GLY A 63 -5.928 11.060 6.700 1.00 0.00 C ATOM 981 O GLY A 63 -5.687 10.118 7.455 1.00 0.00 O ATOM 0 H GLY A 63 -6.052 12.473 9.116 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.766 12.155 6.711 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.332 13.158 6.816 1.00 0.00 H new ATOM 985 N SER A 64 -5.472 11.122 5.452 1.00 0.00 N ATOM 986 CA SER A 64 -4.644 10.064 4.887 1.00 0.00 C ATOM 987 C SER A 64 -3.382 10.638 4.249 1.00 0.00 C ATOM 988 O SER A 64 -3.322 11.824 3.923 1.00 0.00 O ATOM 989 CB SER A 64 -5.437 9.263 3.852 1.00 0.00 C ATOM 990 OG SER A 64 -5.161 9.712 2.537 1.00 0.00 O ATOM 0 H SER A 64 -5.663 11.894 4.814 1.00 0.00 H new ATOM 0 HA SER A 64 -4.346 9.400 5.698 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.188 8.205 3.938 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.504 9.357 4.055 1.00 0.00 H new ATOM 0 HG SER A 64 -4.346 9.279 2.208 1.00 0.00 H new ATOM 996 N TRP A 65 -2.378 9.786 4.069 1.00 0.00 N ATOM 997 CA TRP A 65 -1.115 10.199 3.467 1.00 0.00 C ATOM 998 C TRP A 65 -1.012 9.667 2.048 1.00 0.00 C ATOM 999 O TRP A 65 -1.319 8.507 1.788 1.00 0.00 O ATOM 1000 CB TRP A 65 0.059 9.692 4.305 1.00 0.00 C ATOM 1001 CG TRP A 65 0.452 10.625 5.410 1.00 0.00 C ATOM 1002 CD1 TRP A 65 1.029 11.855 5.281 1.00 0.00 C ATOM 1003 CD2 TRP A 65 0.297 10.403 6.816 1.00 0.00 C ATOM 1004 NE1 TRP A 65 1.244 12.408 6.520 1.00 0.00 N ATOM 1005 CE2 TRP A 65 0.800 11.537 7.477 1.00 0.00 C ATOM 1006 CE3 TRP A 65 -0.220 9.354 7.580 1.00 0.00 C ATOM 1007 CZ2 TRP A 65 0.801 11.652 8.865 1.00 0.00 C ATOM 1008 CZ3 TRP A 65 -0.219 9.469 8.957 1.00 0.00 C ATOM 1009 CH2 TRP A 65 0.288 10.610 9.587 1.00 0.00 C ATOM 0 H TRP A 65 -2.415 8.801 4.333 1.00 0.00 H new ATOM 0 HA TRP A 65 -1.081 11.288 3.437 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -0.202 8.724 4.733 1.00 0.00 H new ATOM 0 HB3 TRP A 65 0.918 9.531 3.653 1.00 0.00 H new ATOM 0 HD1 TRP A 65 1.280 12.325 4.342 1.00 0.00 H new ATOM 0 HE1 TRP A 65 1.666 13.320 6.698 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -0.614 8.469 7.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 1.193 12.532 9.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -0.617 8.664 9.557 1.00 0.00 H new ATOM 0 HH2 TRP A 65 0.274 10.669 10.665 1.00 0.00 H new ATOM 1020 N ILE A 66 -0.589 10.524 1.133 1.00 0.00 N ATOM 1021 CA ILE A 66 -0.459 10.141 -0.265 1.00 0.00 C ATOM 1022 C ILE A 66 0.988 10.193 -0.725 1.00 0.00 C ATOM 1023 O ILE A 66 1.850 10.729 -0.034 1.00 0.00 O ATOM 1024 CB ILE A 66 -1.308 11.035 -1.182 1.00 0.00 C ATOM 1025 CG1 ILE A 66 -0.587 12.358 -1.441 1.00 0.00 C ATOM 1026 CG2 ILE A 66 -2.679 11.268 -0.563 1.00 0.00 C ATOM 1027 CD1 ILE A 66 -1.470 13.428 -2.037 1.00 0.00 C ATOM 0 H ILE A 66 -0.330 11.490 1.332 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.821 9.115 -0.336 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.450 10.534 -2.139 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.172 12.724 -0.502 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.253 12.178 -2.112 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.272 11.903 -1.221 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.185 10.312 -0.428 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.563 11.756 0.404 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.887 14.336 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.865 13.083 -2.993 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.296 13.638 -1.358 1.00 0.00 H new ATOM 1039 N GLY A 67 1.239 9.622 -1.895 1.00 0.00 N ATOM 1040 CA GLY A 67 2.579 9.601 -2.447 1.00 0.00 C ATOM 1041 C GLY A 67 3.022 10.948 -2.994 1.00 0.00 C ATOM 1042 O GLY A 67 3.453 11.042 -4.142 1.00 0.00 O ATOM 0 H GLY A 67 0.533 9.170 -2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.278 9.282 -1.674 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.625 8.859 -3.244 1.00 0.00 H new ATOM 1046 N LEU A 68 2.923 11.994 -2.176 1.00 0.00 N ATOM 1047 CA LEU A 68 3.326 13.326 -2.602 1.00 0.00 C ATOM 1048 C LEU A 68 4.345 13.944 -1.648 1.00 0.00 C ATOM 1049 O LEU A 68 4.111 14.050 -0.444 1.00 0.00 O ATOM 1050 CB LEU A 68 2.105 14.247 -2.708 1.00 0.00 C ATOM 1051 CG LEU A 68 2.322 15.534 -3.511 1.00 0.00 C ATOM 1052 CD1 LEU A 68 3.220 16.503 -2.757 1.00 0.00 C ATOM 1053 CD2 LEU A 68 2.912 15.213 -4.870 1.00 0.00 C ATOM 0 H LEU A 68 2.569 11.943 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 68 3.794 13.222 -3.581 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.288 13.688 -3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.785 14.516 -1.701 1.00 0.00 H new ATOM 0 HG LEU A 68 1.353 16.013 -3.653 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.357 17.408 -3.349 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.758 16.760 -1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.189 16.037 -2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.061 16.137 -5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.870 14.709 -4.741 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.230 14.563 -5.418 1.00 0.00 H new ATOM 1065 N ARG A 69 5.460 14.385 -2.218 1.00 0.00 N ATOM 1066 CA ARG A 69 6.522 15.039 -1.466 1.00 0.00 C ATOM 1067 C ARG A 69 7.063 16.218 -2.273 1.00 0.00 C ATOM 1068 O ARG A 69 7.526 16.038 -3.398 1.00 0.00 O ATOM 1069 CB ARG A 69 7.645 14.048 -1.149 1.00 0.00 C ATOM 1070 CG ARG A 69 8.918 14.706 -0.640 1.00 0.00 C ATOM 1071 CD ARG A 69 10.037 14.622 -1.666 1.00 0.00 C ATOM 1072 NE ARG A 69 11.354 14.587 -1.036 1.00 0.00 N ATOM 1073 CZ ARG A 69 12.286 13.682 -1.322 1.00 0.00 C ATOM 1074 NH1 ARG A 69 12.044 12.739 -2.222 1.00 0.00 N ATOM 1075 NH2 ARG A 69 13.459 13.719 -0.706 1.00 0.00 N ATOM 0 H ARG A 69 5.653 14.299 -3.216 1.00 0.00 H new ATOM 0 HA ARG A 69 6.118 15.405 -0.522 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.290 13.338 -0.402 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.877 13.476 -2.048 1.00 0.00 H new ATOM 0 HG2 ARG A 69 8.719 15.751 -0.402 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.234 14.223 0.285 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.903 13.729 -2.276 1.00 0.00 H new ATOM 0 HD3 ARG A 69 9.979 15.479 -2.337 1.00 0.00 H new ATOM 0 HE ARG A 69 11.572 15.297 -0.337 1.00 0.00 H new ATOM 0 HH11 ARG A 69 11.142 12.707 -2.697 1.00 0.00 H new ATOM 0 HH12 ARG A 69 12.760 12.046 -2.440 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.648 14.442 -0.012 1.00 0.00 H new ATOM 0 HH22 ARG A 69 14.173 13.024 -0.926 1.00 0.00 H new ATOM 1089 N ASN A 70 7.005 17.418 -1.710 1.00 0.00 N ATOM 1090 CA ASN A 70 7.492 18.598 -2.417 1.00 0.00 C ATOM 1091 C ASN A 70 8.994 18.764 -2.230 1.00 0.00 C ATOM 1092 O ASN A 70 9.600 18.133 -1.363 1.00 0.00 O ATOM 1093 CB ASN A 70 6.742 19.852 -1.955 1.00 0.00 C ATOM 1094 CG ASN A 70 7.636 20.848 -1.242 1.00 0.00 C ATOM 1095 OD1 ASN A 70 8.297 20.516 -0.258 1.00 0.00 O ATOM 1096 ND2 ASN A 70 7.656 22.078 -1.738 1.00 0.00 N ATOM 0 H ASN A 70 6.631 17.600 -0.779 1.00 0.00 H new ATOM 0 HA ASN A 70 7.301 18.459 -3.481 1.00 0.00 H new ATOM 0 HB2 ASN A 70 6.286 20.335 -2.819 1.00 0.00 H new ATOM 0 HB3 ASN A 70 5.931 19.559 -1.289 1.00 0.00 H new ATOM 0 HD21 ASN A 70 8.236 22.794 -1.302 1.00 0.00 H new ATOM 0 HD22 ASN A 70 7.091 22.307 -2.556 1.00 0.00 H new ATOM 1103 N LEU A 71 9.589 19.610 -3.063 1.00 0.00 N ATOM 1104 CA LEU A 71 11.027 19.861 -3.011 1.00 0.00 C ATOM 1105 C LEU A 71 11.392 20.802 -1.863 1.00 0.00 C ATOM 1106 O LEU A 71 12.019 21.841 -2.075 1.00 0.00 O ATOM 1107 CB LEU A 71 11.507 20.450 -4.340 1.00 0.00 C ATOM 1108 CG LEU A 71 11.488 19.478 -5.521 1.00 0.00 C ATOM 1109 CD1 LEU A 71 11.320 20.233 -6.831 1.00 0.00 C ATOM 1110 CD2 LEU A 71 12.760 18.644 -5.544 1.00 0.00 C ATOM 0 H LEU A 71 9.097 20.136 -3.785 1.00 0.00 H new ATOM 0 HA LEU A 71 11.524 18.907 -2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.883 21.309 -4.586 1.00 0.00 H new ATOM 0 HB3 LEU A 71 12.524 20.821 -4.210 1.00 0.00 H new ATOM 0 HG LEU A 71 10.638 18.806 -5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.309 19.525 -7.660 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.381 20.787 -6.814 1.00 0.00 H new ATOM 0 HD13 LEU A 71 12.149 20.929 -6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 71 12.730 17.958 -6.390 1.00 0.00 H new ATOM 0 HD22 LEU A 71 13.624 19.301 -5.640 1.00 0.00 H new ATOM 0 HD23 LEU A 71 12.838 18.075 -4.618 1.00 0.00 H new ATOM 1122 N ASP A 72 11.006 20.426 -0.647 1.00 0.00 N ATOM 1123 CA ASP A 72 11.299 21.227 0.538 1.00 0.00 C ATOM 1124 C ASP A 72 10.723 22.636 0.416 1.00 0.00 C ATOM 1125 O ASP A 72 11.438 23.581 0.078 1.00 0.00 O ATOM 1126 CB ASP A 72 12.811 21.299 0.771 1.00 0.00 C ATOM 1127 CG ASP A 72 13.275 20.351 1.858 1.00 0.00 C ATOM 1128 OD1 ASP A 72 13.037 20.649 3.048 1.00 0.00 O ATOM 1129 OD2 ASP A 72 13.874 19.309 1.520 1.00 0.00 O ATOM 0 H ASP A 72 10.488 19.569 -0.456 1.00 0.00 H new ATOM 0 HA ASP A 72 10.826 20.741 1.392 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.330 21.064 -0.158 1.00 0.00 H new ATOM 0 HB3 ASP A 72 13.086 22.319 1.041 1.00 0.00 H new ATOM 1134 N LEU A 73 9.427 22.761 0.703 1.00 0.00 N ATOM 1135 CA LEU A 73 8.724 24.045 0.645 1.00 0.00 C ATOM 1136 C LEU A 73 9.198 24.905 -0.533 1.00 0.00 C ATOM 1137 O LEU A 73 9.296 26.127 -0.417 1.00 0.00 O ATOM 1138 CB LEU A 73 8.909 24.810 1.960 1.00 0.00 C ATOM 1139 CG LEU A 73 10.331 25.305 2.237 1.00 0.00 C ATOM 1140 CD1 LEU A 73 10.312 26.758 2.685 1.00 0.00 C ATOM 1141 CD2 LEU A 73 11.005 24.431 3.284 1.00 0.00 C ATOM 0 H LEU A 73 8.835 21.978 0.982 1.00 0.00 H new ATOM 0 HA LEU A 73 7.666 23.832 0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.237 25.668 1.959 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.600 24.165 2.783 1.00 0.00 H new ATOM 0 HG LEU A 73 10.905 25.239 1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.331 27.093 2.877 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.869 27.374 1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.722 26.850 3.597 1.00 0.00 H new ATOM 0 HD21 LEU A 73 12.015 24.797 3.468 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.432 24.465 4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.052 23.403 2.924 1.00 0.00 H new ATOM 1153 N LYS A 74 9.493 24.265 -1.663 1.00 0.00 N ATOM 1154 CA LYS A 74 9.960 24.983 -2.847 1.00 0.00 C ATOM 1155 C LYS A 74 8.798 25.389 -3.750 1.00 0.00 C ATOM 1156 O LYS A 74 8.939 26.277 -4.591 1.00 0.00 O ATOM 1157 CB LYS A 74 10.949 24.123 -3.635 1.00 0.00 C ATOM 1158 CG LYS A 74 12.387 24.610 -3.542 1.00 0.00 C ATOM 1159 CD LYS A 74 13.334 23.696 -4.303 1.00 0.00 C ATOM 1160 CE LYS A 74 13.242 23.922 -5.802 1.00 0.00 C ATOM 1161 NZ LYS A 74 14.587 24.048 -6.429 1.00 0.00 N ATOM 0 H LYS A 74 9.417 23.255 -1.783 1.00 0.00 H new ATOM 0 HA LYS A 74 10.460 25.890 -2.506 1.00 0.00 H new ATOM 0 HB2 LYS A 74 10.897 23.097 -3.270 1.00 0.00 H new ATOM 0 HB3 LYS A 74 10.647 24.104 -4.682 1.00 0.00 H new ATOM 0 HG2 LYS A 74 12.456 25.622 -3.942 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.689 24.659 -2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.357 23.872 -3.970 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.099 22.656 -4.076 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.704 23.093 -6.262 1.00 0.00 H new ATOM 0 HE3 LYS A 74 12.664 24.825 -5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.480 24.201 -7.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.092 24.855 -6.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 15.130 23.176 -6.264 1.00 0.00 H new ATOM 1174 N GLY A 75 7.651 24.741 -3.572 1.00 0.00 N ATOM 1175 CA GLY A 75 6.489 25.063 -4.382 1.00 0.00 C ATOM 1176 C GLY A 75 6.170 23.994 -5.411 1.00 0.00 C ATOM 1177 O GLY A 75 5.068 23.965 -5.959 1.00 0.00 O ATOM 0 H GLY A 75 7.505 24.002 -2.885 1.00 0.00 H new ATOM 0 HA2 GLY A 75 5.626 25.202 -3.731 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.660 26.011 -4.892 1.00 0.00 H new ATOM 1181 N GLU A 76 7.130 23.112 -5.676 1.00 0.00 N ATOM 1182 CA GLU A 76 6.932 22.039 -6.645 1.00 0.00 C ATOM 1183 C GLU A 76 6.693 20.714 -5.931 1.00 0.00 C ATOM 1184 O GLU A 76 7.495 20.295 -5.097 1.00 0.00 O ATOM 1185 CB GLU A 76 8.143 21.921 -7.572 1.00 0.00 C ATOM 1186 CG GLU A 76 8.945 23.205 -7.698 1.00 0.00 C ATOM 1187 CD GLU A 76 9.424 23.456 -9.114 1.00 0.00 C ATOM 1188 OE1 GLU A 76 9.961 22.515 -9.736 1.00 0.00 O ATOM 1189 OE2 GLU A 76 9.263 24.596 -9.602 1.00 0.00 O ATOM 0 H GLU A 76 8.050 23.119 -5.235 1.00 0.00 H new ATOM 0 HA GLU A 76 6.054 22.280 -7.245 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.796 21.130 -7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.803 21.617 -8.562 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.332 24.045 -7.371 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.805 23.159 -7.030 1.00 0.00 H new ATOM 1196 N PHE A 77 5.577 20.063 -6.251 1.00 0.00 N ATOM 1197 CA PHE A 77 5.233 18.798 -5.625 1.00 0.00 C ATOM 1198 C PHE A 77 5.615 17.629 -6.524 1.00 0.00 C ATOM 1199 O PHE A 77 5.224 17.571 -7.691 1.00 0.00 O ATOM 1200 CB PHE A 77 3.732 18.726 -5.300 1.00 0.00 C ATOM 1201 CG PHE A 77 3.090 20.027 -4.874 1.00 0.00 C ATOM 1202 CD1 PHE A 77 3.849 21.143 -4.555 1.00 0.00 C ATOM 1203 CD2 PHE A 77 1.707 20.127 -4.807 1.00 0.00 C ATOM 1204 CE1 PHE A 77 3.249 22.330 -4.185 1.00 0.00 C ATOM 1205 CE2 PHE A 77 1.103 21.313 -4.434 1.00 0.00 C ATOM 1206 CZ PHE A 77 1.874 22.416 -4.126 1.00 0.00 C ATOM 0 H PHE A 77 4.900 20.393 -6.939 1.00 0.00 H new ATOM 0 HA PHE A 77 5.795 18.733 -4.693 1.00 0.00 H new ATOM 0 HB2 PHE A 77 3.206 18.353 -6.179 1.00 0.00 H new ATOM 0 HB3 PHE A 77 3.586 17.993 -4.507 1.00 0.00 H new ATOM 0 HD1 PHE A 77 4.926 21.083 -4.597 1.00 0.00 H new ATOM 0 HD2 PHE A 77 1.097 19.269 -5.049 1.00 0.00 H new ATOM 0 HE1 PHE A 77 3.856 23.190 -3.942 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.026 21.377 -4.383 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.401 23.344 -3.840 1.00 0.00 H new ATOM 1216 N ILE A 78 6.379 16.701 -5.969 1.00 0.00 N ATOM 1217 CA ILE A 78 6.822 15.524 -6.698 1.00 0.00 C ATOM 1218 C ILE A 78 6.369 14.257 -5.983 1.00 0.00 C ATOM 1219 O ILE A 78 6.387 14.190 -4.758 1.00 0.00 O ATOM 1220 CB ILE A 78 8.356 15.525 -6.860 1.00 0.00 C ATOM 1221 CG1 ILE A 78 8.722 15.889 -8.308 1.00 0.00 C ATOM 1222 CG2 ILE A 78 8.956 14.183 -6.443 1.00 0.00 C ATOM 1223 CD1 ILE A 78 9.651 14.908 -8.996 1.00 0.00 C ATOM 0 H ILE A 78 6.708 16.742 -5.004 1.00 0.00 H new ATOM 0 HA ILE A 78 6.372 15.548 -7.691 1.00 0.00 H new ATOM 0 HB ILE A 78 8.783 16.279 -6.198 1.00 0.00 H new ATOM 0 HG12 ILE A 78 7.804 15.968 -8.891 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.189 16.874 -8.313 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.038 14.214 -6.568 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.717 13.987 -5.398 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.541 13.390 -7.065 1.00 0.00 H new ATOM 0 HD11 ILE A 78 9.852 15.248 -10.012 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.588 14.845 -8.442 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.182 13.925 -9.029 1.00 0.00 H new ATOM 1235 N TRP A 79 5.959 13.256 -6.748 1.00 0.00 N ATOM 1236 CA TRP A 79 5.497 12.005 -6.165 1.00 0.00 C ATOM 1237 C TRP A 79 6.670 11.187 -5.641 1.00 0.00 C ATOM 1238 O TRP A 79 7.773 11.247 -6.181 1.00 0.00 O ATOM 1239 CB TRP A 79 4.720 11.179 -7.196 1.00 0.00 C ATOM 1240 CG TRP A 79 3.379 11.750 -7.554 1.00 0.00 C ATOM 1241 CD1 TRP A 79 2.929 13.017 -7.311 1.00 0.00 C ATOM 1242 CD2 TRP A 79 2.314 11.072 -8.232 1.00 0.00 C ATOM 1243 NE1 TRP A 79 1.651 13.165 -7.790 1.00 0.00 N ATOM 1244 CE2 TRP A 79 1.251 11.985 -8.361 1.00 0.00 C ATOM 1245 CE3 TRP A 79 2.158 9.779 -8.742 1.00 0.00 C ATOM 1246 CZ2 TRP A 79 0.049 11.647 -8.976 1.00 0.00 C ATOM 1247 CZ3 TRP A 79 0.964 9.445 -9.354 1.00 0.00 C ATOM 1248 CH2 TRP A 79 -0.076 10.376 -9.467 1.00 0.00 C ATOM 0 H TRP A 79 5.937 13.285 -7.767 1.00 0.00 H new ATOM 0 HA TRP A 79 4.836 12.252 -5.334 1.00 0.00 H new ATOM 0 HB2 TRP A 79 5.319 11.092 -8.102 1.00 0.00 H new ATOM 0 HB3 TRP A 79 4.581 10.170 -6.807 1.00 0.00 H new ATOM 0 HD1 TRP A 79 3.496 13.790 -6.814 1.00 0.00 H new ATOM 0 HE1 TRP A 79 1.090 14.015 -7.731 1.00 0.00 H new ATOM 0 HE3 TRP A 79 2.955 9.055 -8.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -0.756 12.362 -9.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 0.831 8.450 -9.751 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -0.996 10.085 -9.952 1.00 0.00 H new ATOM 1259 N VAL A 80 6.416 10.422 -4.586 1.00 0.00 N ATOM 1260 CA VAL A 80 7.440 9.577 -3.980 1.00 0.00 C ATOM 1261 C VAL A 80 7.974 8.576 -5.000 1.00 0.00 C ATOM 1262 O VAL A 80 9.101 8.095 -4.890 1.00 0.00 O ATOM 1263 CB VAL A 80 6.874 8.817 -2.763 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.466 8.336 -3.057 1.00 0.00 C ATOM 1265 CG2 VAL A 80 7.773 7.655 -2.367 1.00 0.00 C ATOM 0 H VAL A 80 5.505 10.369 -4.130 1.00 0.00 H new ATOM 0 HA VAL A 80 8.253 10.222 -3.646 1.00 0.00 H new ATOM 0 HB VAL A 80 6.840 9.505 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.076 7.801 -2.191 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.827 9.192 -3.273 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.482 7.669 -3.919 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.345 7.141 -1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.856 6.959 -3.201 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.763 8.032 -2.109 1.00 0.00 H new ATOM 1275 N ASP A 81 7.151 8.277 -5.999 1.00 0.00 N ATOM 1276 CA ASP A 81 7.528 7.339 -7.050 1.00 0.00 C ATOM 1277 C ASP A 81 8.465 8.004 -8.050 1.00 0.00 C ATOM 1278 O ASP A 81 8.906 7.381 -9.016 1.00 0.00 O ATOM 1279 CB ASP A 81 6.283 6.816 -7.768 1.00 0.00 C ATOM 1280 CG ASP A 81 6.557 5.544 -8.548 1.00 0.00 C ATOM 1281 OD1 ASP A 81 7.119 4.597 -7.959 1.00 0.00 O ATOM 1282 OD2 ASP A 81 6.211 5.496 -9.746 1.00 0.00 O ATOM 0 H ASP A 81 6.216 8.672 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 81 8.048 6.500 -6.589 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.497 6.628 -7.037 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.910 7.582 -8.447 1.00 0.00 H new ATOM 1287 N GLY A 82 8.769 9.273 -7.804 1.00 0.00 N ATOM 1288 CA GLY A 82 9.655 10.009 -8.680 1.00 0.00 C ATOM 1289 C GLY A 82 8.955 10.538 -9.915 1.00 0.00 C ATOM 1290 O GLY A 82 9.553 10.613 -10.989 1.00 0.00 O ATOM 0 H GLY A 82 8.415 9.805 -7.009 1.00 0.00 H new ATOM 0 HA2 GLY A 82 10.091 10.843 -8.130 1.00 0.00 H new ATOM 0 HA3 GLY A 82 10.478 9.362 -8.984 1.00 0.00 H new ATOM 1294 N SER A 83 7.684 10.906 -9.769 1.00 0.00 N ATOM 1295 CA SER A 83 6.912 11.429 -10.890 1.00 0.00 C ATOM 1296 C SER A 83 6.118 12.669 -10.486 1.00 0.00 C ATOM 1297 O SER A 83 5.219 12.594 -9.653 1.00 0.00 O ATOM 1298 CB SER A 83 5.963 10.356 -11.427 1.00 0.00 C ATOM 1299 OG SER A 83 5.442 10.722 -12.693 1.00 0.00 O ATOM 0 H SER A 83 7.170 10.852 -8.889 1.00 0.00 H new ATOM 0 HA SER A 83 7.614 11.714 -11.674 1.00 0.00 H new ATOM 0 HB2 SER A 83 6.492 9.406 -11.509 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.144 10.205 -10.723 1.00 0.00 H new ATOM 0 HG SER A 83 4.840 10.019 -13.015 1.00 0.00 H new ATOM 1305 N HIS A 84 6.456 13.808 -11.085 1.00 0.00 N ATOM 1306 CA HIS A 84 5.773 15.063 -10.791 1.00 0.00 C ATOM 1307 C HIS A 84 4.258 14.887 -10.839 1.00 0.00 C ATOM 1308 O HIS A 84 3.741 14.081 -11.614 1.00 0.00 O ATOM 1309 CB HIS A 84 6.204 16.147 -11.780 1.00 0.00 C ATOM 1310 CG HIS A 84 6.065 15.737 -13.214 1.00 0.00 C ATOM 1311 ND1 HIS A 84 6.875 14.791 -13.808 1.00 0.00 N ATOM 1312 CD2 HIS A 84 5.204 16.149 -14.174 1.00 0.00 C ATOM 1313 CE1 HIS A 84 6.518 14.640 -15.071 1.00 0.00 C ATOM 1314 NE2 HIS A 84 5.506 15.451 -15.318 1.00 0.00 N ATOM 0 H HIS A 84 7.200 13.887 -11.778 1.00 0.00 H new ATOM 0 HA HIS A 84 6.051 15.369 -9.783 1.00 0.00 H new ATOM 0 HB2 HIS A 84 5.608 17.043 -11.607 1.00 0.00 H new ATOM 0 HB3 HIS A 84 7.243 16.413 -11.585 1.00 0.00 H new ATOM 0 HD2 HIS A 84 4.425 16.889 -14.061 1.00 0.00 H new ATOM 0 HE1 HIS A 84 6.976 13.967 -15.781 1.00 0.00 H new ATOM 0 HE2 HIS A 84 5.026 15.544 -16.213 1.00 0.00 H new ATOM 1323 N VAL A 85 3.556 15.644 -10.003 1.00 0.00 N ATOM 1324 CA VAL A 85 2.100 15.578 -9.938 1.00 0.00 C ATOM 1325 C VAL A 85 1.470 15.744 -11.319 1.00 0.00 C ATOM 1326 O VAL A 85 2.060 16.351 -12.213 1.00 0.00 O ATOM 1327 CB VAL A 85 1.534 16.658 -8.996 1.00 0.00 C ATOM 1328 CG1 VAL A 85 0.045 16.451 -8.778 1.00 0.00 C ATOM 1329 CG2 VAL A 85 2.274 16.653 -7.671 1.00 0.00 C ATOM 0 H VAL A 85 3.974 16.314 -9.358 1.00 0.00 H new ATOM 0 HA VAL A 85 1.848 14.592 -9.548 1.00 0.00 H new ATOM 0 HB VAL A 85 1.679 17.631 -9.465 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.336 17.224 -8.110 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.474 16.510 -9.734 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.125 15.471 -8.333 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.860 17.423 -7.020 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.164 15.678 -7.196 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.331 16.855 -7.844 1.00 0.00 H new ATOM 1339 N ASP A 86 0.267 15.199 -11.483 1.00 0.00 N ATOM 1340 CA ASP A 86 -0.445 15.283 -12.753 1.00 0.00 C ATOM 1341 C ASP A 86 -1.835 15.888 -12.564 1.00 0.00 C ATOM 1342 O ASP A 86 -2.166 16.906 -13.171 1.00 0.00 O ATOM 1343 CB ASP A 86 -0.563 13.896 -13.387 1.00 0.00 C ATOM 1344 CG ASP A 86 0.787 13.234 -13.580 1.00 0.00 C ATOM 1345 OD1 ASP A 86 1.299 12.636 -12.611 1.00 0.00 O ATOM 1346 OD2 ASP A 86 1.332 13.311 -14.701 1.00 0.00 O ATOM 0 H ASP A 86 -0.234 14.695 -10.752 1.00 0.00 H new ATOM 0 HA ASP A 86 0.125 15.933 -13.416 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -1.189 13.263 -12.757 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.064 13.981 -14.351 1.00 0.00 H new ATOM 1351 N TYR A 87 -2.645 15.251 -11.722 1.00 0.00 N ATOM 1352 CA TYR A 87 -4.002 15.724 -11.460 1.00 0.00 C ATOM 1353 C TYR A 87 -4.026 16.689 -10.279 1.00 0.00 C ATOM 1354 O TYR A 87 -4.561 17.794 -10.381 1.00 0.00 O ATOM 1355 CB TYR A 87 -4.937 14.543 -11.191 1.00 0.00 C ATOM 1356 CG TYR A 87 -4.836 13.443 -12.225 1.00 0.00 C ATOM 1357 CD1 TYR A 87 -3.837 12.480 -12.149 1.00 0.00 C ATOM 1358 CD2 TYR A 87 -5.740 13.369 -13.278 1.00 0.00 C ATOM 1359 CE1 TYR A 87 -3.742 11.474 -13.092 1.00 0.00 C ATOM 1360 CE2 TYR A 87 -5.651 12.366 -14.225 1.00 0.00 C ATOM 1361 CZ TYR A 87 -4.651 11.422 -14.128 1.00 0.00 C ATOM 1362 OH TYR A 87 -4.559 10.421 -15.068 1.00 0.00 O ATOM 0 H TYR A 87 -2.386 14.408 -11.210 1.00 0.00 H new ATOM 0 HA TYR A 87 -4.349 16.256 -12.346 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.712 14.128 -10.208 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -5.965 14.905 -11.156 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.123 12.518 -11.340 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -6.525 14.107 -13.358 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -2.960 10.733 -13.018 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -6.362 12.322 -15.037 1.00 0.00 H new ATOM 0 HH TYR A 87 -5.275 10.526 -15.729 1.00 0.00 H new ATOM 1372 N SER A 88 -3.438 16.262 -9.166 1.00 0.00 N ATOM 1373 CA SER A 88 -3.377 17.077 -7.950 1.00 0.00 C ATOM 1374 C SER A 88 -4.775 17.398 -7.423 1.00 0.00 C ATOM 1375 O SER A 88 -5.736 17.471 -8.187 1.00 0.00 O ATOM 1376 CB SER A 88 -2.607 18.373 -8.206 1.00 0.00 C ATOM 1377 OG SER A 88 -2.119 18.434 -9.536 1.00 0.00 O ATOM 0 H SER A 88 -2.992 15.349 -9.078 1.00 0.00 H new ATOM 0 HA SER A 88 -2.851 16.495 -7.193 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.257 19.227 -8.016 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.773 18.446 -7.508 1.00 0.00 H new ATOM 0 HG SER A 88 -1.775 19.333 -9.717 1.00 0.00 H new ATOM 1383 N ASN A 89 -4.886 17.579 -6.106 1.00 0.00 N ATOM 1384 CA ASN A 89 -6.172 17.879 -5.490 1.00 0.00 C ATOM 1385 C ASN A 89 -6.078 19.014 -4.465 1.00 0.00 C ATOM 1386 O ASN A 89 -7.108 19.533 -4.037 1.00 0.00 O ATOM 1387 CB ASN A 89 -6.731 16.626 -4.814 1.00 0.00 C ATOM 1388 CG ASN A 89 -7.158 15.558 -5.798 1.00 0.00 C ATOM 1389 OD1 ASN A 89 -7.299 15.814 -6.993 1.00 0.00 O ATOM 1390 ND2 ASN A 89 -7.372 14.349 -5.292 1.00 0.00 N ATOM 0 H ASN A 89 -4.105 17.523 -5.452 1.00 0.00 H new ATOM 0 HA ASN A 89 -6.841 18.208 -6.286 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -5.975 16.214 -4.146 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.585 16.904 -4.197 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.666 13.586 -5.901 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.242 14.184 -4.294 1.00 0.00 H new ATOM 1397 N TRP A 90 -4.855 19.394 -4.059 1.00 0.00 N ATOM 1398 CA TRP A 90 -4.684 20.462 -3.074 1.00 0.00 C ATOM 1399 C TRP A 90 -5.672 21.594 -3.320 1.00 0.00 C ATOM 1400 O TRP A 90 -5.554 22.340 -4.292 1.00 0.00 O ATOM 1401 CB TRP A 90 -3.254 21.009 -3.082 1.00 0.00 C ATOM 1402 CG TRP A 90 -2.485 20.717 -4.334 1.00 0.00 C ATOM 1403 CD1 TRP A 90 -1.782 19.582 -4.616 1.00 0.00 C ATOM 1404 CD2 TRP A 90 -2.329 21.579 -5.466 1.00 0.00 C ATOM 1405 NE1 TRP A 90 -1.197 19.686 -5.854 1.00 0.00 N ATOM 1406 CE2 TRP A 90 -1.520 20.902 -6.397 1.00 0.00 C ATOM 1407 CE3 TRP A 90 -2.797 22.858 -5.784 1.00 0.00 C ATOM 1408 CZ2 TRP A 90 -1.167 21.459 -7.623 1.00 0.00 C ATOM 1409 CZ3 TRP A 90 -2.446 23.411 -7.003 1.00 0.00 C ATOM 1410 CH2 TRP A 90 -1.638 22.712 -7.908 1.00 0.00 C ATOM 0 H TRP A 90 -3.985 18.981 -4.395 1.00 0.00 H new ATOM 0 HA TRP A 90 -4.880 20.029 -2.093 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -3.290 22.089 -2.936 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -2.714 20.591 -2.233 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -1.698 18.727 -3.961 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -0.617 18.974 -6.297 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.421 23.404 -5.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -0.544 20.922 -8.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -2.801 24.398 -7.261 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -1.381 23.171 -8.851 1.00 0.00 H new ATOM 1421 N ALA A 91 -6.648 21.696 -2.426 1.00 0.00 N ATOM 1422 CA ALA A 91 -7.688 22.720 -2.512 1.00 0.00 C ATOM 1423 C ALA A 91 -7.117 24.064 -2.960 1.00 0.00 C ATOM 1424 O ALA A 91 -6.240 24.625 -2.303 1.00 0.00 O ATOM 1425 CB ALA A 91 -8.388 22.869 -1.171 1.00 0.00 C ATOM 0 H ALA A 91 -6.743 21.075 -1.623 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.411 22.399 -3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.160 23.634 -1.247 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -8.844 21.919 -0.891 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.662 23.160 -0.412 1.00 0.00 H new ATOM 1431 N PRO A 92 -7.609 24.601 -4.092 1.00 0.00 N ATOM 1432 CA PRO A 92 -7.144 25.886 -4.627 1.00 0.00 C ATOM 1433 C PRO A 92 -7.395 27.039 -3.660 1.00 0.00 C ATOM 1434 O PRO A 92 -8.349 27.013 -2.884 1.00 0.00 O ATOM 1435 CB PRO A 92 -7.971 26.074 -5.906 1.00 0.00 C ATOM 1436 CG PRO A 92 -8.474 24.712 -6.248 1.00 0.00 C ATOM 1437 CD PRO A 92 -8.654 24.002 -4.939 1.00 0.00 C ATOM 0 HA PRO A 92 -6.068 25.883 -4.801 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -8.795 26.769 -5.744 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -7.362 26.483 -6.712 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -9.415 24.769 -6.795 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.766 24.183 -6.886 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -9.650 24.163 -4.526 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.522 22.925 -5.042 1.00 0.00 H new ATOM 1445 N GLY A 93 -6.530 28.048 -3.715 1.00 0.00 N ATOM 1446 CA GLY A 93 -6.676 29.197 -2.840 1.00 0.00 C ATOM 1447 C GLY A 93 -5.958 29.013 -1.517 1.00 0.00 C ATOM 1448 O GLY A 93 -5.555 29.989 -0.883 1.00 0.00 O ATOM 0 H GLY A 93 -5.732 28.090 -4.349 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -6.287 30.083 -3.341 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -7.735 29.376 -2.653 1.00 0.00 H new ATOM 1452 N GLU A 94 -5.799 27.758 -1.102 1.00 0.00 N ATOM 1453 CA GLU A 94 -5.126 27.443 0.154 1.00 0.00 C ATOM 1454 C GLU A 94 -5.817 28.127 1.333 1.00 0.00 C ATOM 1455 O GLU A 94 -5.482 29.257 1.689 1.00 0.00 O ATOM 1456 CB GLU A 94 -3.656 27.864 0.092 1.00 0.00 C ATOM 1457 CG GLU A 94 -2.781 26.904 -0.697 1.00 0.00 C ATOM 1458 CD GLU A 94 -1.734 27.620 -1.528 1.00 0.00 C ATOM 1459 OE1 GLU A 94 -2.106 28.535 -2.293 1.00 0.00 O ATOM 1460 OE2 GLU A 94 -0.542 27.263 -1.416 1.00 0.00 O ATOM 0 H GLU A 94 -6.128 26.942 -1.619 1.00 0.00 H new ATOM 0 HA GLU A 94 -5.180 26.365 0.303 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -3.589 28.855 -0.356 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.267 27.946 1.107 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.287 26.219 -0.008 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.409 26.300 -1.352 1.00 0.00 H new ATOM 1467 N PRO A 95 -6.795 27.447 1.958 1.00 0.00 N ATOM 1468 CA PRO A 95 -7.532 27.995 3.101 1.00 0.00 C ATOM 1469 C PRO A 95 -6.667 28.098 4.353 1.00 0.00 C ATOM 1470 O PRO A 95 -7.105 28.618 5.379 1.00 0.00 O ATOM 1471 CB PRO A 95 -8.662 26.986 3.314 1.00 0.00 C ATOM 1472 CG PRO A 95 -8.139 25.708 2.755 1.00 0.00 C ATOM 1473 CD PRO A 95 -7.258 26.093 1.600 1.00 0.00 C ATOM 0 HA PRO A 95 -7.880 29.010 2.911 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -8.908 26.884 4.371 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -9.573 27.298 2.803 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -7.577 25.154 3.507 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -8.954 25.063 2.426 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -6.424 25.401 1.483 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -7.807 26.092 0.658 1.00 0.00 H new ATOM 1481 N THR A 96 -5.438 27.600 4.260 1.00 0.00 N ATOM 1482 CA THR A 96 -4.511 27.636 5.386 1.00 0.00 C ATOM 1483 C THR A 96 -4.189 29.074 5.779 1.00 0.00 C ATOM 1484 O THR A 96 -4.139 29.964 4.931 1.00 0.00 O ATOM 1485 CB THR A 96 -3.222 26.891 5.035 1.00 0.00 C ATOM 1486 OG1 THR A 96 -3.463 25.910 4.041 1.00 0.00 O ATOM 1487 CG2 THR A 96 -2.590 26.196 6.222 1.00 0.00 C ATOM 0 H THR A 96 -5.061 27.167 3.417 1.00 0.00 H new ATOM 0 HA THR A 96 -4.988 27.144 6.234 1.00 0.00 H new ATOM 0 HB THR A 96 -2.535 27.657 4.675 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.626 25.446 3.829 1.00 0.00 H new ATOM 0 HG21 THR A 96 -1.680 25.687 5.904 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.345 26.933 6.987 1.00 0.00 H new ATOM 0 HG23 THR A 96 -3.289 25.467 6.631 1.00 0.00 H new ATOM 1495 N SER A 97 -3.972 29.293 7.073 1.00 0.00 N ATOM 1496 CA SER A 97 -3.654 30.623 7.581 1.00 0.00 C ATOM 1497 C SER A 97 -2.286 31.082 7.088 1.00 0.00 C ATOM 1498 O SER A 97 -2.020 32.280 6.988 1.00 0.00 O ATOM 1499 CB SER A 97 -3.686 30.628 9.110 1.00 0.00 C ATOM 1500 OG SER A 97 -4.644 31.552 9.598 1.00 0.00 O ATOM 0 H SER A 97 -4.011 28.567 7.788 1.00 0.00 H new ATOM 0 HA SER A 97 -4.406 31.317 7.206 1.00 0.00 H new ATOM 0 HB2 SER A 97 -3.922 29.628 9.475 1.00 0.00 H new ATOM 0 HB3 SER A 97 -2.700 30.884 9.497 1.00 0.00 H new ATOM 0 HG SER A 97 -4.646 31.535 10.578 1.00 0.00 H new ATOM 1506 N ARG A 98 -1.420 30.121 6.781 1.00 0.00 N ATOM 1507 CA ARG A 98 -0.078 30.425 6.299 1.00 0.00 C ATOM 1508 C ARG A 98 0.187 29.741 4.961 1.00 0.00 C ATOM 1509 O ARG A 98 0.354 28.524 4.898 1.00 0.00 O ATOM 1510 CB ARG A 98 0.968 29.985 7.325 1.00 0.00 C ATOM 1511 CG ARG A 98 0.902 30.760 8.631 1.00 0.00 C ATOM 1512 CD ARG A 98 2.237 31.406 8.963 1.00 0.00 C ATOM 1513 NE ARG A 98 2.491 31.430 10.401 1.00 0.00 N ATOM 1514 CZ ARG A 98 2.052 32.388 11.212 1.00 0.00 C ATOM 1515 NH1 ARG A 98 1.338 33.396 10.729 1.00 0.00 N ATOM 1516 NH2 ARG A 98 2.326 32.337 12.509 1.00 0.00 N ATOM 0 H ARG A 98 -1.624 29.125 6.858 1.00 0.00 H new ATOM 0 HA ARG A 98 -0.006 31.503 6.157 1.00 0.00 H new ATOM 0 HB2 ARG A 98 0.835 28.924 7.535 1.00 0.00 H new ATOM 0 HB3 ARG A 98 1.961 30.102 6.892 1.00 0.00 H new ATOM 0 HG2 ARG A 98 0.132 31.528 8.561 1.00 0.00 H new ATOM 0 HG3 ARG A 98 0.610 30.089 9.439 1.00 0.00 H new ATOM 0 HD2 ARG A 98 3.038 30.861 8.463 1.00 0.00 H new ATOM 0 HD3 ARG A 98 2.253 32.424 8.575 1.00 0.00 H new ATOM 0 HE ARG A 98 3.036 30.669 10.806 1.00 0.00 H new ATOM 0 HH11 ARG A 98 1.124 33.438 9.733 1.00 0.00 H new ATOM 0 HH12 ARG A 98 1.003 34.129 11.354 1.00 0.00 H new ATOM 0 HH21 ARG A 98 2.874 31.563 12.884 1.00 0.00 H new ATOM 0 HH22 ARG A 98 1.989 33.072 13.131 1.00 0.00 H new ATOM 1530 N SER A 99 0.226 30.535 3.895 1.00 0.00 N ATOM 1531 CA SER A 99 0.471 30.007 2.557 1.00 0.00 C ATOM 1532 C SER A 99 1.949 30.113 2.194 1.00 0.00 C ATOM 1533 O SER A 99 2.363 31.037 1.495 1.00 0.00 O ATOM 1534 CB SER A 99 -0.375 30.757 1.527 1.00 0.00 C ATOM 1535 OG SER A 99 -1.185 31.740 2.150 1.00 0.00 O ATOM 0 H SER A 99 0.091 31.545 3.932 1.00 0.00 H new ATOM 0 HA SER A 99 0.188 28.954 2.551 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.276 31.230 0.792 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.005 30.051 0.986 1.00 0.00 H new ATOM 0 HG SER A 99 -1.715 32.206 1.470 1.00 0.00 H new ATOM 1541 N GLN A 100 2.740 29.159 2.675 1.00 0.00 N ATOM 1542 CA GLN A 100 4.173 29.142 2.402 1.00 0.00 C ATOM 1543 C GLN A 100 4.765 27.766 2.683 1.00 0.00 C ATOM 1544 O GLN A 100 5.444 27.186 1.835 1.00 0.00 O ATOM 1545 CB GLN A 100 4.886 30.199 3.248 1.00 0.00 C ATOM 1546 CG GLN A 100 5.709 31.180 2.428 1.00 0.00 C ATOM 1547 CD GLN A 100 6.366 32.245 3.282 1.00 0.00 C ATOM 1548 OE1 GLN A 100 5.705 33.164 3.767 1.00 0.00 O ATOM 1549 NE2 GLN A 100 7.675 32.130 3.471 1.00 0.00 N ATOM 0 H GLN A 100 2.413 28.387 3.256 1.00 0.00 H new ATOM 0 HA GLN A 100 4.319 29.371 1.346 1.00 0.00 H new ATOM 0 HB2 GLN A 100 4.144 30.752 3.824 1.00 0.00 H new ATOM 0 HB3 GLN A 100 5.539 29.700 3.964 1.00 0.00 H new ATOM 0 HG2 GLN A 100 6.477 30.635 1.879 1.00 0.00 H new ATOM 0 HG3 GLN A 100 5.067 31.658 1.688 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.185 31.353 3.051 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.171 32.819 4.036 1.00 0.00 H new ATOM 1558 N GLY A 101 4.502 27.247 3.879 1.00 0.00 N ATOM 1559 CA GLY A 101 5.016 25.942 4.251 1.00 0.00 C ATOM 1560 C GLY A 101 4.296 24.811 3.542 1.00 0.00 C ATOM 1561 O GLY A 101 3.073 24.696 3.627 1.00 0.00 O ATOM 0 H GLY A 101 3.942 27.707 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.080 25.894 4.018 1.00 0.00 H new ATOM 0 HA3 GLY A 101 4.920 25.811 5.329 1.00 0.00 H new ATOM 1565 N GLU A 102 5.058 23.976 2.842 1.00 0.00 N ATOM 1566 CA GLU A 102 4.487 22.848 2.114 1.00 0.00 C ATOM 1567 C GLU A 102 5.571 21.853 1.712 1.00 0.00 C ATOM 1568 O GLU A 102 6.444 22.169 0.907 1.00 0.00 O ATOM 1569 CB GLU A 102 3.743 23.338 0.870 1.00 0.00 C ATOM 1570 CG GLU A 102 4.461 24.455 0.131 1.00 0.00 C ATOM 1571 CD GLU A 102 3.510 25.352 -0.637 1.00 0.00 C ATOM 1572 OE1 GLU A 102 2.737 26.089 0.009 1.00 0.00 O ATOM 1573 OE2 GLU A 102 3.539 25.316 -1.885 1.00 0.00 O ATOM 0 H GLU A 102 6.072 24.059 2.764 1.00 0.00 H new ATOM 0 HA GLU A 102 3.782 22.343 2.775 1.00 0.00 H new ATOM 0 HB2 GLU A 102 3.598 22.499 0.190 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.752 23.686 1.163 1.00 0.00 H new ATOM 0 HG2 GLU A 102 5.023 25.056 0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 102 5.184 24.022 -0.560 1.00 0.00 H new ATOM 1580 N ASP A 103 5.509 20.650 2.277 1.00 0.00 N ATOM 1581 CA ASP A 103 6.488 19.611 1.973 1.00 0.00 C ATOM 1582 C ASP A 103 5.800 18.283 1.680 1.00 0.00 C ATOM 1583 O ASP A 103 6.434 17.333 1.221 1.00 0.00 O ATOM 1584 CB ASP A 103 7.467 19.445 3.134 1.00 0.00 C ATOM 1585 CG ASP A 103 8.647 18.564 2.774 1.00 0.00 C ATOM 1586 OD1 ASP A 103 9.611 19.081 2.172 1.00 0.00 O ATOM 1587 OD2 ASP A 103 8.607 17.357 3.093 1.00 0.00 O ATOM 0 H ASP A 103 4.792 20.371 2.947 1.00 0.00 H new ATOM 0 HA ASP A 103 7.039 19.918 1.084 1.00 0.00 H new ATOM 0 HB2 ASP A 103 7.830 20.425 3.443 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.944 19.015 3.988 1.00 0.00 H new ATOM 1592 N CYS A 104 4.501 18.225 1.946 1.00 0.00 N ATOM 1593 CA CYS A 104 3.726 17.016 1.710 1.00 0.00 C ATOM 1594 C CYS A 104 2.252 17.349 1.528 1.00 0.00 C ATOM 1595 O CYS A 104 1.808 18.453 1.848 1.00 0.00 O ATOM 1596 CB CYS A 104 3.900 16.035 2.869 1.00 0.00 C ATOM 1597 SG CYS A 104 3.716 16.791 4.515 1.00 0.00 S ATOM 0 H CYS A 104 3.962 19.003 2.326 1.00 0.00 H new ATOM 0 HA CYS A 104 4.094 16.551 0.796 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.169 15.233 2.765 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.887 15.578 2.799 1.00 0.00 H new ATOM 1602 N VAL A 105 1.498 16.392 1.005 1.00 0.00 N ATOM 1603 CA VAL A 105 0.078 16.589 0.774 1.00 0.00 C ATOM 1604 C VAL A 105 -0.765 15.613 1.588 1.00 0.00 C ATOM 1605 O VAL A 105 -0.533 14.404 1.576 1.00 0.00 O ATOM 1606 CB VAL A 105 -0.260 16.446 -0.719 1.00 0.00 C ATOM 1607 CG1 VAL A 105 -1.760 16.467 -0.939 1.00 0.00 C ATOM 1608 CG2 VAL A 105 0.402 17.557 -1.513 1.00 0.00 C ATOM 0 H VAL A 105 1.848 15.473 0.734 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.161 17.602 1.098 1.00 0.00 H new ATOM 0 HB VAL A 105 0.121 15.486 -1.066 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.973 16.364 -2.003 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.219 15.641 -0.396 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.168 17.411 -0.577 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.156 17.446 -2.569 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.043 18.523 -1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.483 17.502 -1.385 1.00 0.00 H new ATOM 1618 N MET A 106 -1.748 16.161 2.293 1.00 0.00 N ATOM 1619 CA MET A 106 -2.649 15.375 3.123 1.00 0.00 C ATOM 1620 C MET A 106 -4.094 15.633 2.706 1.00 0.00 C ATOM 1621 O MET A 106 -4.364 16.558 1.949 1.00 0.00 O ATOM 1622 CB MET A 106 -2.447 15.728 4.600 1.00 0.00 C ATOM 1623 CG MET A 106 -3.068 17.057 5.003 1.00 0.00 C ATOM 1624 SD MET A 106 -3.483 17.126 6.756 1.00 0.00 S ATOM 1625 CE MET A 106 -4.272 18.731 6.854 1.00 0.00 C ATOM 0 H MET A 106 -1.942 17.162 2.304 1.00 0.00 H new ATOM 0 HA MET A 106 -2.428 14.316 2.987 1.00 0.00 H new ATOM 0 HB2 MET A 106 -2.875 14.936 5.215 1.00 0.00 H new ATOM 0 HB3 MET A 106 -1.379 15.757 4.815 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.375 17.864 4.766 1.00 0.00 H new ATOM 0 HG3 MET A 106 -3.969 17.226 4.413 1.00 0.00 H new ATOM 0 HE1 MET A 106 -4.995 18.732 7.670 1.00 0.00 H new ATOM 0 HE2 MET A 106 -3.518 19.497 7.037 1.00 0.00 H new ATOM 0 HE3 MET A 106 -4.784 18.943 5.915 1.00 0.00 H new ATOM 1635 N MET A 107 -5.021 14.822 3.195 1.00 0.00 N ATOM 1636 CA MET A 107 -6.430 14.996 2.848 1.00 0.00 C ATOM 1637 C MET A 107 -7.279 15.176 4.100 1.00 0.00 C ATOM 1638 O MET A 107 -7.183 14.392 5.045 1.00 0.00 O ATOM 1639 CB MET A 107 -6.954 13.799 2.056 1.00 0.00 C ATOM 1640 CG MET A 107 -6.017 12.607 2.027 1.00 0.00 C ATOM 1641 SD MET A 107 -5.751 11.988 0.356 1.00 0.00 S ATOM 1642 CE MET A 107 -7.403 12.126 -0.323 1.00 0.00 C ATOM 0 H MET A 107 -4.830 14.044 3.827 1.00 0.00 H new ATOM 0 HA MET A 107 -6.503 15.891 2.231 1.00 0.00 H new ATOM 0 HB2 MET A 107 -7.907 13.486 2.482 1.00 0.00 H new ATOM 0 HB3 MET A 107 -7.152 14.115 1.032 1.00 0.00 H new ATOM 0 HG2 MET A 107 -5.059 12.890 2.464 1.00 0.00 H new ATOM 0 HG3 MET A 107 -6.427 11.810 2.647 1.00 0.00 H new ATOM 0 HE1 MET A 107 -7.434 11.650 -1.303 1.00 0.00 H new ATOM 0 HE2 MET A 107 -8.112 11.634 0.342 1.00 0.00 H new ATOM 0 HE3 MET A 107 -7.669 13.178 -0.422 1.00 0.00 H new ATOM 1652 N ARG A 108 -8.112 16.214 4.093 1.00 0.00 N ATOM 1653 CA ARG A 108 -8.989 16.511 5.223 1.00 0.00 C ATOM 1654 C ARG A 108 -9.777 17.792 4.972 1.00 0.00 C ATOM 1655 O ARG A 108 -9.268 18.734 4.364 1.00 0.00 O ATOM 1656 CB ARG A 108 -8.177 16.650 6.513 1.00 0.00 C ATOM 1657 CG ARG A 108 -8.813 15.961 7.709 1.00 0.00 C ATOM 1658 CD ARG A 108 -8.871 16.882 8.917 1.00 0.00 C ATOM 1659 NE ARG A 108 -10.136 17.608 8.990 1.00 0.00 N ATOM 1660 CZ ARG A 108 -11.220 17.142 9.603 1.00 0.00 C ATOM 1661 NH1 ARG A 108 -11.194 15.954 10.193 1.00 0.00 N ATOM 1662 NH2 ARG A 108 -12.332 17.864 9.626 1.00 0.00 N ATOM 0 H ARG A 108 -8.198 16.866 3.314 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.688 15.682 5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -7.182 16.236 6.352 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -8.049 17.708 6.740 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.820 15.636 7.449 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.244 15.066 7.960 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -8.736 16.296 9.826 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.047 17.594 8.871 1.00 0.00 H new ATOM 0 HE ARG A 108 -10.191 18.524 8.546 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -10.341 15.395 10.177 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.027 15.599 10.662 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -12.356 18.778 9.173 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -13.163 17.506 10.096 1.00 0.00 H new ATOM 1676 N GLY A 109 -11.017 17.823 5.448 1.00 0.00 N ATOM 1677 CA GLY A 109 -11.850 18.998 5.269 1.00 0.00 C ATOM 1678 C GLY A 109 -13.161 18.688 4.574 1.00 0.00 C ATOM 1679 O GLY A 109 -14.169 18.423 5.229 1.00 0.00 O ATOM 0 H GLY A 109 -11.460 17.056 5.954 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.056 19.443 6.242 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -11.303 19.741 4.688 1.00 0.00 H new ATOM 1683 N SER A 110 -13.149 18.726 3.245 1.00 0.00 N ATOM 1684 CA SER A 110 -14.350 18.453 2.463 1.00 0.00 C ATOM 1685 C SER A 110 -14.272 17.086 1.788 1.00 0.00 C ATOM 1686 O SER A 110 -15.293 16.520 1.400 1.00 0.00 O ATOM 1687 CB SER A 110 -14.552 19.542 1.407 1.00 0.00 C ATOM 1688 OG SER A 110 -15.031 20.739 1.995 1.00 0.00 O ATOM 0 H SER A 110 -12.322 18.943 2.688 1.00 0.00 H new ATOM 0 HA SER A 110 -15.200 18.449 3.146 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.609 19.736 0.895 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.259 19.195 0.653 1.00 0.00 H new ATOM 0 HG SER A 110 -15.150 21.420 1.300 1.00 0.00 H new ATOM 1694 N GLY A 111 -13.058 16.561 1.652 1.00 0.00 N ATOM 1695 CA GLY A 111 -12.881 15.267 1.023 1.00 0.00 C ATOM 1696 C GLY A 111 -11.820 15.289 -0.059 1.00 0.00 C ATOM 1697 O GLY A 111 -11.754 14.383 -0.890 1.00 0.00 O ATOM 0 H GLY A 111 -12.197 17.008 1.966 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -12.608 14.532 1.781 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -13.828 14.943 0.592 1.00 0.00 H new ATOM 1701 N ARG A 112 -10.988 16.325 -0.048 1.00 0.00 N ATOM 1702 CA ARG A 112 -9.925 16.457 -1.036 1.00 0.00 C ATOM 1703 C ARG A 112 -8.558 16.517 -0.360 1.00 0.00 C ATOM 1704 O ARG A 112 -8.368 15.982 0.730 1.00 0.00 O ATOM 1705 CB ARG A 112 -10.142 17.707 -1.898 1.00 0.00 C ATOM 1706 CG ARG A 112 -10.827 18.857 -1.171 1.00 0.00 C ATOM 1707 CD ARG A 112 -10.011 19.339 0.019 1.00 0.00 C ATOM 1708 NE ARG A 112 -10.274 20.742 0.330 1.00 0.00 N ATOM 1709 CZ ARG A 112 -10.581 21.183 1.546 1.00 0.00 C ATOM 1710 NH1 ARG A 112 -10.664 20.335 2.562 1.00 0.00 N ATOM 1711 NH2 ARG A 112 -10.805 22.474 1.748 1.00 0.00 N ATOM 0 H ARG A 112 -11.029 17.084 0.633 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.954 15.578 -1.680 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.176 18.051 -2.269 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.739 17.435 -2.768 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -10.983 19.684 -1.864 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.812 18.537 -0.831 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -10.242 18.725 0.890 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -8.950 19.207 -0.192 1.00 0.00 H new ATOM 0 HE ARG A 112 -10.219 21.422 -0.429 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -10.492 19.341 2.412 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -10.900 20.677 3.494 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -10.742 23.130 0.970 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.040 22.811 2.682 1.00 0.00 H new ATOM 1725 N TRP A 113 -7.612 17.173 -1.021 1.00 0.00 N ATOM 1726 CA TRP A 113 -6.258 17.315 -0.508 1.00 0.00 C ATOM 1727 C TRP A 113 -5.983 18.725 -0.043 1.00 0.00 C ATOM 1728 O TRP A 113 -6.631 19.680 -0.465 1.00 0.00 O ATOM 1729 CB TRP A 113 -5.210 17.039 -1.581 1.00 0.00 C ATOM 1730 CG TRP A 113 -5.190 15.667 -2.153 1.00 0.00 C ATOM 1731 CD1 TRP A 113 -6.010 14.621 -1.865 1.00 0.00 C ATOM 1732 CD2 TRP A 113 -4.282 15.215 -3.151 1.00 0.00 C ATOM 1733 NE1 TRP A 113 -5.662 13.534 -2.632 1.00 0.00 N ATOM 1734 CE2 TRP A 113 -4.598 13.876 -3.432 1.00 0.00 C ATOM 1735 CE3 TRP A 113 -3.229 15.827 -3.833 1.00 0.00 C ATOM 1736 CZ2 TRP A 113 -3.892 13.130 -4.376 1.00 0.00 C ATOM 1737 CZ3 TRP A 113 -2.528 15.089 -4.770 1.00 0.00 C ATOM 1738 CH2 TRP A 113 -2.863 13.752 -5.034 1.00 0.00 C ATOM 0 H TRP A 113 -7.763 17.620 -1.925 1.00 0.00 H new ATOM 0 HA TRP A 113 -6.191 16.598 0.310 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -5.363 17.746 -2.396 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -4.227 17.247 -1.159 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -6.813 14.641 -1.143 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -6.119 12.622 -2.611 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -2.967 16.856 -3.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -4.147 12.101 -4.581 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.711 15.549 -5.306 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -2.298 13.201 -5.771 1.00 0.00 H new ATOM 1749 N ASN A 114 -4.949 18.837 0.759 1.00 0.00 N ATOM 1750 CA ASN A 114 -4.470 20.110 1.221 1.00 0.00 C ATOM 1751 C ASN A 114 -2.952 20.055 1.204 1.00 0.00 C ATOM 1752 O ASN A 114 -2.344 19.216 1.871 1.00 0.00 O ATOM 1753 CB ASN A 114 -4.985 20.411 2.631 1.00 0.00 C ATOM 1754 CG ASN A 114 -6.450 20.804 2.639 1.00 0.00 C ATOM 1755 OD1 ASN A 114 -6.945 21.423 1.697 1.00 0.00 O ATOM 1756 ND2 ASN A 114 -7.152 20.444 3.708 1.00 0.00 N ATOM 0 H ASN A 114 -4.417 18.040 1.108 1.00 0.00 H new ATOM 0 HA ASN A 114 -4.833 20.909 0.574 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -4.843 19.533 3.262 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -4.393 21.216 3.067 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -8.142 20.680 3.771 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.701 19.932 4.466 1.00 0.00 H new ATOM 1763 N ASP A 115 -2.348 20.932 0.425 1.00 0.00 N ATOM 1764 CA ASP A 115 -0.903 20.966 0.300 1.00 0.00 C ATOM 1765 C ASP A 115 -0.278 21.890 1.339 1.00 0.00 C ATOM 1766 O ASP A 115 -0.406 23.111 1.259 1.00 0.00 O ATOM 1767 CB ASP A 115 -0.516 21.411 -1.106 1.00 0.00 C ATOM 1768 CG ASP A 115 0.983 21.352 -1.321 1.00 0.00 C ATOM 1769 OD1 ASP A 115 1.493 20.265 -1.659 1.00 0.00 O ATOM 1770 OD2 ASP A 115 1.647 22.394 -1.144 1.00 0.00 O ATOM 0 H ASP A 115 -2.837 21.632 -0.132 1.00 0.00 H new ATOM 0 HA ASP A 115 -0.521 19.961 0.478 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.014 20.776 -1.839 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -0.868 22.429 -1.275 1.00 0.00 H new ATOM 1775 N ALA A 116 0.405 21.294 2.313 1.00 0.00 N ATOM 1776 CA ALA A 116 1.056 22.051 3.368 1.00 0.00 C ATOM 1777 C ALA A 116 2.185 21.247 3.998 1.00 0.00 C ATOM 1778 O ALA A 116 2.232 20.023 3.874 1.00 0.00 O ATOM 1779 CB ALA A 116 0.045 22.462 4.425 1.00 0.00 C ATOM 0 H ALA A 116 0.520 20.283 2.390 1.00 0.00 H new ATOM 0 HA ALA A 116 1.485 22.950 2.926 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.548 23.028 5.209 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -0.727 23.081 3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.412 21.572 4.857 1.00 0.00 H new ATOM 1785 N PHE A 117 3.089 21.941 4.678 1.00 0.00 N ATOM 1786 CA PHE A 117 4.218 21.293 5.336 1.00 0.00 C ATOM 1787 C PHE A 117 3.732 20.148 6.223 1.00 0.00 C ATOM 1788 O PHE A 117 2.573 20.124 6.637 1.00 0.00 O ATOM 1789 CB PHE A 117 4.993 22.307 6.179 1.00 0.00 C ATOM 1790 CG PHE A 117 6.483 22.200 6.025 1.00 0.00 C ATOM 1791 CD1 PHE A 117 7.099 22.590 4.847 1.00 0.00 C ATOM 1792 CD2 PHE A 117 7.266 21.712 7.057 1.00 0.00 C ATOM 1793 CE1 PHE A 117 8.469 22.493 4.701 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.637 21.612 6.918 1.00 0.00 C ATOM 1795 CZ PHE A 117 9.240 22.004 5.739 1.00 0.00 C ATOM 0 H PHE A 117 3.063 22.955 4.789 1.00 0.00 H new ATOM 0 HA PHE A 117 4.878 20.890 4.568 1.00 0.00 H new ATOM 0 HB2 PHE A 117 4.678 23.313 5.902 1.00 0.00 H new ATOM 0 HB3 PHE A 117 4.733 22.169 7.229 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.501 22.974 4.034 1.00 0.00 H new ATOM 0 HD2 PHE A 117 6.800 21.406 7.982 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.937 22.799 3.777 1.00 0.00 H new ATOM 0 HE2 PHE A 117 9.236 21.228 7.730 1.00 0.00 H new ATOM 0 HZ PHE A 117 10.312 21.929 5.628 1.00 0.00 H new ATOM 1805 N CYS A 118 4.621 19.205 6.519 1.00 0.00 N ATOM 1806 CA CYS A 118 4.271 18.066 7.361 1.00 0.00 C ATOM 1807 C CYS A 118 4.282 18.463 8.836 1.00 0.00 C ATOM 1808 O CYS A 118 5.149 18.035 9.599 1.00 0.00 O ATOM 1809 CB CYS A 118 5.248 16.912 7.126 1.00 0.00 C ATOM 1810 SG CYS A 118 5.539 16.531 5.369 1.00 0.00 S ATOM 0 H CYS A 118 5.586 19.207 6.190 1.00 0.00 H new ATOM 0 HA CYS A 118 3.265 17.741 7.094 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.201 17.155 7.597 1.00 0.00 H new ATOM 0 HB3 CYS A 118 4.866 16.020 7.622 1.00 0.00 H new ATOM 1815 N ASP A 119 3.316 19.288 9.229 1.00 0.00 N ATOM 1816 CA ASP A 119 3.217 19.747 10.610 1.00 0.00 C ATOM 1817 C ASP A 119 2.432 18.758 11.467 1.00 0.00 C ATOM 1818 O ASP A 119 1.958 19.105 12.548 1.00 0.00 O ATOM 1819 CB ASP A 119 2.553 21.125 10.664 1.00 0.00 C ATOM 1820 CG ASP A 119 3.547 22.253 10.462 1.00 0.00 C ATOM 1821 OD1 ASP A 119 4.554 22.295 11.199 1.00 0.00 O ATOM 1822 OD2 ASP A 119 3.317 23.094 9.567 1.00 0.00 O ATOM 0 H ASP A 119 2.591 19.652 8.611 1.00 0.00 H new ATOM 0 HA ASP A 119 4.228 19.819 11.012 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.780 21.183 9.897 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.057 21.249 11.627 1.00 0.00 H new ATOM 1827 N ARG A 120 2.303 17.527 10.978 1.00 0.00 N ATOM 1828 CA ARG A 120 1.579 16.482 11.699 1.00 0.00 C ATOM 1829 C ARG A 120 0.125 16.883 11.933 1.00 0.00 C ATOM 1830 O ARG A 120 -0.174 17.686 12.818 1.00 0.00 O ATOM 1831 CB ARG A 120 2.262 16.189 13.037 1.00 0.00 C ATOM 1832 CG ARG A 120 2.309 14.711 13.387 1.00 0.00 C ATOM 1833 CD ARG A 120 0.921 14.165 13.684 1.00 0.00 C ATOM 1834 NE ARG A 120 0.938 13.192 14.773 1.00 0.00 N ATOM 1835 CZ ARG A 120 0.713 13.504 16.046 1.00 0.00 C ATOM 1836 NH1 ARG A 120 0.455 14.759 16.389 1.00 0.00 N ATOM 1837 NH2 ARG A 120 0.745 12.561 16.978 1.00 0.00 N ATOM 0 H ARG A 120 2.691 17.228 10.083 1.00 0.00 H new ATOM 0 HA ARG A 120 1.592 15.580 11.087 1.00 0.00 H new ATOM 0 HB2 ARG A 120 3.279 16.579 13.009 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.737 16.724 13.828 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.751 14.154 12.561 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.953 14.561 14.253 1.00 0.00 H new ATOM 0 HD2 ARG A 120 0.255 14.988 13.944 1.00 0.00 H new ATOM 0 HD3 ARG A 120 0.515 13.698 12.787 1.00 0.00 H new ATOM 0 HE ARG A 120 1.134 12.217 14.544 1.00 0.00 H new ATOM 0 HH11 ARG A 120 0.429 15.488 15.676 1.00 0.00 H new ATOM 0 HH12 ARG A 120 0.283 14.996 17.366 1.00 0.00 H new ATOM 0 HH21 ARG A 120 0.942 11.594 16.719 1.00 0.00 H new ATOM 0 HH22 ARG A 120 0.572 12.802 17.954 1.00 0.00 H new ATOM 1851 N LYS A 121 -0.777 16.315 11.138 1.00 0.00 N ATOM 1852 CA LYS A 121 -2.200 16.615 11.264 1.00 0.00 C ATOM 1853 C LYS A 121 -3.053 15.405 10.892 1.00 0.00 C ATOM 1854 O LYS A 121 -4.269 15.517 10.738 1.00 0.00 O ATOM 1855 CB LYS A 121 -2.571 17.805 10.378 1.00 0.00 C ATOM 1856 CG LYS A 121 -2.744 19.104 11.146 1.00 0.00 C ATOM 1857 CD LYS A 121 -4.056 19.786 10.797 1.00 0.00 C ATOM 1858 CE LYS A 121 -5.171 19.365 11.741 1.00 0.00 C ATOM 1859 NZ LYS A 121 -6.286 20.352 11.759 1.00 0.00 N ATOM 0 H LYS A 121 -0.549 15.647 10.402 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.399 16.867 12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -1.797 17.940 9.622 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.497 17.579 9.849 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.711 18.902 12.217 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.914 19.774 10.922 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.928 20.868 10.842 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.334 19.540 9.772 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -5.554 18.390 11.439 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.770 19.252 12.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -7.026 20.028 12.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -5.926 21.276 12.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.686 20.442 10.803 1.00 0.00 H new ATOM 1872 N LEU A 122 -2.409 14.250 10.744 1.00 0.00 N ATOM 1873 CA LEU A 122 -3.116 13.025 10.386 1.00 0.00 C ATOM 1874 C LEU A 122 -2.871 11.926 11.415 1.00 0.00 C ATOM 1875 O LEU A 122 -2.134 12.122 12.381 1.00 0.00 O ATOM 1876 CB LEU A 122 -2.678 12.553 9.000 1.00 0.00 C ATOM 1877 CG LEU A 122 -2.731 13.625 7.911 1.00 0.00 C ATOM 1878 CD1 LEU A 122 -1.355 14.233 7.691 1.00 0.00 C ATOM 1879 CD2 LEU A 122 -3.272 13.038 6.617 1.00 0.00 C ATOM 0 H LEU A 122 -1.403 14.137 10.866 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.184 13.242 10.371 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.659 12.173 9.066 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.311 11.718 8.699 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.404 14.417 8.238 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.414 14.994 6.912 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.006 14.689 8.618 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.657 13.453 7.385 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.304 13.813 5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.623 12.227 6.286 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.278 12.652 6.785 1.00 0.00 H new ATOM 1891 N GLY A 123 -3.495 10.770 11.200 1.00 0.00 N ATOM 1892 CA GLY A 123 -3.333 9.658 12.120 1.00 0.00 C ATOM 1893 C GLY A 123 -3.456 8.307 11.441 1.00 0.00 C ATOM 1894 O GLY A 123 -3.361 7.268 12.094 1.00 0.00 O ATOM 0 H GLY A 123 -4.109 10.584 10.407 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -2.357 9.730 12.601 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -4.083 9.733 12.908 1.00 0.00 H new ATOM 1898 N ALA A 124 -3.665 8.316 10.126 1.00 0.00 N ATOM 1899 CA ALA A 124 -3.797 7.078 9.368 1.00 0.00 C ATOM 1900 C ALA A 124 -2.802 7.040 8.213 1.00 0.00 C ATOM 1901 O ALA A 124 -2.713 7.985 7.431 1.00 0.00 O ATOM 1902 CB ALA A 124 -5.219 6.927 8.849 1.00 0.00 C ATOM 0 H ALA A 124 -3.746 9.165 9.567 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.576 6.244 10.034 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.304 5.998 8.285 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.913 6.905 9.689 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.461 7.769 8.200 1.00 0.00 H new ATOM 1908 N TRP A 125 -2.062 5.938 8.106 1.00 0.00 N ATOM 1909 CA TRP A 125 -1.077 5.778 7.048 1.00 0.00 C ATOM 1910 C TRP A 125 -1.640 4.933 5.918 1.00 0.00 C ATOM 1911 O TRP A 125 -2.289 3.907 6.154 1.00 0.00 O ATOM 1912 CB TRP A 125 0.198 5.133 7.594 1.00 0.00 C ATOM 1913 CG TRP A 125 -0.053 3.854 8.329 1.00 0.00 C ATOM 1914 CD1 TRP A 125 -0.414 3.721 9.638 1.00 0.00 C ATOM 1915 CD2 TRP A 125 0.037 2.526 7.800 1.00 0.00 C ATOM 1916 NE1 TRP A 125 -0.556 2.394 9.956 1.00 0.00 N ATOM 1917 CE2 TRP A 125 -0.283 1.639 8.845 1.00 0.00 C ATOM 1918 CE3 TRP A 125 0.356 2.001 6.545 1.00 0.00 C ATOM 1919 CZ2 TRP A 125 -0.294 0.257 8.672 1.00 0.00 C ATOM 1920 CZ3 TRP A 125 0.347 0.629 6.374 1.00 0.00 C ATOM 1921 CH2 TRP A 125 0.023 -0.229 7.433 1.00 0.00 C ATOM 0 H TRP A 125 -2.129 5.144 8.742 1.00 0.00 H new ATOM 0 HA TRP A 125 -0.833 6.767 6.660 1.00 0.00 H new ATOM 0 HB2 TRP A 125 0.882 4.941 6.767 1.00 0.00 H new ATOM 0 HB3 TRP A 125 0.695 5.836 8.262 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -0.566 4.541 10.324 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -0.822 2.029 10.871 1.00 0.00 H new ATOM 0 HE3 TRP A 125 0.605 2.655 5.723 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -0.544 -0.407 9.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 0.594 0.212 5.409 1.00 0.00 H new ATOM 0 HH2 TRP A 125 0.023 -1.296 7.268 1.00 0.00 H new ATOM 1932 N VAL A 126 -1.401 5.370 4.691 1.00 0.00 N ATOM 1933 CA VAL A 126 -1.896 4.651 3.538 1.00 0.00 C ATOM 1934 C VAL A 126 -0.817 4.453 2.467 1.00 0.00 C ATOM 1935 O VAL A 126 -0.152 5.398 2.044 1.00 0.00 O ATOM 1936 CB VAL A 126 -3.132 5.355 2.938 1.00 0.00 C ATOM 1937 CG1 VAL A 126 -3.139 6.831 3.280 1.00 0.00 C ATOM 1938 CG2 VAL A 126 -3.218 5.143 1.437 1.00 0.00 C ATOM 0 H VAL A 126 -0.871 6.214 4.474 1.00 0.00 H new ATOM 0 HA VAL A 126 -2.191 3.661 3.886 1.00 0.00 H new ATOM 0 HB VAL A 126 -4.017 4.902 3.386 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -4.021 7.301 2.844 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.160 6.953 4.363 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.241 7.302 2.879 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -4.100 5.652 1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.325 5.548 0.961 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -3.291 4.077 1.224 1.00 0.00 H new ATOM 1948 N CYS A 127 -0.673 3.200 2.041 1.00 0.00 N ATOM 1949 CA CYS A 127 0.295 2.801 1.012 1.00 0.00 C ATOM 1950 C CYS A 127 -0.337 1.752 0.111 1.00 0.00 C ATOM 1951 O CYS A 127 -1.338 1.164 0.475 1.00 0.00 O ATOM 1952 CB CYS A 127 1.570 2.235 1.636 1.00 0.00 C ATOM 1953 SG CYS A 127 2.371 3.340 2.838 1.00 0.00 S ATOM 0 H CYS A 127 -1.228 2.424 2.401 1.00 0.00 H new ATOM 0 HA CYS A 127 0.565 3.684 0.433 1.00 0.00 H new ATOM 0 HB2 CYS A 127 1.331 1.293 2.129 1.00 0.00 H new ATOM 0 HB3 CYS A 127 2.280 2.008 0.840 1.00 0.00 H new ATOM 1958 N ASP A 128 0.235 1.495 -1.054 1.00 0.00 N ATOM 1959 CA ASP A 128 -0.339 0.494 -1.933 1.00 0.00 C ATOM 1960 C ASP A 128 0.683 -0.570 -2.285 1.00 0.00 C ATOM 1961 O ASP A 128 1.863 -0.289 -2.471 1.00 0.00 O ATOM 1962 CB ASP A 128 -0.875 1.147 -3.207 1.00 0.00 C ATOM 1963 CG ASP A 128 0.207 1.867 -3.987 1.00 0.00 C ATOM 1964 OD1 ASP A 128 0.750 2.864 -3.468 1.00 0.00 O ATOM 1965 OD2 ASP A 128 0.512 1.433 -5.119 1.00 0.00 O ATOM 0 H ASP A 128 1.076 1.954 -1.406 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.165 0.017 -1.405 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -1.329 0.384 -3.840 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -1.662 1.854 -2.946 1.00 0.00 H new ATOM 1970 N ARG A 129 0.199 -1.798 -2.371 1.00 0.00 N ATOM 1971 CA ARG A 129 1.031 -2.946 -2.691 1.00 0.00 C ATOM 1972 C ARG A 129 0.182 -4.047 -3.307 1.00 0.00 C ATOM 1973 O ARG A 129 -1.013 -4.141 -3.035 1.00 0.00 O ATOM 1974 CB ARG A 129 1.722 -3.465 -1.427 1.00 0.00 C ATOM 1975 CG ARG A 129 2.525 -4.737 -1.642 1.00 0.00 C ATOM 1976 CD ARG A 129 2.075 -5.844 -0.703 1.00 0.00 C ATOM 1977 NE ARG A 129 2.979 -6.991 -0.734 1.00 0.00 N ATOM 1978 CZ ARG A 129 2.590 -8.243 -0.517 1.00 0.00 C ATOM 1979 NH1 ARG A 129 1.317 -8.511 -0.255 1.00 0.00 N ATOM 1980 NH2 ARG A 129 3.474 -9.231 -0.563 1.00 0.00 N ATOM 0 H ARG A 129 -0.783 -2.027 -2.221 1.00 0.00 H new ATOM 0 HA ARG A 129 1.792 -2.640 -3.409 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.384 -2.689 -1.043 1.00 0.00 H new ATOM 0 HB3 ARG A 129 0.968 -3.648 -0.662 1.00 0.00 H new ATOM 0 HG2 ARG A 129 2.416 -5.068 -2.675 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.584 -4.532 -1.483 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.018 -5.455 0.314 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.071 -6.167 -0.978 1.00 0.00 H new ATOM 0 HE ARG A 129 3.965 -6.821 -0.934 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.633 -7.755 -0.220 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.022 -9.473 -0.089 1.00 0.00 H new ATOM 0 HH21 ARG A 129 4.453 -9.030 -0.765 1.00 0.00 H new ATOM 0 HH22 ARG A 129 3.174 -10.192 -0.396 1.00 0.00 H new ATOM 1994 N LEU A 130 0.801 -4.881 -4.129 1.00 0.00 N ATOM 1995 CA LEU A 130 0.083 -5.973 -4.771 1.00 0.00 C ATOM 1996 C LEU A 130 -0.375 -6.997 -3.740 1.00 0.00 C ATOM 1997 O LEU A 130 0.359 -7.327 -2.808 1.00 0.00 O ATOM 1998 CB LEU A 130 0.962 -6.640 -5.832 1.00 0.00 C ATOM 1999 CG LEU A 130 1.670 -5.674 -6.786 1.00 0.00 C ATOM 2000 CD1 LEU A 130 2.139 -6.407 -8.035 1.00 0.00 C ATOM 2001 CD2 LEU A 130 0.758 -4.513 -7.159 1.00 0.00 C ATOM 0 H LEU A 130 1.791 -4.824 -4.366 1.00 0.00 H new ATOM 0 HA LEU A 130 -0.800 -5.561 -5.260 1.00 0.00 H new ATOM 0 HB2 LEU A 130 1.715 -7.247 -5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 130 0.344 -7.319 -6.419 1.00 0.00 H new ATOM 0 HG LEU A 130 2.542 -5.269 -6.274 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.640 -5.705 -8.702 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.833 -7.199 -7.753 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.280 -6.843 -8.545 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.284 -3.841 -7.837 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -0.137 -4.896 -7.649 1.00 0.00 H new ATOM 0 HD23 LEU A 130 0.474 -3.970 -6.258 1.00 0.00 H new ATOM 2013 N ALA A 131 -1.599 -7.484 -3.908 1.00 0.00 N ATOM 2014 CA ALA A 131 -2.172 -8.463 -2.990 1.00 0.00 C ATOM 2015 C ALA A 131 -1.343 -9.741 -2.944 1.00 0.00 C ATOM 2016 O ALA A 131 -0.229 -9.792 -3.465 1.00 0.00 O ATOM 2017 CB ALA A 131 -3.607 -8.778 -3.388 1.00 0.00 C ATOM 0 H ALA A 131 -2.216 -7.216 -4.674 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.165 -8.028 -1.991 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.024 -9.510 -2.696 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.203 -7.866 -3.354 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -3.623 -9.185 -4.399 1.00 0.00 H new ATOM 2023 N THR A 132 -1.896 -10.774 -2.316 1.00 0.00 N ATOM 2024 CA THR A 132 -1.208 -12.050 -2.199 1.00 0.00 C ATOM 2025 C THR A 132 -1.624 -12.993 -3.324 1.00 0.00 C ATOM 2026 O THR A 132 -0.981 -14.017 -3.562 1.00 0.00 O ATOM 2027 CB THR A 132 -1.501 -12.691 -0.841 1.00 0.00 C ATOM 2028 OG1 THR A 132 -1.260 -11.771 0.208 1.00 0.00 O ATOM 2029 CG2 THR A 132 -0.669 -13.925 -0.567 1.00 0.00 C ATOM 0 H THR A 132 -2.818 -10.750 -1.881 1.00 0.00 H new ATOM 0 HA THR A 132 -0.136 -11.867 -2.279 1.00 0.00 H new ATOM 0 HB THR A 132 -2.551 -12.983 -0.881 1.00 0.00 H new ATOM 0 HG1 THR A 132 -1.298 -12.239 1.068 1.00 0.00 H new ATOM 0 HG21 THR A 132 -0.928 -14.328 0.412 1.00 0.00 H new ATOM 0 HG22 THR A 132 -0.868 -14.675 -1.332 1.00 0.00 H new ATOM 0 HG23 THR A 132 0.389 -13.662 -0.583 1.00 0.00 H new ATOM 2037 N CYS A 133 -2.701 -12.637 -4.018 1.00 0.00 N ATOM 2038 CA CYS A 133 -3.204 -13.447 -5.122 1.00 0.00 C ATOM 2039 C CYS A 133 -2.507 -13.077 -6.427 1.00 0.00 C ATOM 2040 O CYS A 133 -2.183 -11.912 -6.660 1.00 0.00 O ATOM 2041 CB CYS A 133 -4.715 -13.266 -5.268 1.00 0.00 C ATOM 2042 SG CYS A 133 -5.310 -11.598 -4.836 1.00 0.00 S ATOM 0 H CYS A 133 -3.242 -11.792 -3.835 1.00 0.00 H new ATOM 0 HA CYS A 133 -2.991 -14.493 -4.900 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -4.999 -13.486 -6.297 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -5.220 -13.996 -4.635 1.00 0.00 H new ATOM 2047 N THR A 134 -2.281 -14.075 -7.276 1.00 0.00 N ATOM 2048 CA THR A 134 -1.623 -13.854 -8.559 1.00 0.00 C ATOM 2049 C THR A 134 -2.341 -14.607 -9.676 1.00 0.00 C ATOM 2050 O THR A 134 -2.114 -15.800 -9.877 1.00 0.00 O ATOM 2051 CB THR A 134 -0.161 -14.297 -8.487 1.00 0.00 C ATOM 2052 OG1 THR A 134 0.372 -14.063 -7.196 1.00 0.00 O ATOM 2053 CG2 THR A 134 0.729 -13.587 -9.486 1.00 0.00 C ATOM 0 H THR A 134 -2.544 -15.044 -7.099 1.00 0.00 H new ATOM 0 HA THR A 134 -1.662 -12.788 -8.781 1.00 0.00 H new ATOM 0 HB THR A 134 -0.170 -15.361 -8.723 1.00 0.00 H new ATOM 0 HG1 THR A 134 1.307 -14.355 -7.170 1.00 0.00 H new ATOM 0 HG21 THR A 134 1.752 -13.947 -9.382 1.00 0.00 H new ATOM 0 HG22 THR A 134 0.374 -13.788 -10.497 1.00 0.00 H new ATOM 0 HG23 THR A 134 0.702 -12.513 -9.299 1.00 0.00 H new ATOM 2061 N PRO A 135 -3.223 -13.915 -10.423 1.00 0.00 N ATOM 2062 CA PRO A 135 -3.977 -14.526 -11.524 1.00 0.00 C ATOM 2063 C PRO A 135 -3.063 -15.186 -12.555 1.00 0.00 C ATOM 2064 O PRO A 135 -1.965 -14.697 -12.825 1.00 0.00 O ATOM 2065 CB PRO A 135 -4.720 -13.343 -12.152 1.00 0.00 C ATOM 2066 CG PRO A 135 -4.806 -12.326 -11.066 1.00 0.00 C ATOM 2067 CD PRO A 135 -3.555 -12.489 -10.250 1.00 0.00 C ATOM 0 HA PRO A 135 -4.635 -15.321 -11.173 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -4.183 -12.953 -13.017 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -5.711 -13.637 -12.498 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -4.875 -11.319 -11.478 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -5.695 -12.482 -10.454 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.754 -11.843 -10.608 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.722 -12.239 -9.202 1.00 0.00 H new ATOM 2075 N PRO A 136 -3.505 -16.309 -13.147 1.00 0.00 N ATOM 2076 CA PRO A 136 -2.721 -17.034 -14.152 1.00 0.00 C ATOM 2077 C PRO A 136 -2.620 -16.272 -15.469 1.00 0.00 C ATOM 2078 O PRO A 136 -3.553 -16.275 -16.272 1.00 0.00 O ATOM 2079 CB PRO A 136 -3.502 -18.335 -14.345 1.00 0.00 C ATOM 2080 CG PRO A 136 -4.903 -17.993 -13.974 1.00 0.00 C ATOM 2081 CD PRO A 136 -4.803 -16.962 -12.885 1.00 0.00 C ATOM 0 HA PRO A 136 -1.690 -17.185 -13.831 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -3.439 -18.685 -15.375 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -3.108 -19.131 -13.713 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -5.450 -17.602 -14.832 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -5.441 -18.875 -13.628 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -5.627 -16.250 -12.930 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -4.830 -17.419 -11.896 1.00 0.00 H new ATOM 2089 N ALA A 137 -1.483 -15.618 -15.682 1.00 0.00 N ATOM 2090 CA ALA A 137 -1.259 -14.850 -16.901 1.00 0.00 C ATOM 2091 C ALA A 137 -1.037 -15.769 -18.097 1.00 0.00 C ATOM 2092 O ALA A 137 0.006 -16.415 -18.211 1.00 0.00 O ATOM 2093 CB ALA A 137 -0.073 -13.914 -16.726 1.00 0.00 C ATOM 0 H ALA A 137 -0.702 -15.605 -15.026 1.00 0.00 H new ATOM 0 HA ALA A 137 -2.152 -14.255 -17.094 1.00 0.00 H new ATOM 0 HB1 ALA A 137 0.082 -13.347 -17.644 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -0.271 -13.226 -15.904 1.00 0.00 H new ATOM 0 HB3 ALA A 137 0.821 -14.497 -16.504 1.00 0.00 H new ATOM 2099 N SER A 138 -2.024 -15.824 -18.986 1.00 0.00 N ATOM 2100 CA SER A 138 -1.937 -16.665 -20.175 1.00 0.00 C ATOM 2101 C SER A 138 -2.800 -16.105 -21.301 1.00 0.00 C ATOM 2102 O SER A 138 -2.788 -16.622 -22.419 1.00 0.00 O ATOM 2103 CB SER A 138 -2.370 -18.095 -19.846 1.00 0.00 C ATOM 2104 OG SER A 138 -3.773 -18.173 -19.662 1.00 0.00 O ATOM 0 H SER A 138 -2.893 -15.296 -18.906 1.00 0.00 H new ATOM 0 HA SER A 138 -0.899 -16.675 -20.508 1.00 0.00 H new ATOM 0 HB2 SER A 138 -2.068 -18.764 -20.652 1.00 0.00 H new ATOM 0 HB3 SER A 138 -1.862 -18.434 -18.943 1.00 0.00 H new ATOM 0 HG SER A 138 -4.025 -19.097 -19.455 1.00 0.00 H new ATOM 2110 N GLU A 139 -3.545 -15.046 -20.998 1.00 0.00 N ATOM 2111 CA GLU A 139 -4.417 -14.411 -21.982 1.00 0.00 C ATOM 2112 C GLU A 139 -5.395 -15.419 -22.578 1.00 0.00 C ATOM 2113 O GLU A 139 -5.708 -15.367 -23.768 1.00 0.00 O ATOM 2114 CB GLU A 139 -3.583 -13.768 -23.094 1.00 0.00 C ATOM 2115 CG GLU A 139 -3.536 -12.251 -23.018 1.00 0.00 C ATOM 2116 CD GLU A 139 -2.272 -11.740 -22.353 1.00 0.00 C ATOM 2117 OE1 GLU A 139 -1.228 -11.675 -23.035 1.00 0.00 O ATOM 2118 OE2 GLU A 139 -2.327 -11.404 -21.151 1.00 0.00 O ATOM 0 H GLU A 139 -3.562 -14.608 -20.077 1.00 0.00 H new ATOM 0 HA GLU A 139 -4.991 -13.636 -21.474 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -2.566 -14.158 -23.046 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -3.992 -14.063 -24.060 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.605 -11.838 -24.024 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.404 -11.891 -22.465 1.00 0.00 H new ATOM 2125 N GLY A 140 -5.873 -16.336 -21.743 1.00 0.00 N ATOM 2126 CA GLY A 140 -6.811 -17.343 -22.204 1.00 0.00 C ATOM 2127 C GLY A 140 -8.205 -16.785 -22.414 1.00 0.00 C ATOM 2128 O GLY A 140 -8.704 -16.016 -21.591 1.00 0.00 O ATOM 0 H GLY A 140 -5.627 -16.400 -20.755 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -6.450 -17.771 -23.139 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -6.854 -18.155 -21.478 1.00 0.00 H new ATOM 2132 N SER A 141 -8.835 -17.171 -23.518 1.00 0.00 N ATOM 2133 CA SER A 141 -10.180 -16.705 -23.836 1.00 0.00 C ATOM 2134 C SER A 141 -11.213 -17.363 -22.927 1.00 0.00 C ATOM 2135 O SER A 141 -11.149 -18.565 -22.667 1.00 0.00 O ATOM 2136 CB SER A 141 -10.512 -16.999 -25.300 1.00 0.00 C ATOM 2137 OG SER A 141 -10.301 -15.855 -26.110 1.00 0.00 O ATOM 0 H SER A 141 -8.435 -17.806 -24.209 1.00 0.00 H new ATOM 0 HA SER A 141 -10.212 -15.628 -23.673 1.00 0.00 H new ATOM 0 HB2 SER A 141 -9.893 -17.822 -25.658 1.00 0.00 H new ATOM 0 HB3 SER A 141 -11.550 -17.321 -25.383 1.00 0.00 H new ATOM 0 HG SER A 141 -10.518 -16.069 -27.041 1.00 0.00 H new ATOM 2143 N ALA A 142 -12.164 -16.568 -22.446 1.00 0.00 N ATOM 2144 CA ALA A 142 -13.210 -17.073 -21.566 1.00 0.00 C ATOM 2145 C ALA A 142 -14.588 -16.904 -22.198 1.00 0.00 C ATOM 2146 O ALA A 142 -15.327 -17.873 -22.366 1.00 0.00 O ATOM 2147 CB ALA A 142 -13.155 -16.364 -20.221 1.00 0.00 C ATOM 0 H ALA A 142 -12.231 -15.571 -22.652 1.00 0.00 H new ATOM 0 HA ALA A 142 -13.038 -18.138 -21.411 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -13.942 -16.751 -19.573 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -12.184 -16.539 -19.757 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -13.299 -15.294 -20.368 1.00 0.00 H new ATOM 2153 N GLU A 143 -14.925 -15.666 -22.548 1.00 0.00 N ATOM 2154 CA GLU A 143 -16.214 -15.370 -23.163 1.00 0.00 C ATOM 2155 C GLU A 143 -16.224 -15.781 -24.631 1.00 0.00 C ATOM 2156 O GLU A 143 -15.265 -15.433 -25.350 1.00 0.00 O ATOM 2157 CB GLU A 143 -16.532 -13.878 -23.037 1.00 0.00 C ATOM 2158 CG GLU A 143 -17.890 -13.596 -22.416 1.00 0.00 C ATOM 2159 CD GLU A 143 -18.012 -12.174 -21.904 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -17.209 -11.787 -21.029 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -18.911 -11.447 -22.377 1.00 0.00 O ATOM 2162 OXT GLU A 143 -17.193 -16.448 -25.051 1.00 0.00 O ATOM 0 H GLU A 143 -14.324 -14.853 -22.416 1.00 0.00 H new ATOM 0 HA GLU A 143 -16.979 -15.943 -22.639 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -15.760 -13.400 -22.434 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -16.492 -13.422 -24.026 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -18.669 -13.780 -23.156 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -18.061 -14.291 -21.593 1.00 0.00 H new TER 2169 GLU A 143