USER MOD reduce.3.24.130724 H: found=0, std=0, add=1022, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1025 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 91 MET CE :methyl 160:sc= -0.0381 (180deg=0) USER MOD Set 1.2: A 100 ASN : amide:sc= -0.0669 K(o=-0.11,f=-0.78) USER MOD Set 2.1: A 38 CYS SG : rot 92:sc= -0.414 USER MOD Set 2.2: A 79 CYS SG : rot -34:sc= 0.0917 USER MOD Single : A 2 SER OG : rot -38:sc= 0.505 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 158:sc=-0.00226 (180deg=-0.667) USER MOD Single : A 7 HIS : no HE2:sc= -1.57 K(o=-1.6,f=-2.8!) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 10 ASN : amide:sc=-0.00833 X(o=-0.0083,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 16 GLN : amide:sc= 0.681 K(o=0.68,f=-0.29) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.564 X(o=-0.56,f=-0.14) USER MOD Single : A 37 THR OG1 : rot 96:sc= 0.362 USER MOD Single : A 39 MET CE :methyl -172:sc= 0 (180deg=-0.0505) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 MET CE :methyl -178:sc= -3.77! (180deg=-4.35!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -51:sc= 1.31 USER MOD Single : A 51 LYS NZ :NH3+ -131:sc=-0.00828 (180deg=-1.89!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0.015) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.543 K(o=-0.54,f=-1.5) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -178:sc= -1.19 (180deg=-1.21) USER MOD Single : A 87 ASN : amide:sc= -5.9! C(o=-5.9!,f=-5.3!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.955 K(o=-0.95,f=-2.8!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc= -0.152 K(o=-0.15,f=-2!) USER MOD Single : A 101 LYS NZ :NH3+ -167:sc=-0.00112 (180deg=-0.0851) USER MOD Single : A 103 ASN : amide:sc= -2.9 X(o=-2.9,f=-3.1) USER MOD Single : A 106 MET CE :methyl 155:sc= 0 (180deg=-1.17) USER MOD Single : A 109 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.781) USER MOD Single : A 110 GLN : amide:sc= -0.0257 K(o=-0.026,f=-1.6) USER MOD Single : A 112 MET CE :methyl -145:sc= -3.87! (180deg=-4.03!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.0527 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -10.542 9.122 -15.762 1.00 0.00 N ATOM 2 CA SER A 2 -9.152 8.870 -15.303 1.00 0.00 C ATOM 3 C SER A 2 -9.103 8.646 -13.794 1.00 0.00 C ATOM 4 O SER A 2 -9.330 9.569 -13.013 1.00 0.00 O ATOM 5 CB SER A 2 -8.286 10.071 -15.687 1.00 0.00 C ATOM 6 OG SER A 2 -9.000 11.285 -15.531 1.00 0.00 O ATOM 0 HA SER A 2 -8.775 7.967 -15.782 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.390 10.090 -15.067 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.956 9.970 -16.721 1.00 0.00 H new ATOM 0 HG SER A 2 -9.932 11.154 -15.804 1.00 0.00 H new ATOM 14 N TYR A 3 -8.805 7.414 -13.394 1.00 0.00 N ATOM 15 CA TYR A 3 -8.726 7.070 -11.979 1.00 0.00 C ATOM 16 C TYR A 3 -7.359 7.432 -11.407 1.00 0.00 C ATOM 17 O TYR A 3 -6.382 6.709 -11.602 1.00 0.00 O ATOM 18 CB TYR A 3 -8.995 5.577 -11.780 1.00 0.00 C ATOM 19 CG TYR A 3 -10.453 5.251 -11.544 1.00 0.00 C ATOM 20 CD1 TYR A 3 -11.414 5.546 -12.502 1.00 0.00 C ATOM 21 CD2 TYR A 3 -10.867 4.646 -10.364 1.00 0.00 C ATOM 22 CE1 TYR A 3 -12.747 5.249 -12.290 1.00 0.00 C ATOM 23 CE2 TYR A 3 -12.198 4.346 -10.144 1.00 0.00 C ATOM 24 CZ TYR A 3 -13.133 4.650 -11.110 1.00 0.00 C ATOM 25 OH TYR A 3 -14.460 4.353 -10.895 1.00 0.00 O ATOM 0 H TYR A 3 -8.615 6.638 -14.029 1.00 0.00 H new ATOM 0 HA TYR A 3 -9.486 7.643 -11.448 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -8.647 5.033 -12.658 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -8.410 5.221 -10.932 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -11.115 6.015 -13.428 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -10.136 4.406 -9.606 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -13.482 5.485 -13.045 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -12.504 3.876 -9.221 1.00 0.00 H new ATOM 0 HH TYR A 3 -14.563 3.933 -10.016 1.00 0.00 H new ATOM 35 N MET A 4 -7.298 8.555 -10.699 1.00 0.00 N ATOM 36 CA MET A 4 -6.052 9.014 -10.098 1.00 0.00 C ATOM 37 C MET A 4 -5.847 8.385 -8.723 1.00 0.00 C ATOM 38 O MET A 4 -6.739 8.417 -7.876 1.00 0.00 O ATOM 39 CB MET A 4 -6.049 10.539 -9.979 1.00 0.00 C ATOM 40 CG MET A 4 -4.723 11.110 -9.505 1.00 0.00 C ATOM 41 SD MET A 4 -4.395 12.753 -10.172 1.00 0.00 S ATOM 42 CE MET A 4 -5.985 13.540 -9.928 1.00 0.00 C ATOM 0 H MET A 4 -8.098 9.164 -10.528 1.00 0.00 H new ATOM 0 HA MET A 4 -5.231 8.706 -10.745 1.00 0.00 H new ATOM 0 HB2 MET A 4 -6.295 10.971 -10.949 1.00 0.00 H new ATOM 0 HB3 MET A 4 -6.834 10.843 -9.286 1.00 0.00 H new ATOM 0 HG2 MET A 4 -4.721 11.157 -8.416 1.00 0.00 H new ATOM 0 HG3 MET A 4 -3.917 10.436 -9.796 1.00 0.00 H new ATOM 0 HE1 MET A 4 -5.857 14.622 -9.914 1.00 0.00 H new ATOM 0 HE2 MET A 4 -6.656 13.265 -10.742 1.00 0.00 H new ATOM 0 HE3 MET A 4 -6.411 13.213 -8.980 1.00 0.00 H new ATOM 52 N LEU A 5 -4.666 7.813 -8.510 1.00 0.00 N ATOM 53 CA LEU A 5 -4.337 7.172 -7.244 1.00 0.00 C ATOM 54 C LEU A 5 -4.654 8.088 -6.060 1.00 0.00 C ATOM 55 O LEU A 5 -3.940 9.059 -5.811 1.00 0.00 O ATOM 56 CB LEU A 5 -2.858 6.783 -7.218 1.00 0.00 C ATOM 57 CG LEU A 5 -2.556 5.354 -7.673 1.00 0.00 C ATOM 58 CD1 LEU A 5 -2.437 5.290 -9.190 1.00 0.00 C ATOM 59 CD2 LEU A 5 -1.285 4.842 -7.011 1.00 0.00 C ATOM 0 H LEU A 5 -3.918 7.781 -9.203 1.00 0.00 H new ATOM 0 HA LEU A 5 -4.948 6.274 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -2.305 7.475 -7.853 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -2.482 6.912 -6.203 1.00 0.00 H new ATOM 0 HG LEU A 5 -3.383 4.712 -7.369 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.222 4.266 -9.495 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.374 5.614 -9.642 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -1.630 5.944 -9.520 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.085 3.824 -7.346 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.448 5.485 -7.284 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -1.410 4.850 -5.928 1.00 0.00 H new ATOM 71 N PRO A 6 -5.734 7.794 -5.312 1.00 0.00 N ATOM 72 CA PRO A 6 -6.134 8.602 -4.155 1.00 0.00 C ATOM 73 C PRO A 6 -5.174 8.446 -2.979 1.00 0.00 C ATOM 74 O PRO A 6 -4.681 7.351 -2.708 1.00 0.00 O ATOM 75 CB PRO A 6 -7.513 8.047 -3.794 1.00 0.00 C ATOM 76 CG PRO A 6 -7.499 6.645 -4.294 1.00 0.00 C ATOM 77 CD PRO A 6 -6.646 6.656 -5.533 1.00 0.00 C ATOM 0 HA PRO A 6 -6.134 9.668 -4.384 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -7.685 8.082 -2.718 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -8.308 8.627 -4.263 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -7.090 5.967 -3.545 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -8.509 6.300 -4.518 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -6.099 5.721 -5.652 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -7.246 6.791 -6.433 1.00 0.00 H new ATOM 85 N HIS A 7 -4.911 9.550 -2.287 1.00 0.00 N ATOM 86 CA HIS A 7 -4.010 9.538 -1.140 1.00 0.00 C ATOM 87 C HIS A 7 -4.781 9.750 0.160 1.00 0.00 C ATOM 88 O HIS A 7 -6.011 9.774 0.166 1.00 0.00 O ATOM 89 CB HIS A 7 -2.940 10.621 -1.296 1.00 0.00 C ATOM 90 CG HIS A 7 -3.492 12.012 -1.306 1.00 0.00 C ATOM 91 ND1 HIS A 7 -2.707 13.133 -1.480 1.00 0.00 N ATOM 92 CD2 HIS A 7 -4.760 12.463 -1.160 1.00 0.00 C ATOM 93 CE1 HIS A 7 -3.469 14.213 -1.441 1.00 0.00 C ATOM 94 NE2 HIS A 7 -4.718 13.833 -1.249 1.00 0.00 N ATOM 0 H HIS A 7 -5.309 10.464 -2.501 1.00 0.00 H new ATOM 0 HA HIS A 7 -3.526 8.562 -1.098 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -2.222 10.530 -0.481 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -2.394 10.449 -2.223 1.00 0.00 H new ATOM 0 HD1 HIS A 7 -1.696 13.129 -1.617 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -5.641 11.858 -1.003 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -3.127 15.232 -1.548 1.00 0.00 H new ATOM 103 N LEU A 8 -4.049 9.905 1.259 1.00 0.00 N ATOM 104 CA LEU A 8 -4.663 10.115 2.565 1.00 0.00 C ATOM 105 C LEU A 8 -4.823 11.605 2.853 1.00 0.00 C ATOM 106 O LEU A 8 -4.535 12.447 2.002 1.00 0.00 O ATOM 107 CB LEU A 8 -3.820 9.457 3.660 1.00 0.00 C ATOM 108 CG LEU A 8 -4.267 8.051 4.064 1.00 0.00 C ATOM 109 CD1 LEU A 8 -4.180 7.103 2.878 1.00 0.00 C ATOM 110 CD2 LEU A 8 -3.426 7.538 5.222 1.00 0.00 C ATOM 0 H LEU A 8 -3.029 9.889 1.271 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.652 9.656 2.555 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.785 9.409 3.321 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.837 10.095 4.543 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.306 8.099 4.389 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.502 6.107 3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.825 7.463 2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.151 7.058 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.757 6.537 5.497 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.378 7.504 4.924 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.539 8.205 6.077 1.00 0.00 H new ATOM 122 N HIS A 9 -5.283 11.923 4.059 1.00 0.00 N ATOM 123 CA HIS A 9 -5.480 13.312 4.458 1.00 0.00 C ATOM 124 C HIS A 9 -5.870 13.408 5.929 1.00 0.00 C ATOM 125 O HIS A 9 -5.328 14.224 6.674 1.00 0.00 O ATOM 126 CB HIS A 9 -6.556 13.966 3.589 1.00 0.00 C ATOM 127 CG HIS A 9 -6.293 15.412 3.298 1.00 0.00 C ATOM 128 ND1 HIS A 9 -6.260 15.928 2.020 1.00 0.00 N ATOM 129 CD2 HIS A 9 -6.050 16.453 4.130 1.00 0.00 C ATOM 130 CE1 HIS A 9 -6.007 17.224 2.078 1.00 0.00 C ATOM 131 NE2 HIS A 9 -5.877 17.567 3.346 1.00 0.00 N ATOM 0 H HIS A 9 -5.526 11.239 4.776 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.537 13.841 4.317 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -6.631 13.422 2.647 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -7.520 13.874 4.088 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -6.001 16.414 5.208 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -5.921 17.889 1.232 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -5.680 18.507 3.688 1.00 0.00 H new ATOM 140 N ASN A 10 -6.817 12.570 6.342 1.00 0.00 N ATOM 141 CA ASN A 10 -7.279 12.563 7.725 1.00 0.00 C ATOM 142 C ASN A 10 -7.433 11.136 8.241 1.00 0.00 C ATOM 143 O ASN A 10 -7.651 10.205 7.467 1.00 0.00 O ATOM 144 CB ASN A 10 -8.612 13.306 7.842 1.00 0.00 C ATOM 145 CG ASN A 10 -8.446 14.809 7.744 1.00 0.00 C ATOM 146 OD1 ASN A 10 -8.891 15.433 6.780 1.00 0.00 O ATOM 147 ND2 ASN A 10 -7.801 15.401 8.744 1.00 0.00 N ATOM 0 H ASN A 10 -7.278 11.889 5.739 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.531 13.071 8.334 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -9.285 12.965 7.055 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -9.082 13.056 8.793 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -7.658 16.411 8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -7.449 14.845 9.524 1.00 0.00 H new ATOM 154 N GLY A 11 -7.318 10.973 9.556 1.00 0.00 N ATOM 155 CA GLY A 11 -7.447 9.658 10.157 1.00 0.00 C ATOM 156 C GLY A 11 -8.769 8.991 9.825 1.00 0.00 C ATOM 157 O GLY A 11 -8.866 7.765 9.812 1.00 0.00 O ATOM 0 H GLY A 11 -7.138 11.729 10.216 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.629 9.024 9.815 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -7.351 9.746 11.239 1.00 0.00 H new ATOM 161 N TRP A 12 -9.787 9.801 9.557 1.00 0.00 N ATOM 162 CA TRP A 12 -11.109 9.282 9.224 1.00 0.00 C ATOM 163 C TRP A 12 -11.051 8.398 7.982 1.00 0.00 C ATOM 164 O TRP A 12 -11.784 7.416 7.873 1.00 0.00 O ATOM 165 CB TRP A 12 -12.090 10.433 8.998 1.00 0.00 C ATOM 166 CG TRP A 12 -12.566 11.067 10.271 1.00 0.00 C ATOM 167 CD1 TRP A 12 -13.367 10.499 11.219 1.00 0.00 C ATOM 168 CD2 TRP A 12 -12.270 12.390 10.732 1.00 0.00 C ATOM 169 NE1 TRP A 12 -13.587 11.388 12.243 1.00 0.00 N ATOM 170 CE2 TRP A 12 -12.925 12.556 11.968 1.00 0.00 C ATOM 171 CE3 TRP A 12 -11.515 13.450 10.222 1.00 0.00 C ATOM 172 CZ2 TRP A 12 -12.847 13.739 12.699 1.00 0.00 C ATOM 173 CZ3 TRP A 12 -11.438 14.623 10.949 1.00 0.00 C ATOM 174 CH2 TRP A 12 -12.101 14.760 12.175 1.00 0.00 C ATOM 0 H TRP A 12 -9.723 10.819 9.564 1.00 0.00 H new ATOM 0 HA TRP A 12 -11.455 8.677 10.062 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -11.612 11.192 8.379 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -12.951 10.063 8.441 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -13.769 9.498 11.171 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -14.151 11.208 13.073 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -11.001 13.354 9.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -13.357 13.847 13.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -10.857 15.448 10.565 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -12.022 15.690 12.718 1.00 0.00 H new ATOM 185 N GLN A 13 -10.173 8.754 7.050 1.00 0.00 N ATOM 186 CA GLN A 13 -10.019 7.992 5.817 1.00 0.00 C ATOM 187 C GLN A 13 -8.969 6.897 5.980 1.00 0.00 C ATOM 188 O GLN A 13 -9.088 5.818 5.400 1.00 0.00 O ATOM 189 CB GLN A 13 -9.628 8.920 4.665 1.00 0.00 C ATOM 190 CG GLN A 13 -10.485 10.172 4.574 1.00 0.00 C ATOM 191 CD GLN A 13 -10.691 10.635 3.146 1.00 0.00 C ATOM 192 OE1 GLN A 13 -11.284 9.927 2.330 1.00 0.00 O ATOM 193 NE2 GLN A 13 -10.200 11.829 2.834 1.00 0.00 N ATOM 0 H GLN A 13 -9.558 9.564 7.125 1.00 0.00 H new ATOM 0 HA GLN A 13 -10.976 7.522 5.589 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -8.584 9.212 4.783 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -9.701 8.371 3.726 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -11.455 9.978 5.033 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -10.016 10.972 5.147 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.716 12.382 3.541 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -10.307 12.193 1.887 1.00 0.00 H new ATOM 202 N VAL A 14 -7.943 7.182 6.774 1.00 0.00 N ATOM 203 CA VAL A 14 -6.872 6.222 7.014 1.00 0.00 C ATOM 204 C VAL A 14 -7.413 4.942 7.644 1.00 0.00 C ATOM 205 O VAL A 14 -6.957 3.843 7.329 1.00 0.00 O ATOM 206 CB VAL A 14 -5.783 6.812 7.931 1.00 0.00 C ATOM 207 CG1 VAL A 14 -4.596 5.866 8.029 1.00 0.00 C ATOM 208 CG2 VAL A 14 -5.346 8.179 7.427 1.00 0.00 C ATOM 0 H VAL A 14 -7.830 8.070 7.263 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.432 5.989 6.044 1.00 0.00 H new ATOM 0 HB VAL A 14 -6.201 6.935 8.930 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.838 6.300 8.681 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.924 4.911 8.440 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.174 5.708 7.037 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.577 8.581 8.086 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.945 8.084 6.418 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -6.202 8.853 7.415 1.00 0.00 H new ATOM 218 N ASP A 15 -8.387 5.093 8.536 1.00 0.00 N ATOM 219 CA ASP A 15 -8.987 3.948 9.210 1.00 0.00 C ATOM 220 C ASP A 15 -10.181 3.416 8.423 1.00 0.00 C ATOM 221 O ASP A 15 -10.323 2.209 8.233 1.00 0.00 O ATOM 222 CB ASP A 15 -9.427 4.335 10.624 1.00 0.00 C ATOM 223 CG ASP A 15 -9.216 3.215 11.622 1.00 0.00 C ATOM 224 OD1 ASP A 15 -8.069 2.738 11.746 1.00 0.00 O ATOM 225 OD2 ASP A 15 -10.198 2.815 12.282 1.00 0.00 O ATOM 0 H ASP A 15 -8.777 5.995 8.808 1.00 0.00 H new ATOM 0 HA ASP A 15 -8.235 3.161 9.272 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -8.870 5.215 10.947 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -10.481 4.612 10.610 1.00 0.00 H new ATOM 230 N GLN A 16 -11.036 4.326 7.968 1.00 0.00 N ATOM 231 CA GLN A 16 -12.218 3.949 7.202 1.00 0.00 C ATOM 232 C GLN A 16 -11.836 3.160 5.952 1.00 0.00 C ATOM 233 O GLN A 16 -12.620 2.353 5.453 1.00 0.00 O ATOM 234 CB GLN A 16 -13.014 5.195 6.808 1.00 0.00 C ATOM 235 CG GLN A 16 -14.297 4.884 6.053 1.00 0.00 C ATOM 236 CD GLN A 16 -14.161 5.103 4.559 1.00 0.00 C ATOM 237 OE1 GLN A 16 -14.338 6.215 4.063 1.00 0.00 O ATOM 238 NE2 GLN A 16 -13.845 4.038 3.831 1.00 0.00 N ATOM 0 H GLN A 16 -10.932 5.330 8.117 1.00 0.00 H new ATOM 0 HA GLN A 16 -12.837 3.312 7.833 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -13.259 5.759 7.708 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.386 5.837 6.191 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -14.583 3.849 6.240 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -15.101 5.511 6.437 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -13.707 3.134 4.283 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -13.740 4.124 2.820 1.00 0.00 H new ATOM 247 N ALA A 17 -10.629 3.400 5.450 1.00 0.00 N ATOM 248 CA ALA A 17 -10.147 2.712 4.258 1.00 0.00 C ATOM 249 C ALA A 17 -9.422 1.420 4.620 1.00 0.00 C ATOM 250 O ALA A 17 -9.703 0.361 4.060 1.00 0.00 O ATOM 251 CB ALA A 17 -9.231 3.625 3.456 1.00 0.00 C ATOM 0 H ALA A 17 -9.967 4.065 5.850 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.011 2.452 3.647 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.878 3.099 2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -9.780 4.517 3.154 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -8.378 3.914 4.069 1.00 0.00 H new ATOM 257 N ILE A 18 -8.486 1.514 5.559 1.00 0.00 N ATOM 258 CA ILE A 18 -7.719 0.353 5.993 1.00 0.00 C ATOM 259 C ILE A 18 -8.558 -0.566 6.875 1.00 0.00 C ATOM 260 O ILE A 18 -8.760 -1.736 6.553 1.00 0.00 O ATOM 261 CB ILE A 18 -6.453 0.771 6.765 1.00 0.00 C ATOM 262 CG1 ILE A 18 -5.667 1.817 5.970 1.00 0.00 C ATOM 263 CG2 ILE A 18 -5.584 -0.442 7.058 1.00 0.00 C ATOM 264 CD1 ILE A 18 -4.610 2.528 6.788 1.00 0.00 C ATOM 0 H ILE A 18 -8.241 2.383 6.034 1.00 0.00 H new ATOM 0 HA ILE A 18 -7.425 -0.184 5.091 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.755 1.213 7.714 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.191 1.332 5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -6.362 2.555 5.569 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.694 -0.129 7.604 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -6.146 -1.156 7.660 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.288 -0.912 6.120 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.093 3.255 6.161 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -5.082 3.042 7.625 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -3.893 1.800 7.167 1.00 0.00 H new ATOM 276 N LEU A 19 -9.043 -0.029 7.990 1.00 0.00 N ATOM 277 CA LEU A 19 -9.860 -0.802 8.920 1.00 0.00 C ATOM 278 C LEU A 19 -11.091 -1.374 8.225 1.00 0.00 C ATOM 279 O LEU A 19 -11.332 -2.580 8.260 1.00 0.00 O ATOM 280 CB LEU A 19 -10.287 0.069 10.103 1.00 0.00 C ATOM 281 CG LEU A 19 -10.835 -0.698 11.308 1.00 0.00 C ATOM 282 CD1 LEU A 19 -9.709 -1.071 12.259 1.00 0.00 C ATOM 283 CD2 LEU A 19 -11.893 0.127 12.026 1.00 0.00 C ATOM 0 H LEU A 19 -8.885 0.938 8.272 1.00 0.00 H new ATOM 0 HA LEU A 19 -9.256 -1.632 9.287 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -9.430 0.660 10.427 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -11.048 0.771 9.762 1.00 0.00 H new ATOM 0 HG LEU A 19 -11.300 -1.617 10.951 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -10.117 -1.616 13.110 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -8.986 -1.699 11.739 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -9.215 -0.165 12.611 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -12.273 -0.433 12.881 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -11.453 1.062 12.371 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -12.713 0.343 11.341 1.00 0.00 H new ATOM 295 N SER A 20 -11.868 -0.499 7.594 1.00 0.00 N ATOM 296 CA SER A 20 -13.076 -0.918 6.892 1.00 0.00 C ATOM 297 C SER A 20 -12.770 -1.260 5.437 1.00 0.00 C ATOM 298 O SER A 20 -13.331 -0.664 4.516 1.00 0.00 O ATOM 299 CB SER A 20 -14.137 0.183 6.961 1.00 0.00 C ATOM 300 OG SER A 20 -15.436 -0.368 7.089 1.00 0.00 O ATOM 0 H SER A 20 -11.683 0.503 7.554 1.00 0.00 H new ATOM 0 HA SER A 20 -13.460 -1.813 7.381 1.00 0.00 H new ATOM 0 HB2 SER A 20 -13.931 0.838 7.808 1.00 0.00 H new ATOM 0 HB3 SER A 20 -14.086 0.798 6.063 1.00 0.00 H new ATOM 0 HG SER A 20 -16.095 0.356 7.133 1.00 0.00 H new ATOM 306 N GLU A 21 -11.878 -2.225 5.235 1.00 0.00 N ATOM 307 CA GLU A 21 -11.499 -2.647 3.890 1.00 0.00 C ATOM 308 C GLU A 21 -12.722 -3.075 3.085 1.00 0.00 C ATOM 309 O GLU A 21 -12.949 -2.588 1.977 1.00 0.00 O ATOM 310 CB GLU A 21 -10.486 -3.795 3.955 1.00 0.00 C ATOM 311 CG GLU A 21 -10.905 -4.932 4.873 1.00 0.00 C ATOM 312 CD GLU A 21 -11.533 -6.088 4.120 1.00 0.00 C ATOM 313 OE1 GLU A 21 -10.996 -6.465 3.058 1.00 0.00 O ATOM 314 OE2 GLU A 21 -12.561 -6.616 4.594 1.00 0.00 O ATOM 0 H GLU A 21 -11.404 -2.729 5.985 1.00 0.00 H new ATOM 0 HA GLU A 21 -11.039 -1.796 3.389 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.333 -4.189 2.950 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.527 -3.402 4.293 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.034 -5.291 5.422 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.614 -4.556 5.611 1.00 0.00 H new ATOM 321 N GLU A 22 -13.511 -3.985 3.650 1.00 0.00 N ATOM 322 CA GLU A 22 -14.716 -4.478 2.987 1.00 0.00 C ATOM 323 C GLU A 22 -14.436 -4.852 1.534 1.00 0.00 C ATOM 324 O GLU A 22 -15.320 -4.771 0.681 1.00 0.00 O ATOM 325 CB GLU A 22 -15.823 -3.422 3.048 1.00 0.00 C ATOM 326 CG GLU A 22 -17.213 -4.008 3.241 1.00 0.00 C ATOM 327 CD GLU A 22 -18.086 -3.858 2.010 1.00 0.00 C ATOM 328 OE1 GLU A 22 -17.532 -3.648 0.911 1.00 0.00 O ATOM 329 OE2 GLU A 22 -19.324 -3.951 2.147 1.00 0.00 O ATOM 0 H GLU A 22 -13.338 -4.397 4.567 1.00 0.00 H new ATOM 0 HA GLU A 22 -15.043 -5.375 3.513 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -15.612 -2.733 3.866 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -15.808 -2.839 2.127 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -17.126 -5.065 3.493 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.696 -3.517 4.086 1.00 0.00 H new ATOM 336 N ASP A 23 -13.202 -5.261 1.259 1.00 0.00 N ATOM 337 CA ASP A 23 -12.810 -5.645 -0.092 1.00 0.00 C ATOM 338 C ASP A 23 -11.933 -6.891 -0.075 1.00 0.00 C ATOM 339 O ASP A 23 -12.400 -7.995 -0.359 1.00 0.00 O ATOM 340 CB ASP A 23 -12.074 -4.491 -0.778 1.00 0.00 C ATOM 341 CG ASP A 23 -12.970 -3.291 -1.012 1.00 0.00 C ATOM 342 OD1 ASP A 23 -14.187 -3.490 -1.211 1.00 0.00 O ATOM 343 OD2 ASP A 23 -12.456 -2.153 -0.993 1.00 0.00 O ATOM 0 H ASP A 23 -12.457 -5.335 1.952 1.00 0.00 H new ATOM 0 HA ASP A 23 -13.715 -5.874 -0.655 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.223 -4.192 -0.166 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -11.675 -4.835 -1.732 1.00 0.00 H new ATOM 348 N ARG A 24 -10.663 -6.708 0.259 1.00 0.00 N ATOM 349 CA ARG A 24 -9.717 -7.818 0.313 1.00 0.00 C ATOM 350 C ARG A 24 -8.351 -7.351 0.796 1.00 0.00 C ATOM 351 O ARG A 24 -7.803 -7.885 1.760 1.00 0.00 O ATOM 352 CB ARG A 24 -9.583 -8.470 -1.066 1.00 0.00 C ATOM 353 CG ARG A 24 -8.862 -9.808 -1.040 1.00 0.00 C ATOM 354 CD ARG A 24 -8.481 -10.262 -2.441 1.00 0.00 C ATOM 355 NE ARG A 24 -7.275 -9.591 -2.923 1.00 0.00 N ATOM 356 CZ ARG A 24 -7.031 -9.323 -4.204 1.00 0.00 C ATOM 357 NH1 ARG A 24 -7.898 -9.678 -5.145 1.00 0.00 N ATOM 358 NH2 ARG A 24 -5.911 -8.701 -4.546 1.00 0.00 N ATOM 0 H ARG A 24 -10.262 -5.801 0.497 1.00 0.00 H new ATOM 0 HA ARG A 24 -10.102 -8.551 1.022 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -10.577 -8.611 -1.490 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -9.047 -7.791 -1.729 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.965 -9.728 -0.426 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -9.501 -10.558 -0.574 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.321 -11.340 -2.442 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.306 -10.061 -3.125 1.00 0.00 H new ATOM 0 HE ARG A 24 -6.577 -9.311 -2.235 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -8.760 -10.160 -4.889 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -7.702 -9.468 -6.124 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -5.239 -8.429 -3.828 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.721 -8.494 -5.527 1.00 0.00 H new ATOM 372 N VAL A 25 -7.810 -6.356 0.113 1.00 0.00 N ATOM 373 CA VAL A 25 -6.502 -5.809 0.457 1.00 0.00 C ATOM 374 C VAL A 25 -6.532 -4.283 0.479 1.00 0.00 C ATOM 375 O VAL A 25 -7.449 -3.661 -0.054 1.00 0.00 O ATOM 376 CB VAL A 25 -5.424 -6.281 -0.539 1.00 0.00 C ATOM 377 CG1 VAL A 25 -4.042 -5.819 -0.102 1.00 0.00 C ATOM 378 CG2 VAL A 25 -5.462 -7.793 -0.687 1.00 0.00 C ATOM 0 H VAL A 25 -8.256 -5.907 -0.687 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.253 -6.175 1.453 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.638 -5.834 -1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.299 -6.164 -0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.021 -4.730 -0.053 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.815 -6.231 0.881 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.695 -8.109 -1.394 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.277 -8.258 0.281 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.442 -8.098 -1.055 1.00 0.00 H new ATOM 388 N VAL A 26 -5.518 -3.688 1.100 1.00 0.00 N ATOM 389 CA VAL A 26 -5.415 -2.253 1.195 1.00 0.00 C ATOM 390 C VAL A 26 -3.956 -1.817 1.291 1.00 0.00 C ATOM 391 O VAL A 26 -3.267 -2.137 2.259 1.00 0.00 O ATOM 392 CB VAL A 26 -6.186 -1.702 2.408 1.00 0.00 C ATOM 393 CG1 VAL A 26 -6.395 -0.202 2.278 1.00 0.00 C ATOM 394 CG2 VAL A 26 -7.514 -2.425 2.577 1.00 0.00 C ATOM 0 H VAL A 26 -4.752 -4.193 1.547 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.859 -1.846 0.287 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.589 -1.882 3.302 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.942 0.166 3.146 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.427 0.297 2.221 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.966 0.009 1.374 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.042 -2.019 3.440 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.121 -2.286 1.682 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.332 -3.489 2.730 1.00 0.00 H new ATOM 404 N VAL A 27 -3.492 -1.091 0.280 1.00 0.00 N ATOM 405 CA VAL A 27 -2.113 -0.617 0.253 1.00 0.00 C ATOM 406 C VAL A 27 -2.024 0.839 0.703 1.00 0.00 C ATOM 407 O VAL A 27 -2.948 1.622 0.489 1.00 0.00 O ATOM 408 CB VAL A 27 -1.503 -0.755 -1.158 1.00 0.00 C ATOM 409 CG1 VAL A 27 -0.071 -0.240 -1.182 1.00 0.00 C ATOM 410 CG2 VAL A 27 -1.564 -2.201 -1.624 1.00 0.00 C ATOM 0 H VAL A 27 -4.049 -0.818 -0.530 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.546 -1.239 0.946 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.090 -0.147 -1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.338 -0.348 -2.187 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.058 0.812 -0.896 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.534 -0.815 -0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.130 -2.281 -2.621 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.003 -2.830 -0.933 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.603 -2.530 -1.653 1.00 0.00 H new ATOM 420 N ILE A 28 -0.904 1.190 1.328 1.00 0.00 N ATOM 421 CA ILE A 28 -0.692 2.551 1.810 1.00 0.00 C ATOM 422 C ILE A 28 0.750 2.991 1.590 1.00 0.00 C ATOM 423 O ILE A 28 1.678 2.418 2.161 1.00 0.00 O ATOM 424 CB ILE A 28 -1.032 2.677 3.307 1.00 0.00 C ATOM 425 CG1 ILE A 28 -2.381 2.020 3.605 1.00 0.00 C ATOM 426 CG2 ILE A 28 -1.044 4.139 3.726 1.00 0.00 C ATOM 427 CD1 ILE A 28 -2.273 0.554 3.961 1.00 0.00 C ATOM 0 H ILE A 28 -0.130 0.552 1.512 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.359 3.197 1.239 1.00 0.00 H new ATOM 0 HB ILE A 28 -0.264 2.160 3.883 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.861 2.551 4.427 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.029 2.128 2.735 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.286 4.212 4.786 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.062 4.577 3.547 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.793 4.678 3.145 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -3.267 0.154 4.160 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.822 0.010 3.131 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.652 0.440 4.849 1.00 0.00 H new ATOM 439 N ARG A 29 0.933 4.010 0.756 1.00 0.00 N ATOM 440 CA ARG A 29 2.266 4.524 0.462 1.00 0.00 C ATOM 441 C ARG A 29 2.539 5.814 1.228 1.00 0.00 C ATOM 442 O ARG A 29 1.662 6.668 1.358 1.00 0.00 O ATOM 443 CB ARG A 29 2.420 4.768 -1.041 1.00 0.00 C ATOM 444 CG ARG A 29 3.801 5.263 -1.437 1.00 0.00 C ATOM 445 CD ARG A 29 4.182 4.801 -2.835 1.00 0.00 C ATOM 446 NE ARG A 29 3.121 5.053 -3.807 1.00 0.00 N ATOM 447 CZ ARG A 29 2.226 4.143 -4.192 1.00 0.00 C ATOM 448 NH1 ARG A 29 2.248 2.915 -3.684 1.00 0.00 N ATOM 449 NH2 ARG A 29 1.303 4.462 -5.087 1.00 0.00 N ATOM 0 H ARG A 29 0.177 4.495 0.273 1.00 0.00 H new ATOM 0 HA ARG A 29 2.992 3.776 0.781 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.208 3.842 -1.575 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.676 5.498 -1.361 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.824 6.352 -1.394 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.538 4.900 -0.720 1.00 0.00 H new ATOM 0 HD2 ARG A 29 5.091 5.314 -3.150 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.408 3.735 -2.815 1.00 0.00 H new ATOM 0 HE ARG A 29 3.061 5.985 -4.217 1.00 0.00 H new ATOM 0 HH11 ARG A 29 2.954 2.662 -2.993 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.559 2.226 -3.985 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.278 5.403 -5.481 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.618 3.767 -5.383 1.00 0.00 H new ATOM 463 N PHE A 30 3.760 5.947 1.735 1.00 0.00 N ATOM 464 CA PHE A 30 4.151 7.133 2.489 1.00 0.00 C ATOM 465 C PHE A 30 5.115 7.998 1.684 1.00 0.00 C ATOM 466 O PHE A 30 5.898 7.490 0.882 1.00 0.00 O ATOM 467 CB PHE A 30 4.797 6.730 3.816 1.00 0.00 C ATOM 468 CG PHE A 30 3.807 6.524 4.928 1.00 0.00 C ATOM 469 CD1 PHE A 30 2.676 5.746 4.730 1.00 0.00 C ATOM 470 CD2 PHE A 30 4.006 7.106 6.168 1.00 0.00 C ATOM 471 CE1 PHE A 30 1.764 5.555 5.750 1.00 0.00 C ATOM 472 CE2 PHE A 30 3.098 6.919 7.192 1.00 0.00 C ATOM 473 CZ PHE A 30 1.974 6.143 6.982 1.00 0.00 C ATOM 0 H PHE A 30 4.496 5.248 1.638 1.00 0.00 H new ATOM 0 HA PHE A 30 3.252 7.715 2.692 1.00 0.00 H new ATOM 0 HB2 PHE A 30 5.364 5.810 3.670 1.00 0.00 H new ATOM 0 HB3 PHE A 30 5.509 7.500 4.113 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.506 5.285 3.768 1.00 0.00 H new ATOM 0 HD2 PHE A 30 4.882 7.714 6.337 1.00 0.00 H new ATOM 0 HE1 PHE A 30 0.887 4.946 5.584 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.266 7.378 8.155 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.261 5.997 7.780 1.00 0.00 H new ATOM 483 N GLY A 31 5.051 9.307 1.902 1.00 0.00 N ATOM 484 CA GLY A 31 5.922 10.221 1.189 1.00 0.00 C ATOM 485 C GLY A 31 5.194 10.983 0.099 1.00 0.00 C ATOM 486 O GLY A 31 3.979 10.854 -0.051 1.00 0.00 O ATOM 0 H GLY A 31 4.411 9.751 2.560 1.00 0.00 H new ATOM 0 HA2 GLY A 31 6.357 10.929 1.895 1.00 0.00 H new ATOM 0 HA3 GLY A 31 6.748 9.662 0.748 1.00 0.00 H new ATOM 490 N HIS A 32 5.937 11.778 -0.662 1.00 0.00 N ATOM 491 CA HIS A 32 5.355 12.564 -1.744 1.00 0.00 C ATOM 492 C HIS A 32 5.364 11.779 -3.051 1.00 0.00 C ATOM 493 O HIS A 32 6.051 10.765 -3.174 1.00 0.00 O ATOM 494 CB HIS A 32 6.119 13.877 -1.917 1.00 0.00 C ATOM 495 CG HIS A 32 5.242 15.037 -2.276 1.00 0.00 C ATOM 496 ND1 HIS A 32 5.732 16.298 -2.542 1.00 0.00 N ATOM 497 CD2 HIS A 32 3.897 15.121 -2.411 1.00 0.00 C ATOM 498 CE1 HIS A 32 4.728 17.108 -2.825 1.00 0.00 C ATOM 499 NE2 HIS A 32 3.604 16.418 -2.753 1.00 0.00 N ATOM 0 H HIS A 32 6.944 11.896 -0.550 1.00 0.00 H new ATOM 0 HA HIS A 32 4.321 12.787 -1.483 1.00 0.00 H new ATOM 0 HB2 HIS A 32 6.648 14.105 -0.992 1.00 0.00 H new ATOM 0 HB3 HIS A 32 6.874 13.749 -2.693 1.00 0.00 H new ATOM 0 HD2 HIS A 32 3.188 14.318 -2.275 1.00 0.00 H new ATOM 0 HE1 HIS A 32 4.812 18.156 -3.073 1.00 0.00 H new ATOM 0 HE2 HIS A 32 2.669 16.789 -2.924 1.00 0.00 H new ATOM 508 N ASP A 33 4.597 12.255 -4.027 1.00 0.00 N ATOM 509 CA ASP A 33 4.517 11.599 -5.327 1.00 0.00 C ATOM 510 C ASP A 33 5.828 11.741 -6.094 1.00 0.00 C ATOM 511 O ASP A 33 6.163 10.902 -6.931 1.00 0.00 O ATOM 512 CB ASP A 33 3.368 12.186 -6.148 1.00 0.00 C ATOM 513 CG ASP A 33 2.020 11.977 -5.486 1.00 0.00 C ATOM 514 OD1 ASP A 33 1.987 11.784 -4.253 1.00 0.00 O ATOM 515 OD2 ASP A 33 0.997 12.006 -6.202 1.00 0.00 O ATOM 0 H ASP A 33 4.022 13.093 -3.942 1.00 0.00 H new ATOM 0 HA ASP A 33 4.331 10.539 -5.157 1.00 0.00 H new ATOM 0 HB2 ASP A 33 3.537 13.253 -6.294 1.00 0.00 H new ATOM 0 HB3 ASP A 33 3.360 11.727 -7.137 1.00 0.00 H new ATOM 520 N TRP A 34 6.567 12.808 -5.806 1.00 0.00 N ATOM 521 CA TRP A 34 7.841 13.060 -6.470 1.00 0.00 C ATOM 522 C TRP A 34 8.797 11.884 -6.291 1.00 0.00 C ATOM 523 O TRP A 34 9.665 11.645 -7.130 1.00 0.00 O ATOM 524 CB TRP A 34 8.481 14.338 -5.925 1.00 0.00 C ATOM 525 CG TRP A 34 7.940 15.587 -6.551 1.00 0.00 C ATOM 526 CD1 TRP A 34 6.638 15.847 -6.872 1.00 0.00 C ATOM 527 CD2 TRP A 34 8.686 16.747 -6.935 1.00 0.00 C ATOM 528 NE1 TRP A 34 6.530 17.097 -7.430 1.00 0.00 N ATOM 529 CE2 TRP A 34 7.774 17.670 -7.480 1.00 0.00 C ATOM 530 CE3 TRP A 34 10.039 17.096 -6.870 1.00 0.00 C ATOM 531 CZ2 TRP A 34 8.170 18.917 -7.957 1.00 0.00 C ATOM 532 CZ3 TRP A 34 10.431 18.335 -7.344 1.00 0.00 C ATOM 533 CH2 TRP A 34 9.499 19.232 -7.880 1.00 0.00 C ATOM 0 H TRP A 34 6.305 13.513 -5.117 1.00 0.00 H new ATOM 0 HA TRP A 34 7.644 13.184 -7.535 1.00 0.00 H new ATOM 0 HB2 TRP A 34 8.324 14.383 -4.847 1.00 0.00 H new ATOM 0 HB3 TRP A 34 9.558 14.295 -6.089 1.00 0.00 H new ATOM 0 HD1 TRP A 34 5.814 15.168 -6.710 1.00 0.00 H new ATOM 0 HE1 TRP A 34 5.665 17.529 -7.754 1.00 0.00 H new ATOM 0 HE3 TRP A 34 10.764 16.411 -6.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 7.454 19.610 -8.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 11.473 18.615 -7.300 1.00 0.00 H new ATOM 0 HH2 TRP A 34 9.836 20.193 -8.240 1.00 0.00 H new ATOM 544 N ASP A 35 8.634 11.154 -5.192 1.00 0.00 N ATOM 545 CA ASP A 35 9.484 10.004 -4.905 1.00 0.00 C ATOM 546 C ASP A 35 9.402 8.970 -6.027 1.00 0.00 C ATOM 547 O ASP A 35 8.400 8.891 -6.737 1.00 0.00 O ATOM 548 CB ASP A 35 9.085 9.364 -3.574 1.00 0.00 C ATOM 549 CG ASP A 35 8.903 10.389 -2.472 1.00 0.00 C ATOM 550 OD1 ASP A 35 9.703 11.346 -2.414 1.00 0.00 O ATOM 551 OD2 ASP A 35 7.961 10.235 -1.667 1.00 0.00 O ATOM 0 H ASP A 35 7.921 11.338 -4.486 1.00 0.00 H new ATOM 0 HA ASP A 35 10.513 10.356 -4.835 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.157 8.807 -3.705 1.00 0.00 H new ATOM 0 HB3 ASP A 35 9.849 8.646 -3.276 1.00 0.00 H new ATOM 556 N PRO A 36 10.464 8.163 -6.204 1.00 0.00 N ATOM 557 CA PRO A 36 10.510 7.135 -7.250 1.00 0.00 C ATOM 558 C PRO A 36 9.478 6.031 -7.033 1.00 0.00 C ATOM 559 O PRO A 36 8.666 5.749 -7.915 1.00 0.00 O ATOM 560 CB PRO A 36 11.930 6.569 -7.142 1.00 0.00 C ATOM 561 CG PRO A 36 12.378 6.903 -5.760 1.00 0.00 C ATOM 562 CD PRO A 36 11.701 8.195 -5.403 1.00 0.00 C ATOM 0 HA PRO A 36 10.278 7.550 -8.231 1.00 0.00 H new ATOM 0 HB2 PRO A 36 11.939 5.492 -7.310 1.00 0.00 H new ATOM 0 HB3 PRO A 36 12.589 7.013 -7.888 1.00 0.00 H new ATOM 0 HG2 PRO A 36 12.104 6.113 -5.060 1.00 0.00 H new ATOM 0 HG3 PRO A 36 13.462 7.006 -5.716 1.00 0.00 H new ATOM 0 HD2 PRO A 36 11.488 8.256 -4.336 1.00 0.00 H new ATOM 0 HD3 PRO A 36 12.320 9.056 -5.654 1.00 0.00 H new ATOM 570 N THR A 37 9.516 5.407 -5.859 1.00 0.00 N ATOM 571 CA THR A 37 8.591 4.335 -5.533 1.00 0.00 C ATOM 572 C THR A 37 7.147 4.794 -5.690 1.00 0.00 C ATOM 573 O THR A 37 6.268 4.009 -6.045 1.00 0.00 O ATOM 574 CB THR A 37 8.829 3.842 -4.105 1.00 0.00 C ATOM 575 OG1 THR A 37 10.177 3.447 -3.930 1.00 0.00 O ATOM 576 CG2 THR A 37 7.955 2.667 -3.724 1.00 0.00 C ATOM 0 H THR A 37 10.181 5.629 -5.118 1.00 0.00 H new ATOM 0 HA THR A 37 8.769 3.514 -6.227 1.00 0.00 H new ATOM 0 HB THR A 37 8.577 4.686 -3.463 1.00 0.00 H new ATOM 0 HG1 THR A 37 10.685 4.185 -3.534 1.00 0.00 H new ATOM 0 HG21 THR A 37 8.175 2.367 -2.699 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.906 2.953 -3.802 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.154 1.832 -4.396 1.00 0.00 H new ATOM 584 N CYS A 38 6.912 6.073 -5.424 1.00 0.00 N ATOM 585 CA CYS A 38 5.575 6.642 -5.536 1.00 0.00 C ATOM 586 C CYS A 38 5.150 6.741 -6.997 1.00 0.00 C ATOM 587 O CYS A 38 3.970 6.608 -7.321 1.00 0.00 O ATOM 588 CB CYS A 38 5.528 8.026 -4.882 1.00 0.00 C ATOM 589 SG CYS A 38 4.693 8.055 -3.278 1.00 0.00 S ATOM 0 H CYS A 38 7.629 6.735 -5.129 1.00 0.00 H new ATOM 0 HA CYS A 38 4.880 5.981 -5.017 1.00 0.00 H new ATOM 0 HB2 CYS A 38 6.547 8.392 -4.756 1.00 0.00 H new ATOM 0 HB3 CYS A 38 5.022 8.718 -5.556 1.00 0.00 H new ATOM 0 HG CYS A 38 5.567 7.884 -2.331 1.00 0.00 H new ATOM 595 N MET A 39 6.121 6.975 -7.874 1.00 0.00 N ATOM 596 CA MET A 39 5.849 7.092 -9.302 1.00 0.00 C ATOM 597 C MET A 39 5.887 5.727 -9.981 1.00 0.00 C ATOM 598 O MET A 39 5.127 5.466 -10.912 1.00 0.00 O ATOM 599 CB MET A 39 6.864 8.029 -9.959 1.00 0.00 C ATOM 600 CG MET A 39 6.781 9.463 -9.460 1.00 0.00 C ATOM 601 SD MET A 39 7.102 10.671 -10.759 1.00 0.00 S ATOM 602 CE MET A 39 8.782 10.244 -11.210 1.00 0.00 C ATOM 0 H MET A 39 7.103 7.087 -7.621 1.00 0.00 H new ATOM 0 HA MET A 39 4.848 7.507 -9.421 1.00 0.00 H new ATOM 0 HB2 MET A 39 7.869 7.648 -9.777 1.00 0.00 H new ATOM 0 HB3 MET A 39 6.710 8.019 -11.038 1.00 0.00 H new ATOM 0 HG2 MET A 39 5.791 9.641 -9.041 1.00 0.00 H new ATOM 0 HG3 MET A 39 7.499 9.605 -8.652 1.00 0.00 H new ATOM 0 HE1 MET A 39 9.174 10.990 -11.901 1.00 0.00 H new ATOM 0 HE2 MET A 39 9.403 10.217 -10.315 1.00 0.00 H new ATOM 0 HE3 MET A 39 8.792 9.265 -11.689 1.00 0.00 H new ATOM 612 N LYS A 40 6.776 4.860 -9.509 1.00 0.00 N ATOM 613 CA LYS A 40 6.912 3.522 -10.075 1.00 0.00 C ATOM 614 C LYS A 40 5.669 2.685 -9.795 1.00 0.00 C ATOM 615 O LYS A 40 5.085 2.098 -10.706 1.00 0.00 O ATOM 616 CB LYS A 40 8.149 2.826 -9.503 1.00 0.00 C ATOM 617 CG LYS A 40 8.894 1.976 -10.519 1.00 0.00 C ATOM 618 CD LYS A 40 9.931 2.792 -11.273 1.00 0.00 C ATOM 619 CE LYS A 40 10.073 2.320 -12.712 1.00 0.00 C ATOM 620 NZ LYS A 40 11.232 1.399 -12.881 1.00 0.00 N ATOM 0 H LYS A 40 7.412 5.059 -8.737 1.00 0.00 H new ATOM 0 HA LYS A 40 7.026 3.621 -11.154 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.828 3.580 -9.105 1.00 0.00 H new ATOM 0 HB3 LYS A 40 7.847 2.196 -8.667 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.383 1.144 -10.011 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.184 1.545 -11.225 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.647 3.844 -11.260 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.894 2.716 -10.767 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.158 1.813 -13.020 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.196 3.183 -13.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.295 1.099 -13.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.108 1.890 -12.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.103 0.564 -12.275 1.00 0.00 H new ATOM 634 N MET A 41 5.271 2.634 -8.528 1.00 0.00 N ATOM 635 CA MET A 41 4.097 1.867 -8.125 1.00 0.00 C ATOM 636 C MET A 41 2.820 2.498 -8.669 1.00 0.00 C ATOM 637 O MET A 41 1.921 1.799 -9.135 1.00 0.00 O ATOM 638 CB MET A 41 4.024 1.775 -6.600 1.00 0.00 C ATOM 639 CG MET A 41 3.262 0.559 -6.101 1.00 0.00 C ATOM 640 SD MET A 41 1.474 0.763 -6.213 1.00 0.00 S ATOM 641 CE MET A 41 0.920 -0.444 -5.011 1.00 0.00 C ATOM 0 H MET A 41 5.744 3.114 -7.763 1.00 0.00 H new ATOM 0 HA MET A 41 4.189 0.863 -8.540 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.036 1.750 -6.197 1.00 0.00 H new ATOM 0 HB3 MET A 41 3.549 2.676 -6.212 1.00 0.00 H new ATOM 0 HG2 MET A 41 3.561 -0.315 -6.680 1.00 0.00 H new ATOM 0 HG3 MET A 41 3.537 0.363 -5.065 1.00 0.00 H new ATOM 0 HE1 MET A 41 -0.170 -0.463 -4.990 1.00 0.00 H new ATOM 0 HE2 MET A 41 1.295 -1.430 -5.286 1.00 0.00 H new ATOM 0 HE3 MET A 41 1.297 -0.175 -4.024 1.00 0.00 H new ATOM 651 N ASP A 42 2.747 3.822 -8.602 1.00 0.00 N ATOM 652 CA ASP A 42 1.578 4.552 -9.083 1.00 0.00 C ATOM 653 C ASP A 42 1.436 4.438 -10.599 1.00 0.00 C ATOM 654 O ASP A 42 0.343 4.191 -11.112 1.00 0.00 O ATOM 655 CB ASP A 42 1.673 6.025 -8.680 1.00 0.00 C ATOM 656 CG ASP A 42 0.431 6.811 -9.052 1.00 0.00 C ATOM 657 OD1 ASP A 42 0.003 6.729 -10.222 1.00 0.00 O ATOM 658 OD2 ASP A 42 -0.113 7.512 -8.172 1.00 0.00 O ATOM 0 H ASP A 42 3.484 4.414 -8.219 1.00 0.00 H new ATOM 0 HA ASP A 42 0.695 4.107 -8.624 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.834 6.094 -7.604 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.541 6.475 -9.162 1.00 0.00 H new ATOM 663 N GLU A 43 2.545 4.618 -11.312 1.00 0.00 N ATOM 664 CA GLU A 43 2.538 4.536 -12.770 1.00 0.00 C ATOM 665 C GLU A 43 1.986 3.195 -13.230 1.00 0.00 C ATOM 666 O GLU A 43 1.292 3.111 -14.244 1.00 0.00 O ATOM 667 CB GLU A 43 3.950 4.735 -13.325 1.00 0.00 C ATOM 668 CG GLU A 43 4.362 6.195 -13.429 1.00 0.00 C ATOM 669 CD GLU A 43 5.847 6.365 -13.682 1.00 0.00 C ATOM 670 OE1 GLU A 43 6.457 5.448 -14.273 1.00 0.00 O ATOM 671 OE2 GLU A 43 6.401 7.413 -13.289 1.00 0.00 O ATOM 0 H GLU A 43 3.458 4.821 -10.905 1.00 0.00 H new ATOM 0 HA GLU A 43 1.894 5.329 -13.150 1.00 0.00 H new ATOM 0 HB2 GLU A 43 4.660 4.210 -12.686 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.011 4.277 -14.312 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.803 6.670 -14.235 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.093 6.711 -12.508 1.00 0.00 H new ATOM 678 N VAL A 44 2.294 2.151 -12.474 1.00 0.00 N ATOM 679 CA VAL A 44 1.823 0.812 -12.798 1.00 0.00 C ATOM 680 C VAL A 44 0.434 0.570 -12.222 1.00 0.00 C ATOM 681 O VAL A 44 -0.367 -0.163 -12.797 1.00 0.00 O ATOM 682 CB VAL A 44 2.788 -0.270 -12.273 1.00 0.00 C ATOM 683 CG1 VAL A 44 2.859 -0.243 -10.753 1.00 0.00 C ATOM 684 CG2 VAL A 44 2.370 -1.644 -12.771 1.00 0.00 C ATOM 0 H VAL A 44 2.868 2.205 -11.632 1.00 0.00 H new ATOM 0 HA VAL A 44 1.780 0.744 -13.885 1.00 0.00 H new ATOM 0 HB VAL A 44 3.784 -0.055 -12.659 1.00 0.00 H new ATOM 0 HG11 VAL A 44 3.546 -1.015 -10.407 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.214 0.733 -10.423 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.868 -0.427 -10.339 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.062 -2.395 -12.391 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.363 -1.868 -12.419 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.385 -1.656 -13.861 1.00 0.00 H new ATOM 694 N LEU A 45 0.155 1.194 -11.081 1.00 0.00 N ATOM 695 CA LEU A 45 -1.137 1.052 -10.417 1.00 0.00 C ATOM 696 C LEU A 45 -2.289 1.284 -11.391 1.00 0.00 C ATOM 697 O LEU A 45 -3.269 0.538 -11.398 1.00 0.00 O ATOM 698 CB LEU A 45 -1.242 2.035 -9.250 1.00 0.00 C ATOM 699 CG LEU A 45 -1.991 1.512 -8.024 1.00 0.00 C ATOM 700 CD1 LEU A 45 -3.472 1.356 -8.330 1.00 0.00 C ATOM 701 CD2 LEU A 45 -1.398 0.188 -7.560 1.00 0.00 C ATOM 0 H LEU A 45 0.810 1.806 -10.595 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.208 0.032 -10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.235 2.322 -8.946 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.739 2.939 -9.601 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.882 2.238 -7.219 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -3.989 0.983 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.889 2.323 -8.613 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -3.602 0.651 -9.151 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.944 -0.169 -6.687 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.476 -0.546 -8.362 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.349 0.331 -7.299 1.00 0.00 H new ATOM 713 N TYR A 46 -2.167 2.324 -12.207 1.00 0.00 N ATOM 714 CA TYR A 46 -3.201 2.660 -13.180 1.00 0.00 C ATOM 715 C TYR A 46 -3.465 1.501 -14.139 1.00 0.00 C ATOM 716 O TYR A 46 -4.589 1.317 -14.607 1.00 0.00 O ATOM 717 CB TYR A 46 -2.798 3.906 -13.971 1.00 0.00 C ATOM 718 CG TYR A 46 -3.936 4.524 -14.752 1.00 0.00 C ATOM 719 CD1 TYR A 46 -5.192 4.681 -14.178 1.00 0.00 C ATOM 720 CD2 TYR A 46 -3.755 4.949 -16.062 1.00 0.00 C ATOM 721 CE1 TYR A 46 -6.235 5.245 -14.887 1.00 0.00 C ATOM 722 CE2 TYR A 46 -4.793 5.514 -16.778 1.00 0.00 C ATOM 723 CZ TYR A 46 -6.030 5.659 -16.187 1.00 0.00 C ATOM 724 OH TYR A 46 -7.066 6.222 -16.896 1.00 0.00 O ATOM 0 H TYR A 46 -1.362 2.950 -12.215 1.00 0.00 H new ATOM 0 HA TYR A 46 -4.120 2.861 -12.630 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -2.396 4.649 -13.282 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -1.996 3.644 -14.661 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -5.355 4.357 -13.161 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -2.787 4.836 -16.528 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -7.205 5.361 -14.426 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -4.636 5.840 -17.795 1.00 0.00 H new ATOM 0 HH TYR A 46 -6.756 6.460 -17.795 1.00 0.00 H new ATOM 734 N SER A 47 -2.426 0.728 -14.436 1.00 0.00 N ATOM 735 CA SER A 47 -2.551 -0.405 -15.349 1.00 0.00 C ATOM 736 C SER A 47 -2.914 -1.688 -14.605 1.00 0.00 C ATOM 737 O SER A 47 -3.690 -2.505 -15.099 1.00 0.00 O ATOM 738 CB SER A 47 -1.248 -0.605 -16.125 1.00 0.00 C ATOM 739 OG SER A 47 -0.216 -1.076 -15.275 1.00 0.00 O ATOM 0 H SER A 47 -1.488 0.864 -14.059 1.00 0.00 H new ATOM 0 HA SER A 47 -3.358 -0.180 -16.047 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.409 -1.316 -16.935 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.945 0.337 -16.583 1.00 0.00 H new ATOM 0 HG SER A 47 -0.154 -0.499 -14.485 1.00 0.00 H new ATOM 745 N ILE A 48 -2.341 -1.862 -13.419 1.00 0.00 N ATOM 746 CA ILE A 48 -2.598 -3.049 -12.612 1.00 0.00 C ATOM 747 C ILE A 48 -3.695 -2.796 -11.581 1.00 0.00 C ATOM 748 O ILE A 48 -3.792 -3.505 -10.579 1.00 0.00 O ATOM 749 CB ILE A 48 -1.321 -3.516 -11.883 1.00 0.00 C ATOM 750 CG1 ILE A 48 -0.803 -2.415 -10.955 1.00 0.00 C ATOM 751 CG2 ILE A 48 -0.250 -3.911 -12.890 1.00 0.00 C ATOM 752 CD1 ILE A 48 -0.275 -2.936 -9.636 1.00 0.00 C ATOM 0 H ILE A 48 -1.695 -1.196 -12.995 1.00 0.00 H new ATOM 0 HA ILE A 48 -2.927 -3.830 -13.298 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.566 -4.389 -11.279 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -0.010 -1.866 -11.463 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.608 -1.706 -10.761 1.00 0.00 H new ATOM 0 HG21 ILE A 48 0.645 -4.238 -12.360 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -0.620 -4.724 -13.514 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -0.007 -3.054 -13.518 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.075 -2.101 -9.029 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.071 -3.460 -9.107 1.00 0.00 H new ATOM 0 HD13 ILE A 48 0.551 -3.622 -9.820 1.00 0.00 H new ATOM 764 N ALA A 49 -4.521 -1.785 -11.832 1.00 0.00 N ATOM 765 CA ALA A 49 -5.610 -1.445 -10.923 1.00 0.00 C ATOM 766 C ALA A 49 -6.854 -2.274 -11.223 1.00 0.00 C ATOM 767 O ALA A 49 -7.324 -3.035 -10.376 1.00 0.00 O ATOM 768 CB ALA A 49 -5.930 0.039 -11.014 1.00 0.00 C ATOM 0 H ALA A 49 -4.457 -1.188 -12.656 1.00 0.00 H new ATOM 0 HA ALA A 49 -5.287 -1.675 -9.908 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -6.744 0.278 -10.330 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -5.047 0.619 -10.744 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.228 0.285 -12.033 1.00 0.00 H new ATOM 774 N GLU A 50 -7.385 -2.120 -12.432 1.00 0.00 N ATOM 775 CA GLU A 50 -8.577 -2.847 -12.852 1.00 0.00 C ATOM 776 C GLU A 50 -8.461 -4.338 -12.540 1.00 0.00 C ATOM 777 O GLU A 50 -9.466 -5.020 -12.344 1.00 0.00 O ATOM 778 CB GLU A 50 -8.819 -2.646 -14.349 1.00 0.00 C ATOM 779 CG GLU A 50 -10.258 -2.896 -14.770 1.00 0.00 C ATOM 780 CD GLU A 50 -10.588 -2.272 -16.111 1.00 0.00 C ATOM 781 OE1 GLU A 50 -10.219 -2.862 -17.148 1.00 0.00 O ATOM 782 OE2 GLU A 50 -11.218 -1.192 -16.125 1.00 0.00 O ATOM 0 H GLU A 50 -7.005 -1.494 -13.142 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.423 -2.449 -12.292 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -8.541 -1.627 -14.620 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.164 -3.315 -14.908 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -10.437 -3.970 -14.819 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -10.930 -2.495 -14.011 1.00 0.00 H new ATOM 789 N LYS A 51 -7.228 -4.838 -12.499 1.00 0.00 N ATOM 790 CA LYS A 51 -6.981 -6.249 -12.215 1.00 0.00 C ATOM 791 C LYS A 51 -7.728 -6.700 -10.960 1.00 0.00 C ATOM 792 O LYS A 51 -8.655 -7.506 -11.036 1.00 0.00 O ATOM 793 CB LYS A 51 -5.479 -6.499 -12.050 1.00 0.00 C ATOM 794 CG LYS A 51 -4.889 -7.387 -13.133 1.00 0.00 C ATOM 795 CD LYS A 51 -3.476 -6.959 -13.497 1.00 0.00 C ATOM 796 CE LYS A 51 -3.457 -6.120 -14.763 1.00 0.00 C ATOM 797 NZ LYS A 51 -2.091 -6.029 -15.349 1.00 0.00 N ATOM 0 H LYS A 51 -6.385 -4.287 -12.659 1.00 0.00 H new ATOM 0 HA LYS A 51 -7.352 -6.832 -13.058 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.957 -5.542 -12.052 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.300 -6.958 -11.078 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.880 -8.422 -12.791 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.521 -7.350 -14.020 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.044 -6.388 -12.675 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.852 -7.842 -13.635 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.138 -6.553 -15.496 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.824 -5.118 -14.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -1.868 -5.035 -15.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -1.397 -6.404 -14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.052 -6.584 -16.227 1.00 0.00 H new ATOM 811 N VAL A 52 -7.316 -6.177 -9.810 1.00 0.00 N ATOM 812 CA VAL A 52 -7.948 -6.529 -8.543 1.00 0.00 C ATOM 813 C VAL A 52 -8.629 -5.320 -7.908 1.00 0.00 C ATOM 814 O VAL A 52 -8.790 -5.256 -6.689 1.00 0.00 O ATOM 815 CB VAL A 52 -6.923 -7.107 -7.549 1.00 0.00 C ATOM 816 CG1 VAL A 52 -6.360 -8.421 -8.067 1.00 0.00 C ATOM 817 CG2 VAL A 52 -5.808 -6.107 -7.287 1.00 0.00 C ATOM 0 H VAL A 52 -6.549 -5.509 -9.729 1.00 0.00 H new ATOM 0 HA VAL A 52 -8.699 -7.287 -8.765 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.431 -7.303 -6.605 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.638 -8.814 -7.352 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.170 -9.138 -8.196 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.868 -8.253 -9.025 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.094 -6.534 -6.582 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.300 -5.875 -8.223 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.230 -5.194 -6.867 1.00 0.00 H new ATOM 827 N LYS A 53 -9.024 -4.361 -8.741 1.00 0.00 N ATOM 828 CA LYS A 53 -9.685 -3.154 -8.266 1.00 0.00 C ATOM 829 C LYS A 53 -10.859 -3.487 -7.350 1.00 0.00 C ATOM 830 O LYS A 53 -11.188 -2.723 -6.442 1.00 0.00 O ATOM 831 CB LYS A 53 -10.171 -2.315 -9.450 1.00 0.00 C ATOM 832 CG LYS A 53 -10.837 -1.012 -9.040 1.00 0.00 C ATOM 833 CD LYS A 53 -11.283 -0.209 -10.251 1.00 0.00 C ATOM 834 CE LYS A 53 -10.097 0.379 -10.998 1.00 0.00 C ATOM 835 NZ LYS A 53 -10.526 1.211 -12.156 1.00 0.00 N ATOM 0 H LYS A 53 -8.896 -4.399 -9.752 1.00 0.00 H new ATOM 0 HA LYS A 53 -8.958 -2.580 -7.692 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.324 -2.092 -10.098 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -10.875 -2.904 -10.037 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -11.698 -1.226 -8.407 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -10.143 -0.419 -8.445 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -11.856 -0.849 -10.922 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -11.947 0.594 -9.932 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.503 0.986 -10.315 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -9.453 -0.427 -11.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -9.688 1.593 -12.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -11.071 0.626 -12.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -11.119 1.996 -11.819 1.00 0.00 H new ATOM 849 N ASN A 54 -11.489 -4.632 -7.596 1.00 0.00 N ATOM 850 CA ASN A 54 -12.628 -5.066 -6.794 1.00 0.00 C ATOM 851 C ASN A 54 -12.187 -6.014 -5.683 1.00 0.00 C ATOM 852 O ASN A 54 -12.839 -7.025 -5.421 1.00 0.00 O ATOM 853 CB ASN A 54 -13.671 -5.749 -7.682 1.00 0.00 C ATOM 854 CG ASN A 54 -15.074 -5.630 -7.121 1.00 0.00 C ATOM 855 OD1 ASN A 54 -15.555 -6.524 -6.425 1.00 0.00 O ATOM 856 ND2 ASN A 54 -15.740 -4.520 -7.423 1.00 0.00 N ATOM 0 H ASN A 54 -11.230 -5.276 -8.344 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.073 -4.184 -6.334 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -13.642 -5.307 -8.678 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -13.415 -6.803 -7.794 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -16.689 -4.384 -7.074 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -15.302 -3.805 -8.003 1.00 0.00 H new ATOM 863 N PHE A 55 -11.078 -5.681 -5.032 1.00 0.00 N ATOM 864 CA PHE A 55 -10.552 -6.503 -3.948 1.00 0.00 C ATOM 865 C PHE A 55 -9.553 -5.719 -3.108 1.00 0.00 C ATOM 866 O PHE A 55 -9.651 -5.672 -1.882 1.00 0.00 O ATOM 867 CB PHE A 55 -9.890 -7.762 -4.508 1.00 0.00 C ATOM 868 CG PHE A 55 -10.868 -8.846 -4.865 1.00 0.00 C ATOM 869 CD1 PHE A 55 -11.830 -9.254 -3.955 1.00 0.00 C ATOM 870 CD2 PHE A 55 -10.824 -9.456 -6.108 1.00 0.00 C ATOM 871 CE1 PHE A 55 -12.731 -10.252 -4.280 1.00 0.00 C ATOM 872 CE2 PHE A 55 -11.721 -10.454 -6.438 1.00 0.00 C ATOM 873 CZ PHE A 55 -12.676 -10.852 -5.523 1.00 0.00 C ATOM 0 H PHE A 55 -10.526 -4.848 -5.236 1.00 0.00 H new ATOM 0 HA PHE A 55 -11.386 -6.795 -3.310 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -9.315 -7.496 -5.395 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.183 -8.149 -3.774 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -11.877 -8.788 -2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -10.080 -9.148 -6.828 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -13.477 -10.562 -3.563 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -11.675 -10.922 -7.410 1.00 0.00 H new ATOM 0 HZ PHE A 55 -13.379 -11.631 -5.779 1.00 0.00 H new ATOM 883 N ALA A 56 -8.593 -5.103 -3.781 1.00 0.00 N ATOM 884 CA ALA A 56 -7.570 -4.314 -3.107 1.00 0.00 C ATOM 885 C ALA A 56 -7.823 -2.823 -3.297 1.00 0.00 C ATOM 886 O ALA A 56 -8.336 -2.400 -4.333 1.00 0.00 O ATOM 887 CB ALA A 56 -6.189 -4.687 -3.625 1.00 0.00 C ATOM 0 H ALA A 56 -8.500 -5.134 -4.796 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.616 -4.534 -2.040 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.435 -4.090 -3.113 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.003 -5.745 -3.437 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.138 -4.494 -4.697 1.00 0.00 H new ATOM 893 N VAL A 57 -7.466 -2.028 -2.292 1.00 0.00 N ATOM 894 CA VAL A 57 -7.664 -0.587 -2.364 1.00 0.00 C ATOM 895 C VAL A 57 -6.465 0.160 -1.788 1.00 0.00 C ATOM 896 O VAL A 57 -6.312 0.270 -0.572 1.00 0.00 O ATOM 897 CB VAL A 57 -8.944 -0.163 -1.616 1.00 0.00 C ATOM 898 CG1 VAL A 57 -8.899 -0.637 -0.173 1.00 0.00 C ATOM 899 CG2 VAL A 57 -9.140 1.345 -1.688 1.00 0.00 C ATOM 0 H VAL A 57 -7.041 -2.356 -1.425 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.770 -0.327 -3.417 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.798 -0.634 -2.103 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.810 -0.329 0.340 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.819 -1.724 -0.149 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.035 -0.199 0.327 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.049 1.620 -1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.286 1.845 -1.232 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.226 1.651 -2.731 1.00 0.00 H new ATOM 909 N ILE A 58 -5.619 0.673 -2.674 1.00 0.00 N ATOM 910 CA ILE A 58 -4.432 1.412 -2.264 1.00 0.00 C ATOM 911 C ILE A 58 -4.782 2.854 -1.904 1.00 0.00 C ATOM 912 O ILE A 58 -5.844 3.354 -2.275 1.00 0.00 O ATOM 913 CB ILE A 58 -3.363 1.407 -3.378 1.00 0.00 C ATOM 914 CG1 ILE A 58 -2.081 2.090 -2.899 1.00 0.00 C ATOM 915 CG2 ILE A 58 -3.896 2.084 -4.633 1.00 0.00 C ATOM 916 CD1 ILE A 58 -0.865 1.742 -3.728 1.00 0.00 C ATOM 0 H ILE A 58 -5.734 0.590 -3.684 1.00 0.00 H new ATOM 0 HA ILE A 58 -4.028 0.913 -1.383 1.00 0.00 H new ATOM 0 HB ILE A 58 -3.126 0.371 -3.622 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.226 3.170 -2.917 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.896 1.810 -1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.129 2.071 -5.407 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.778 1.551 -4.987 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.163 3.116 -4.404 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.007 2.262 -3.331 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.694 0.666 -3.690 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.030 2.047 -4.761 1.00 0.00 H new ATOM 928 N TYR A 59 -3.881 3.519 -1.188 1.00 0.00 N ATOM 929 CA TYR A 59 -4.086 4.892 -0.787 1.00 0.00 C ATOM 930 C TYR A 59 -2.766 5.547 -0.393 1.00 0.00 C ATOM 931 O TYR A 59 -2.153 5.178 0.609 1.00 0.00 O ATOM 932 CB TYR A 59 -5.082 4.980 0.370 1.00 0.00 C ATOM 933 CG TYR A 59 -6.523 4.784 -0.045 1.00 0.00 C ATOM 934 CD1 TYR A 59 -7.067 5.509 -1.098 1.00 0.00 C ATOM 935 CD2 TYR A 59 -7.339 3.876 0.617 1.00 0.00 C ATOM 936 CE1 TYR A 59 -8.385 5.333 -1.478 1.00 0.00 C ATOM 937 CE2 TYR A 59 -8.656 3.694 0.242 1.00 0.00 C ATOM 938 CZ TYR A 59 -9.175 4.426 -0.805 1.00 0.00 C ATOM 939 OH TYR A 59 -10.486 4.249 -1.181 1.00 0.00 O ATOM 0 H TYR A 59 -2.997 3.118 -0.875 1.00 0.00 H new ATOM 0 HA TYR A 59 -4.498 5.429 -1.641 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.824 4.229 1.116 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.982 5.954 0.850 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.451 6.221 -1.628 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.937 3.302 1.439 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.794 5.904 -2.299 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.276 2.982 0.766 1.00 0.00 H new ATOM 0 HH TYR A 59 -10.903 3.573 -0.606 1.00 0.00 H new ATOM 949 N LEU A 60 -2.335 6.518 -1.189 1.00 0.00 N ATOM 950 CA LEU A 60 -1.087 7.225 -0.926 1.00 0.00 C ATOM 951 C LEU A 60 -1.160 7.983 0.395 1.00 0.00 C ATOM 952 O LEU A 60 -2.184 7.964 1.078 1.00 0.00 O ATOM 953 CB LEU A 60 -0.778 8.194 -2.068 1.00 0.00 C ATOM 954 CG LEU A 60 -0.052 7.575 -3.263 1.00 0.00 C ATOM 955 CD1 LEU A 60 -0.796 6.346 -3.762 1.00 0.00 C ATOM 956 CD2 LEU A 60 0.103 8.596 -4.379 1.00 0.00 C ATOM 0 H LEU A 60 -2.831 6.834 -2.022 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.287 6.488 -0.857 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -1.714 8.631 -2.417 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.171 9.011 -1.677 1.00 0.00 H new ATOM 0 HG LEU A 60 0.942 7.266 -2.939 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -0.264 5.919 -4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.855 5.607 -2.963 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.803 6.630 -4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.622 8.138 -5.221 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.881 8.936 -4.700 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.680 9.447 -4.016 1.00 0.00 H new ATOM 968 N VAL A 61 -0.066 8.650 0.748 1.00 0.00 N ATOM 969 CA VAL A 61 -0.003 9.416 1.986 1.00 0.00 C ATOM 970 C VAL A 61 1.016 10.545 1.877 1.00 0.00 C ATOM 971 O VAL A 61 2.190 10.308 1.595 1.00 0.00 O ATOM 972 CB VAL A 61 0.362 8.521 3.186 1.00 0.00 C ATOM 973 CG1 VAL A 61 0.272 9.305 4.486 1.00 0.00 C ATOM 974 CG2 VAL A 61 -0.538 7.294 3.232 1.00 0.00 C ATOM 0 H VAL A 61 0.789 8.675 0.193 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.995 9.837 2.150 1.00 0.00 H new ATOM 0 HB VAL A 61 1.391 8.184 3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 61 0.533 8.656 5.321 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.963 10.147 4.451 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -0.745 9.675 4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.265 6.674 4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.577 7.608 3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.417 6.720 2.314 1.00 0.00 H new ATOM 984 N ASP A 62 0.559 11.772 2.100 1.00 0.00 N ATOM 985 CA ASP A 62 1.433 12.938 2.024 1.00 0.00 C ATOM 986 C ASP A 62 2.070 13.230 3.379 1.00 0.00 C ATOM 987 O ASP A 62 1.393 13.652 4.317 1.00 0.00 O ATOM 988 CB ASP A 62 0.647 14.159 1.544 1.00 0.00 C ATOM 989 CG ASP A 62 0.249 14.053 0.084 1.00 0.00 C ATOM 990 OD1 ASP A 62 -0.260 12.984 -0.316 1.00 0.00 O ATOM 991 OD2 ASP A 62 0.445 15.038 -0.658 1.00 0.00 O ATOM 0 H ASP A 62 -0.410 11.986 2.335 1.00 0.00 H new ATOM 0 HA ASP A 62 2.226 12.720 1.309 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -0.249 14.274 2.154 1.00 0.00 H new ATOM 0 HB3 ASP A 62 1.249 15.056 1.689 1.00 0.00 H new ATOM 996 N ILE A 63 3.376 13.006 3.473 1.00 0.00 N ATOM 997 CA ILE A 63 4.108 13.244 4.703 1.00 0.00 C ATOM 998 C ILE A 63 3.964 14.692 5.165 1.00 0.00 C ATOM 999 O ILE A 63 4.114 14.991 6.349 1.00 0.00 O ATOM 1000 CB ILE A 63 5.601 12.919 4.523 1.00 0.00 C ATOM 1001 CG1 ILE A 63 6.126 13.511 3.213 1.00 0.00 C ATOM 1002 CG2 ILE A 63 5.825 11.414 4.558 1.00 0.00 C ATOM 1003 CD1 ILE A 63 7.631 13.667 3.181 1.00 0.00 C ATOM 0 H ILE A 63 3.949 12.658 2.704 1.00 0.00 H new ATOM 0 HA ILE A 63 3.682 12.587 5.462 1.00 0.00 H new ATOM 0 HB ILE A 63 6.154 13.369 5.348 1.00 0.00 H new ATOM 0 HG12 ILE A 63 5.817 12.872 2.385 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.664 14.485 3.053 1.00 0.00 H new ATOM 0 HG21 ILE A 63 6.886 11.201 4.429 1.00 0.00 H new ATOM 0 HG22 ILE A 63 5.489 11.018 5.517 1.00 0.00 H new ATOM 0 HG23 ILE A 63 5.260 10.943 3.753 1.00 0.00 H new ATOM 0 HD11 ILE A 63 7.932 14.092 2.224 1.00 0.00 H new ATOM 0 HD12 ILE A 63 7.945 14.330 3.987 1.00 0.00 H new ATOM 0 HD13 ILE A 63 8.101 12.692 3.309 1.00 0.00 H new ATOM 1015 N THR A 64 3.671 15.585 4.225 1.00 0.00 N ATOM 1016 CA THR A 64 3.506 16.999 4.539 1.00 0.00 C ATOM 1017 C THR A 64 2.051 17.316 4.864 1.00 0.00 C ATOM 1018 O THR A 64 1.757 17.985 5.855 1.00 0.00 O ATOM 1019 CB THR A 64 3.980 17.862 3.369 1.00 0.00 C ATOM 1020 OG1 THR A 64 5.212 17.385 2.859 1.00 0.00 O ATOM 1021 CG2 THR A 64 4.168 19.318 3.736 1.00 0.00 C ATOM 0 H THR A 64 3.543 15.354 3.240 1.00 0.00 H new ATOM 0 HA THR A 64 4.113 17.225 5.416 1.00 0.00 H new ATOM 0 HB THR A 64 3.190 17.792 2.621 1.00 0.00 H new ATOM 0 HG1 THR A 64 5.497 17.950 2.110 1.00 0.00 H new ATOM 0 HG21 THR A 64 4.505 19.873 2.861 1.00 0.00 H new ATOM 0 HG22 THR A 64 3.221 19.730 4.085 1.00 0.00 H new ATOM 0 HG23 THR A 64 4.913 19.401 4.527 1.00 0.00 H new ATOM 1029 N GLU A 65 1.144 16.830 4.023 1.00 0.00 N ATOM 1030 CA GLU A 65 -0.282 17.061 4.222 1.00 0.00 C ATOM 1031 C GLU A 65 -0.753 16.447 5.536 1.00 0.00 C ATOM 1032 O GLU A 65 -1.465 17.085 6.312 1.00 0.00 O ATOM 1033 CB GLU A 65 -1.082 16.476 3.056 1.00 0.00 C ATOM 1034 CG GLU A 65 -2.282 17.321 2.657 1.00 0.00 C ATOM 1035 CD GLU A 65 -2.587 17.236 1.175 1.00 0.00 C ATOM 1036 OE1 GLU A 65 -2.745 16.107 0.665 1.00 0.00 O ATOM 1037 OE2 GLU A 65 -2.669 18.299 0.524 1.00 0.00 O ATOM 0 H GLU A 65 1.371 16.274 3.198 1.00 0.00 H new ATOM 0 HA GLU A 65 -0.449 18.137 4.264 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.424 16.365 2.194 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.425 15.477 3.326 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.155 16.996 3.223 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.096 18.360 2.927 1.00 0.00 H new ATOM 1044 N VAL A 66 -0.348 15.205 5.780 1.00 0.00 N ATOM 1045 CA VAL A 66 -0.726 14.503 7.001 1.00 0.00 C ATOM 1046 C VAL A 66 -0.116 15.179 8.229 1.00 0.00 C ATOM 1047 O VAL A 66 1.044 15.592 8.205 1.00 0.00 O ATOM 1048 CB VAL A 66 -0.275 13.029 6.961 1.00 0.00 C ATOM 1049 CG1 VAL A 66 -0.870 12.252 8.125 1.00 0.00 C ATOM 1050 CG2 VAL A 66 -0.657 12.387 5.633 1.00 0.00 C ATOM 0 H VAL A 66 0.242 14.664 5.148 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.813 14.540 7.070 1.00 0.00 H new ATOM 0 HB VAL A 66 0.811 13.002 7.054 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.539 11.215 8.077 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.540 12.695 9.065 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.958 12.288 8.069 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.330 11.347 5.624 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.739 12.428 5.507 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.176 12.925 4.817 1.00 0.00 H new ATOM 1060 N PRO A 67 -0.892 15.308 9.323 1.00 0.00 N ATOM 1061 CA PRO A 67 -0.418 15.943 10.557 1.00 0.00 C ATOM 1062 C PRO A 67 0.990 15.499 10.949 1.00 0.00 C ATOM 1063 O PRO A 67 1.734 16.249 11.578 1.00 0.00 O ATOM 1064 CB PRO A 67 -1.436 15.475 11.594 1.00 0.00 C ATOM 1065 CG PRO A 67 -2.698 15.303 10.822 1.00 0.00 C ATOM 1066 CD PRO A 67 -2.291 14.850 9.444 1.00 0.00 C ATOM 0 HA PRO A 67 -0.346 17.026 10.458 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -1.126 14.541 12.062 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -1.555 16.207 12.393 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -3.348 14.568 11.297 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -3.256 16.238 10.775 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -2.368 13.768 9.339 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -2.925 15.291 8.674 1.00 0.00 H new ATOM 1074 N ASP A 68 1.348 14.275 10.570 1.00 0.00 N ATOM 1075 CA ASP A 68 2.667 13.736 10.882 1.00 0.00 C ATOM 1076 C ASP A 68 3.766 14.605 10.277 1.00 0.00 C ATOM 1077 O ASP A 68 4.219 14.362 9.158 1.00 0.00 O ATOM 1078 CB ASP A 68 2.791 12.302 10.364 1.00 0.00 C ATOM 1079 CG ASP A 68 3.586 11.415 11.301 1.00 0.00 C ATOM 1080 OD1 ASP A 68 4.820 11.591 11.383 1.00 0.00 O ATOM 1081 OD2 ASP A 68 2.974 10.544 11.955 1.00 0.00 O ATOM 0 H ASP A 68 0.744 13.640 10.048 1.00 0.00 H new ATOM 0 HA ASP A 68 2.785 13.734 11.966 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.795 11.881 10.227 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.270 12.313 9.385 1.00 0.00 H new ATOM 1086 N PHE A 69 4.189 15.621 11.024 1.00 0.00 N ATOM 1087 CA PHE A 69 5.232 16.528 10.561 1.00 0.00 C ATOM 1088 C PHE A 69 6.526 15.773 10.276 1.00 0.00 C ATOM 1089 O PHE A 69 6.964 15.684 9.128 1.00 0.00 O ATOM 1090 CB PHE A 69 5.484 17.621 11.603 1.00 0.00 C ATOM 1091 CG PHE A 69 4.661 18.858 11.386 1.00 0.00 C ATOM 1092 CD1 PHE A 69 4.639 19.483 10.149 1.00 0.00 C ATOM 1093 CD2 PHE A 69 3.910 19.395 12.418 1.00 0.00 C ATOM 1094 CE1 PHE A 69 3.881 20.622 9.948 1.00 0.00 C ATOM 1095 CE2 PHE A 69 3.152 20.533 12.223 1.00 0.00 C ATOM 1096 CZ PHE A 69 3.137 21.147 10.986 1.00 0.00 C ATOM 0 H PHE A 69 3.825 15.836 11.952 1.00 0.00 H new ATOM 0 HA PHE A 69 4.892 16.989 9.634 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.271 17.222 12.595 1.00 0.00 H new ATOM 0 HB3 PHE A 69 6.540 17.890 11.588 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.220 19.076 9.334 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.917 18.918 13.387 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.871 21.101 8.980 1.00 0.00 H new ATOM 0 HE2 PHE A 69 2.572 20.942 13.037 1.00 0.00 H new ATOM 0 HZ PHE A 69 2.544 22.036 10.831 1.00 0.00 H new ATOM 1106 N ASN A 70 7.135 15.232 11.326 1.00 0.00 N ATOM 1107 CA ASN A 70 8.379 14.485 11.186 1.00 0.00 C ATOM 1108 C ASN A 70 8.820 13.901 12.524 1.00 0.00 C ATOM 1109 O ASN A 70 9.315 12.775 12.588 1.00 0.00 O ATOM 1110 CB ASN A 70 9.479 15.388 10.626 1.00 0.00 C ATOM 1111 CG ASN A 70 9.779 16.565 11.532 1.00 0.00 C ATOM 1112 OD1 ASN A 70 10.489 16.431 12.529 1.00 0.00 O ATOM 1113 ND2 ASN A 70 9.238 17.729 11.192 1.00 0.00 N ATOM 0 H ASN A 70 6.787 15.297 12.283 1.00 0.00 H new ATOM 0 HA ASN A 70 8.202 13.663 10.493 1.00 0.00 H new ATOM 0 HB2 ASN A 70 10.387 14.803 10.483 1.00 0.00 H new ATOM 0 HB3 ASN A 70 9.179 15.756 9.645 1.00 0.00 H new ATOM 0 HD21 ASN A 70 9.405 18.556 11.765 1.00 0.00 H new ATOM 0 HD22 ASN A 70 8.656 17.796 10.357 1.00 0.00 H new ATOM 1120 N LYS A 71 8.637 14.674 13.592 1.00 0.00 N ATOM 1121 CA LYS A 71 9.015 14.236 14.932 1.00 0.00 C ATOM 1122 C LYS A 71 10.533 14.171 15.075 1.00 0.00 C ATOM 1123 O LYS A 71 11.128 14.935 15.836 1.00 0.00 O ATOM 1124 CB LYS A 71 8.403 12.868 15.245 1.00 0.00 C ATOM 1125 CG LYS A 71 7.978 12.708 16.695 1.00 0.00 C ATOM 1126 CD LYS A 71 7.342 11.350 16.942 1.00 0.00 C ATOM 1127 CE LYS A 71 6.712 11.273 18.323 1.00 0.00 C ATOM 1128 NZ LYS A 71 5.251 11.558 18.285 1.00 0.00 N ATOM 0 H LYS A 71 8.229 15.608 13.555 1.00 0.00 H new ATOM 0 HA LYS A 71 8.629 14.966 15.644 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.537 12.711 14.602 1.00 0.00 H new ATOM 0 HB3 LYS A 71 9.127 12.091 15.000 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.845 12.829 17.345 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.271 13.495 16.957 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.583 11.159 16.183 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.097 10.570 16.841 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.877 10.281 18.742 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.203 11.985 18.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.860 11.495 19.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.094 12.515 17.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.778 10.863 17.673 1.00 0.00 H new ATOM 1142 N MET A 72 11.154 13.256 14.340 1.00 0.00 N ATOM 1143 CA MET A 72 12.602 13.093 14.384 1.00 0.00 C ATOM 1144 C MET A 72 13.175 12.927 12.981 1.00 0.00 C ATOM 1145 O MET A 72 13.954 13.758 12.514 1.00 0.00 O ATOM 1146 CB MET A 72 12.974 11.885 15.246 1.00 0.00 C ATOM 1147 CG MET A 72 12.235 11.833 16.573 1.00 0.00 C ATOM 1148 SD MET A 72 13.213 11.073 17.884 1.00 0.00 S ATOM 1149 CE MET A 72 13.593 12.502 18.895 1.00 0.00 C ATOM 0 H MET A 72 10.677 12.615 13.706 1.00 0.00 H new ATOM 0 HA MET A 72 13.030 13.992 14.827 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.765 10.973 14.687 1.00 0.00 H new ATOM 0 HB3 MET A 72 14.047 11.903 15.438 1.00 0.00 H new ATOM 0 HG2 MET A 72 11.959 12.845 16.871 1.00 0.00 H new ATOM 0 HG3 MET A 72 11.308 11.274 16.446 1.00 0.00 H new ATOM 0 HE1 MET A 72 14.196 12.193 19.749 1.00 0.00 H new ATOM 0 HE2 MET A 72 14.148 13.229 18.303 1.00 0.00 H new ATOM 0 HE3 MET A 72 12.666 12.954 19.249 1.00 0.00 H new ATOM 1159 N TYR A 73 12.782 11.848 12.312 1.00 0.00 N ATOM 1160 CA TYR A 73 13.255 11.572 10.960 1.00 0.00 C ATOM 1161 C TYR A 73 12.274 10.673 10.216 1.00 0.00 C ATOM 1162 O TYR A 73 12.677 9.802 9.444 1.00 0.00 O ATOM 1163 CB TYR A 73 14.636 10.915 11.005 1.00 0.00 C ATOM 1164 CG TYR A 73 14.742 9.796 12.015 1.00 0.00 C ATOM 1165 CD1 TYR A 73 15.072 10.059 13.339 1.00 0.00 C ATOM 1166 CD2 TYR A 73 14.513 8.476 11.646 1.00 0.00 C ATOM 1167 CE1 TYR A 73 15.171 9.038 14.266 1.00 0.00 C ATOM 1168 CE2 TYR A 73 14.609 7.451 12.567 1.00 0.00 C ATOM 1169 CZ TYR A 73 14.938 7.736 13.875 1.00 0.00 C ATOM 1170 OH TYR A 73 15.035 6.718 14.794 1.00 0.00 O ATOM 0 H TYR A 73 12.137 11.150 12.684 1.00 0.00 H new ATOM 0 HA TYR A 73 13.329 12.519 10.426 1.00 0.00 H new ATOM 0 HB2 TYR A 73 14.875 10.524 10.016 1.00 0.00 H new ATOM 0 HB3 TYR A 73 15.383 11.674 11.237 1.00 0.00 H new ATOM 0 HD1 TYR A 73 15.254 11.077 13.649 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.256 8.248 10.622 1.00 0.00 H new ATOM 0 HE1 TYR A 73 15.429 9.259 15.291 1.00 0.00 H new ATOM 0 HE2 TYR A 73 14.427 6.431 12.264 1.00 0.00 H new ATOM 0 HH TYR A 73 14.840 5.863 14.357 1.00 0.00 H new ATOM 1180 N GLU A 74 10.984 10.887 10.455 1.00 0.00 N ATOM 1181 CA GLU A 74 9.940 10.097 9.814 1.00 0.00 C ATOM 1182 C GLU A 74 10.160 10.002 8.309 1.00 0.00 C ATOM 1183 O GLU A 74 10.204 8.910 7.742 1.00 0.00 O ATOM 1184 CB GLU A 74 8.566 10.703 10.102 1.00 0.00 C ATOM 1185 CG GLU A 74 7.415 9.738 9.868 1.00 0.00 C ATOM 1186 CD GLU A 74 7.362 8.632 10.904 1.00 0.00 C ATOM 1187 OE1 GLU A 74 6.969 8.916 12.055 1.00 0.00 O ATOM 1188 OE2 GLU A 74 7.711 7.482 10.563 1.00 0.00 O ATOM 0 H GLU A 74 10.636 11.605 11.091 1.00 0.00 H new ATOM 0 HA GLU A 74 9.984 9.089 10.228 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.538 11.045 11.137 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.426 11.582 9.472 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.475 10.289 9.882 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.511 9.297 8.876 1.00 0.00 H new ATOM 1195 N LEU A 75 10.297 11.154 7.672 1.00 0.00 N ATOM 1196 CA LEU A 75 10.512 11.212 6.229 1.00 0.00 C ATOM 1197 C LEU A 75 12.002 11.188 5.893 1.00 0.00 C ATOM 1198 O LEU A 75 12.512 12.082 5.217 1.00 0.00 O ATOM 1199 CB LEU A 75 9.854 12.462 5.623 1.00 0.00 C ATOM 1200 CG LEU A 75 10.014 13.768 6.413 1.00 0.00 C ATOM 1201 CD1 LEU A 75 8.979 13.856 7.526 1.00 0.00 C ATOM 1202 CD2 LEU A 75 11.425 13.906 6.974 1.00 0.00 C ATOM 0 H LEU A 75 10.264 12.065 8.130 1.00 0.00 H new ATOM 0 HA LEU A 75 10.046 10.329 5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.264 12.614 4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 75 8.789 12.263 5.503 1.00 0.00 H new ATOM 0 HG LEU A 75 9.847 14.596 5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 75 9.111 14.790 8.073 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.978 13.826 7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 75 9.106 13.015 8.208 1.00 0.00 H new ATOM 0 HD21 LEU A 75 11.506 14.841 7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 75 11.635 13.070 7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 75 12.144 13.906 6.155 1.00 0.00 H new ATOM 1214 N TYR A 76 12.695 10.157 6.365 1.00 0.00 N ATOM 1215 CA TYR A 76 14.124 10.016 6.111 1.00 0.00 C ATOM 1216 C TYR A 76 14.377 9.538 4.685 1.00 0.00 C ATOM 1217 O TYR A 76 14.890 10.283 3.850 1.00 0.00 O ATOM 1218 CB TYR A 76 14.749 9.039 7.108 1.00 0.00 C ATOM 1219 CG TYR A 76 16.101 9.480 7.623 1.00 0.00 C ATOM 1220 CD1 TYR A 76 16.318 10.792 8.022 1.00 0.00 C ATOM 1221 CD2 TYR A 76 17.159 8.584 7.708 1.00 0.00 C ATOM 1222 CE1 TYR A 76 17.553 11.199 8.492 1.00 0.00 C ATOM 1223 CE2 TYR A 76 18.396 8.983 8.179 1.00 0.00 C ATOM 1224 CZ TYR A 76 18.587 10.292 8.569 1.00 0.00 C ATOM 1225 OH TYR A 76 19.818 10.692 9.037 1.00 0.00 O ATOM 0 H TYR A 76 12.290 9.407 6.925 1.00 0.00 H new ATOM 0 HA TYR A 76 14.588 10.995 6.236 1.00 0.00 H new ATOM 0 HB2 TYR A 76 14.072 8.912 7.953 1.00 0.00 H new ATOM 0 HB3 TYR A 76 14.851 8.064 6.632 1.00 0.00 H new ATOM 0 HD1 TYR A 76 15.510 11.506 7.964 1.00 0.00 H new ATOM 0 HD2 TYR A 76 17.013 7.559 7.401 1.00 0.00 H new ATOM 0 HE1 TYR A 76 17.706 12.224 8.797 1.00 0.00 H new ATOM 0 HE2 TYR A 76 19.208 8.274 8.241 1.00 0.00 H new ATOM 0 HH TYR A 76 20.435 9.930 9.028 1.00 0.00 H new ATOM 1235 N ASP A 77 14.012 8.290 4.413 1.00 0.00 N ATOM 1236 CA ASP A 77 14.197 7.709 3.088 1.00 0.00 C ATOM 1237 C ASP A 77 13.351 8.443 2.050 1.00 0.00 C ATOM 1238 O ASP A 77 12.444 9.199 2.400 1.00 0.00 O ATOM 1239 CB ASP A 77 13.833 6.223 3.106 1.00 0.00 C ATOM 1240 CG ASP A 77 15.047 5.333 3.283 1.00 0.00 C ATOM 1241 OD1 ASP A 77 15.575 5.267 4.413 1.00 0.00 O ATOM 1242 OD2 ASP A 77 15.469 4.700 2.292 1.00 0.00 O ATOM 0 H ASP A 77 13.586 7.661 5.093 1.00 0.00 H new ATOM 0 HA ASP A 77 15.247 7.814 2.813 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.127 6.034 3.915 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.329 5.964 2.175 1.00 0.00 H new ATOM 1247 N PRO A 78 13.633 8.226 0.754 1.00 0.00 N ATOM 1248 CA PRO A 78 12.889 8.871 -0.335 1.00 0.00 C ATOM 1249 C PRO A 78 11.404 8.529 -0.298 1.00 0.00 C ATOM 1250 O PRO A 78 10.553 9.390 -0.525 1.00 0.00 O ATOM 1251 CB PRO A 78 13.537 8.307 -1.608 1.00 0.00 C ATOM 1252 CG PRO A 78 14.262 7.081 -1.170 1.00 0.00 C ATOM 1253 CD PRO A 78 14.693 7.340 0.245 1.00 0.00 C ATOM 0 HA PRO A 78 12.937 9.958 -0.269 1.00 0.00 H new ATOM 0 HB2 PRO A 78 12.785 8.071 -2.361 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.220 9.029 -2.055 1.00 0.00 H new ATOM 0 HG2 PRO A 78 13.617 6.204 -1.227 1.00 0.00 H new ATOM 0 HG3 PRO A 78 15.122 6.886 -1.811 1.00 0.00 H new ATOM 0 HD2 PRO A 78 14.761 6.418 0.822 1.00 0.00 H new ATOM 0 HD3 PRO A 78 15.673 7.816 0.288 1.00 0.00 H new ATOM 1261 N CYS A 79 11.098 7.270 -0.006 1.00 0.00 N ATOM 1262 CA CYS A 79 9.715 6.815 0.064 1.00 0.00 C ATOM 1263 C CYS A 79 9.612 5.507 0.842 1.00 0.00 C ATOM 1264 O CYS A 79 10.612 4.990 1.339 1.00 0.00 O ATOM 1265 CB CYS A 79 9.142 6.634 -1.344 1.00 0.00 C ATOM 1266 SG CYS A 79 7.497 7.348 -1.568 1.00 0.00 S ATOM 0 H CYS A 79 11.790 6.546 0.186 1.00 0.00 H new ATOM 0 HA CYS A 79 9.135 7.575 0.588 1.00 0.00 H new ATOM 0 HB2 CYS A 79 9.824 7.087 -2.063 1.00 0.00 H new ATOM 0 HB3 CYS A 79 9.099 5.569 -1.573 1.00 0.00 H new ATOM 0 HG CYS A 79 6.819 7.229 -0.465 1.00 0.00 H new ATOM 1272 N THR A 80 8.398 4.978 0.940 1.00 0.00 N ATOM 1273 CA THR A 80 8.162 3.728 1.654 1.00 0.00 C ATOM 1274 C THR A 80 6.686 3.343 1.596 1.00 0.00 C ATOM 1275 O THR A 80 5.807 4.189 1.762 1.00 0.00 O ATOM 1276 CB THR A 80 8.607 3.854 3.113 1.00 0.00 C ATOM 1277 OG1 THR A 80 8.433 2.627 3.798 1.00 0.00 O ATOM 1278 CG2 THR A 80 7.852 4.918 3.879 1.00 0.00 C ATOM 0 H THR A 80 7.561 5.395 0.534 1.00 0.00 H new ATOM 0 HA THR A 80 8.747 2.946 1.170 1.00 0.00 H new ATOM 0 HB THR A 80 9.659 4.137 3.071 1.00 0.00 H new ATOM 0 HG1 THR A 80 8.725 2.727 4.728 1.00 0.00 H new ATOM 0 HG21 THR A 80 8.216 4.955 4.906 1.00 0.00 H new ATOM 0 HG22 THR A 80 8.006 5.887 3.404 1.00 0.00 H new ATOM 0 HG23 THR A 80 6.788 4.680 3.880 1.00 0.00 H new ATOM 1286 N VAL A 81 6.419 2.063 1.359 1.00 0.00 N ATOM 1287 CA VAL A 81 5.050 1.570 1.277 1.00 0.00 C ATOM 1288 C VAL A 81 4.778 0.519 2.349 1.00 0.00 C ATOM 1289 O VAL A 81 5.705 -0.091 2.883 1.00 0.00 O ATOM 1290 CB VAL A 81 4.755 0.964 -0.107 1.00 0.00 C ATOM 1291 CG1 VAL A 81 3.283 0.610 -0.236 1.00 0.00 C ATOM 1292 CG2 VAL A 81 5.180 1.923 -1.209 1.00 0.00 C ATOM 0 H VAL A 81 7.133 1.348 1.220 1.00 0.00 H new ATOM 0 HA VAL A 81 4.395 2.426 1.438 1.00 0.00 H new ATOM 0 HB VAL A 81 5.333 0.046 -0.211 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.096 0.183 -1.222 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.015 -0.117 0.531 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.680 1.509 -0.110 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.964 1.479 -2.181 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.631 2.859 -1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 81 6.249 2.119 -1.129 1.00 0.00 H new ATOM 1302 N MET A 82 3.502 0.309 2.656 1.00 0.00 N ATOM 1303 CA MET A 82 3.110 -0.670 3.664 1.00 0.00 C ATOM 1304 C MET A 82 1.735 -1.253 3.353 1.00 0.00 C ATOM 1305 O MET A 82 0.761 -0.520 3.188 1.00 0.00 O ATOM 1306 CB MET A 82 3.103 -0.028 5.053 1.00 0.00 C ATOM 1307 CG MET A 82 2.365 1.300 5.106 1.00 0.00 C ATOM 1308 SD MET A 82 2.967 2.376 6.421 1.00 0.00 S ATOM 1309 CE MET A 82 3.061 1.222 7.787 1.00 0.00 C ATOM 0 H MET A 82 2.722 0.803 2.222 1.00 0.00 H new ATOM 0 HA MET A 82 3.839 -1.480 3.649 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.643 -0.718 5.761 1.00 0.00 H new ATOM 0 HB3 MET A 82 4.132 0.124 5.379 1.00 0.00 H new ATOM 0 HG2 MET A 82 2.471 1.809 4.148 1.00 0.00 H new ATOM 0 HG3 MET A 82 1.301 1.114 5.252 1.00 0.00 H new ATOM 0 HE1 MET A 82 3.385 1.747 8.685 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.079 0.781 7.959 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.776 0.434 7.549 1.00 0.00 H new ATOM 1319 N PHE A 83 1.665 -2.578 3.276 1.00 0.00 N ATOM 1320 CA PHE A 83 0.410 -3.263 2.987 1.00 0.00 C ATOM 1321 C PHE A 83 -0.428 -3.417 4.252 1.00 0.00 C ATOM 1322 O PHE A 83 0.108 -3.497 5.357 1.00 0.00 O ATOM 1323 CB PHE A 83 0.685 -4.637 2.374 1.00 0.00 C ATOM 1324 CG PHE A 83 1.189 -4.575 0.961 1.00 0.00 C ATOM 1325 CD1 PHE A 83 2.355 -3.889 0.657 1.00 0.00 C ATOM 1326 CD2 PHE A 83 0.498 -5.200 -0.065 1.00 0.00 C ATOM 1327 CE1 PHE A 83 2.822 -3.830 -0.642 1.00 0.00 C ATOM 1328 CE2 PHE A 83 0.959 -5.144 -1.366 1.00 0.00 C ATOM 1329 CZ PHE A 83 2.123 -4.457 -1.655 1.00 0.00 C ATOM 0 H PHE A 83 2.463 -3.199 3.410 1.00 0.00 H new ATOM 0 HA PHE A 83 -0.149 -2.659 2.273 1.00 0.00 H new ATOM 0 HB2 PHE A 83 1.417 -5.160 2.989 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.232 -5.226 2.398 1.00 0.00 H new ATOM 0 HD1 PHE A 83 2.905 -3.395 1.445 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -0.412 -5.738 0.155 1.00 0.00 H new ATOM 0 HE1 PHE A 83 3.733 -3.294 -0.865 1.00 0.00 H new ATOM 0 HE2 PHE A 83 0.411 -5.636 -2.156 1.00 0.00 H new ATOM 0 HZ PHE A 83 2.485 -4.411 -2.671 1.00 0.00 H new ATOM 1339 N PHE A 84 -1.746 -3.456 4.083 1.00 0.00 N ATOM 1340 CA PHE A 84 -2.655 -3.599 5.214 1.00 0.00 C ATOM 1341 C PHE A 84 -3.838 -4.490 4.852 1.00 0.00 C ATOM 1342 O PHE A 84 -4.646 -4.146 3.990 1.00 0.00 O ATOM 1343 CB PHE A 84 -3.156 -2.228 5.671 1.00 0.00 C ATOM 1344 CG PHE A 84 -2.247 -1.557 6.661 1.00 0.00 C ATOM 1345 CD1 PHE A 84 -1.022 -1.047 6.261 1.00 0.00 C ATOM 1346 CD2 PHE A 84 -2.618 -1.437 7.990 1.00 0.00 C ATOM 1347 CE1 PHE A 84 -0.184 -0.428 7.170 1.00 0.00 C ATOM 1348 CE2 PHE A 84 -1.784 -0.820 8.903 1.00 0.00 C ATOM 1349 CZ PHE A 84 -0.566 -0.314 8.493 1.00 0.00 C ATOM 0 H PHE A 84 -2.207 -3.391 3.176 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.106 -4.068 6.031 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.271 -1.583 4.800 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.145 -2.341 6.116 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.719 -1.134 5.228 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.570 -1.830 8.316 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.768 -0.034 6.846 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.085 -0.734 9.937 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.086 0.170 9.205 1.00 0.00 H new ATOM 1359 N PHE A 85 -3.935 -5.637 5.518 1.00 0.00 N ATOM 1360 CA PHE A 85 -5.021 -6.577 5.266 1.00 0.00 C ATOM 1361 C PHE A 85 -5.957 -6.660 6.468 1.00 0.00 C ATOM 1362 O PHE A 85 -5.602 -7.219 7.506 1.00 0.00 O ATOM 1363 CB PHE A 85 -4.463 -7.967 4.948 1.00 0.00 C ATOM 1364 CG PHE A 85 -3.265 -7.949 4.039 1.00 0.00 C ATOM 1365 CD1 PHE A 85 -3.145 -6.991 3.045 1.00 0.00 C ATOM 1366 CD2 PHE A 85 -2.260 -8.892 4.179 1.00 0.00 C ATOM 1367 CE1 PHE A 85 -2.045 -6.974 2.208 1.00 0.00 C ATOM 1368 CE2 PHE A 85 -1.158 -8.881 3.346 1.00 0.00 C ATOM 1369 CZ PHE A 85 -1.050 -7.920 2.359 1.00 0.00 C ATOM 0 H PHE A 85 -3.275 -5.937 6.235 1.00 0.00 H new ATOM 0 HA PHE A 85 -5.586 -6.215 4.407 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -4.192 -8.461 5.881 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -5.248 -8.566 4.487 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -3.920 -6.249 2.923 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -2.339 -9.645 4.949 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -1.964 -6.222 1.437 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -0.382 -9.622 3.466 1.00 0.00 H new ATOM 0 HZ PHE A 85 -0.189 -7.909 1.707 1.00 0.00 H new ATOM 1379 N ARG A 86 -7.152 -6.099 6.322 1.00 0.00 N ATOM 1380 CA ARG A 86 -8.139 -6.110 7.396 1.00 0.00 C ATOM 1381 C ARG A 86 -7.571 -5.487 8.668 1.00 0.00 C ATOM 1382 O ARG A 86 -7.785 -5.992 9.770 1.00 0.00 O ATOM 1383 CB ARG A 86 -8.601 -7.542 7.677 1.00 0.00 C ATOM 1384 CG ARG A 86 -9.964 -7.622 8.346 1.00 0.00 C ATOM 1385 CD ARG A 86 -10.743 -8.840 7.877 1.00 0.00 C ATOM 1386 NE ARG A 86 -10.545 -9.989 8.757 1.00 0.00 N ATOM 1387 CZ ARG A 86 -11.153 -11.162 8.594 1.00 0.00 C ATOM 1388 NH1 ARG A 86 -11.998 -11.344 7.586 1.00 0.00 N ATOM 1389 NH2 ARG A 86 -10.916 -12.155 9.439 1.00 0.00 N ATOM 0 H ARG A 86 -7.461 -5.631 5.470 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.994 -5.515 7.075 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.633 -8.095 6.738 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -7.864 -8.034 8.312 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -9.838 -7.664 9.428 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.532 -6.718 8.126 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -11.804 -8.596 7.832 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -10.433 -9.101 6.865 1.00 0.00 H new ATOM 0 HE ARG A 86 -9.903 -9.886 9.543 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -12.184 -10.583 6.932 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.461 -12.245 7.465 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.267 -12.021 10.215 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.382 -13.054 9.314 1.00 0.00 H new ATOM 1403 N ASN A 87 -6.844 -4.385 8.506 1.00 0.00 N ATOM 1404 CA ASN A 87 -6.244 -3.692 9.640 1.00 0.00 C ATOM 1405 C ASN A 87 -5.239 -4.589 10.356 1.00 0.00 C ATOM 1406 O ASN A 87 -5.107 -4.537 11.580 1.00 0.00 O ATOM 1407 CB ASN A 87 -7.327 -3.237 10.620 1.00 0.00 C ATOM 1408 CG ASN A 87 -7.007 -1.897 11.252 1.00 0.00 C ATOM 1409 OD1 ASN A 87 -6.683 -1.818 12.438 1.00 0.00 O ATOM 1410 ND2 ASN A 87 -7.099 -0.832 10.463 1.00 0.00 N ATOM 0 H ASN A 87 -6.657 -3.954 7.601 1.00 0.00 H new ATOM 0 HA ASN A 87 -5.717 -2.816 9.260 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -8.281 -3.171 10.098 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -7.443 -3.987 11.403 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.898 0.097 10.834 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.371 -0.943 9.486 1.00 0.00 H new ATOM 1417 N LYS A 88 -4.531 -5.409 9.587 1.00 0.00 N ATOM 1418 CA LYS A 88 -3.538 -6.317 10.147 1.00 0.00 C ATOM 1419 C LYS A 88 -2.186 -5.623 10.294 1.00 0.00 C ATOM 1420 O LYS A 88 -1.392 -5.971 11.168 1.00 0.00 O ATOM 1421 CB LYS A 88 -3.394 -7.557 9.263 1.00 0.00 C ATOM 1422 CG LYS A 88 -2.396 -8.573 9.797 1.00 0.00 C ATOM 1423 CD LYS A 88 -2.823 -9.995 9.475 1.00 0.00 C ATOM 1424 CE LYS A 88 -4.140 -10.348 10.148 1.00 0.00 C ATOM 1425 NZ LYS A 88 -4.270 -11.812 10.381 1.00 0.00 N ATOM 0 H LYS A 88 -4.627 -5.463 8.573 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.879 -6.622 11.136 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.368 -8.036 9.162 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -3.085 -7.247 8.265 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -1.413 -8.381 9.366 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.299 -8.457 10.876 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.922 -10.110 8.396 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.049 -10.691 9.800 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -4.214 -9.821 11.099 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -4.968 -10.004 9.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -5.181 -12.011 10.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.225 -12.314 9.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -3.495 -12.136 10.994 1.00 0.00 H new ATOM 1439 N HIS A 89 -1.932 -4.640 9.435 1.00 0.00 N ATOM 1440 CA HIS A 89 -0.677 -3.899 9.470 1.00 0.00 C ATOM 1441 C HIS A 89 0.506 -4.819 9.182 1.00 0.00 C ATOM 1442 O HIS A 89 1.058 -5.441 10.089 1.00 0.00 O ATOM 1443 CB HIS A 89 -0.493 -3.226 10.832 1.00 0.00 C ATOM 1444 CG HIS A 89 0.732 -2.371 10.916 1.00 0.00 C ATOM 1445 ND1 HIS A 89 1.569 -2.145 9.843 1.00 0.00 N ATOM 1446 CD2 HIS A 89 1.265 -1.684 11.956 1.00 0.00 C ATOM 1447 CE1 HIS A 89 2.561 -1.357 10.219 1.00 0.00 C ATOM 1448 NE2 HIS A 89 2.399 -1.064 11.495 1.00 0.00 N ATOM 0 H HIS A 89 -2.579 -4.339 8.706 1.00 0.00 H new ATOM 0 HA HIS A 89 -0.717 -3.132 8.696 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -1.369 -2.614 11.047 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -0.444 -3.994 11.604 1.00 0.00 H new ATOM 0 HD2 HIS A 89 0.871 -1.634 12.960 1.00 0.00 H new ATOM 0 HE1 HIS A 89 3.367 -1.012 9.589 1.00 0.00 H new ATOM 0 HE2 HIS A 89 3.017 -0.472 12.050 1.00 0.00 H new ATOM 1457 N ILE A 90 0.888 -4.900 7.912 1.00 0.00 N ATOM 1458 CA ILE A 90 2.004 -5.743 7.502 1.00 0.00 C ATOM 1459 C ILE A 90 2.867 -5.041 6.456 1.00 0.00 C ATOM 1460 O ILE A 90 2.359 -4.529 5.459 1.00 0.00 O ATOM 1461 CB ILE A 90 1.510 -7.090 6.935 1.00 0.00 C ATOM 1462 CG1 ILE A 90 2.695 -8.009 6.624 1.00 0.00 C ATOM 1463 CG2 ILE A 90 0.661 -6.866 5.691 1.00 0.00 C ATOM 1464 CD1 ILE A 90 2.951 -9.047 7.693 1.00 0.00 C ATOM 0 H ILE A 90 0.441 -4.392 7.149 1.00 0.00 H new ATOM 0 HA ILE A 90 2.605 -5.933 8.391 1.00 0.00 H new ATOM 0 HB ILE A 90 0.890 -7.575 7.689 1.00 0.00 H new ATOM 0 HG12 ILE A 90 2.514 -8.514 5.675 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.591 -7.402 6.496 1.00 0.00 H new ATOM 0 HG21 ILE A 90 0.321 -7.827 5.305 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.202 -6.251 5.946 1.00 0.00 H new ATOM 0 HG23 ILE A 90 1.256 -6.359 4.931 1.00 0.00 H new ATOM 0 HD11 ILE A 90 3.804 -9.662 7.406 1.00 0.00 H new ATOM 0 HD12 ILE A 90 3.164 -8.550 8.639 1.00 0.00 H new ATOM 0 HD13 ILE A 90 2.070 -9.679 7.805 1.00 0.00 H new ATOM 1476 N MET A 91 4.176 -5.016 6.695 1.00 0.00 N ATOM 1477 CA MET A 91 5.111 -4.371 5.774 1.00 0.00 C ATOM 1478 C MET A 91 4.910 -4.864 4.342 1.00 0.00 C ATOM 1479 O MET A 91 4.237 -4.215 3.543 1.00 0.00 O ATOM 1480 CB MET A 91 6.564 -4.605 6.217 1.00 0.00 C ATOM 1481 CG MET A 91 6.793 -5.930 6.933 1.00 0.00 C ATOM 1482 SD MET A 91 8.344 -6.717 6.459 1.00 0.00 S ATOM 1483 CE MET A 91 9.336 -6.419 7.920 1.00 0.00 C ATOM 0 H MET A 91 4.613 -5.434 7.516 1.00 0.00 H new ATOM 0 HA MET A 91 4.907 -3.300 5.797 1.00 0.00 H new ATOM 0 HB2 MET A 91 7.211 -4.562 5.341 1.00 0.00 H new ATOM 0 HB3 MET A 91 6.866 -3.792 6.876 1.00 0.00 H new ATOM 0 HG2 MET A 91 6.790 -5.762 8.010 1.00 0.00 H new ATOM 0 HG3 MET A 91 5.966 -6.605 6.713 1.00 0.00 H new ATOM 0 HE1 MET A 91 10.169 -7.122 7.944 1.00 0.00 H new ATOM 0 HE2 MET A 91 9.722 -5.400 7.896 1.00 0.00 H new ATOM 0 HE3 MET A 91 8.722 -6.553 8.810 1.00 0.00 H new ATOM 1493 N ILE A 92 5.497 -6.012 4.027 1.00 0.00 N ATOM 1494 CA ILE A 92 5.382 -6.589 2.693 1.00 0.00 C ATOM 1495 C ILE A 92 5.965 -5.655 1.637 1.00 0.00 C ATOM 1496 O ILE A 92 5.443 -4.566 1.400 1.00 0.00 O ATOM 1497 CB ILE A 92 3.916 -6.900 2.337 1.00 0.00 C ATOM 1498 CG1 ILE A 92 3.259 -7.706 3.459 1.00 0.00 C ATOM 1499 CG2 ILE A 92 3.839 -7.655 1.018 1.00 0.00 C ATOM 1500 CD1 ILE A 92 1.823 -8.088 3.171 1.00 0.00 C ATOM 0 H ILE A 92 6.058 -6.562 4.677 1.00 0.00 H new ATOM 0 HA ILE A 92 5.949 -7.520 2.703 1.00 0.00 H new ATOM 0 HB ILE A 92 3.376 -5.960 2.225 1.00 0.00 H new ATOM 0 HG12 ILE A 92 3.839 -8.612 3.632 1.00 0.00 H new ATOM 0 HG13 ILE A 92 3.294 -7.125 4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.797 -7.867 0.781 1.00 0.00 H new ATOM 0 HG22 ILE A 92 4.275 -7.048 0.225 1.00 0.00 H new ATOM 0 HG23 ILE A 92 4.390 -8.592 1.102 1.00 0.00 H new ATOM 0 HD11 ILE A 92 1.423 -8.657 4.010 1.00 0.00 H new ATOM 0 HD12 ILE A 92 1.228 -7.186 3.028 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.783 -8.696 2.267 1.00 0.00 H new ATOM 1512 N ASP A 93 7.051 -6.090 1.008 1.00 0.00 N ATOM 1513 CA ASP A 93 7.710 -5.294 -0.022 1.00 0.00 C ATOM 1514 C ASP A 93 6.924 -5.329 -1.329 1.00 0.00 C ATOM 1515 O ASP A 93 6.386 -6.368 -1.714 1.00 0.00 O ATOM 1516 CB ASP A 93 9.131 -5.809 -0.259 1.00 0.00 C ATOM 1517 CG ASP A 93 9.179 -7.311 -0.458 1.00 0.00 C ATOM 1518 OD1 ASP A 93 9.020 -8.048 0.539 1.00 0.00 O ATOM 1519 OD2 ASP A 93 9.372 -7.752 -1.611 1.00 0.00 O ATOM 0 H ASP A 93 7.494 -6.990 1.193 1.00 0.00 H new ATOM 0 HA ASP A 93 7.753 -4.262 0.327 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.551 -5.316 -1.136 1.00 0.00 H new ATOM 0 HB3 ASP A 93 9.758 -5.538 0.590 1.00 0.00 H new ATOM 1524 N LEU A 94 6.867 -4.189 -2.012 1.00 0.00 N ATOM 1525 CA LEU A 94 6.153 -4.092 -3.279 1.00 0.00 C ATOM 1526 C LEU A 94 7.113 -4.232 -4.457 1.00 0.00 C ATOM 1527 O LEU A 94 6.826 -3.773 -5.562 1.00 0.00 O ATOM 1528 CB LEU A 94 5.399 -2.761 -3.369 1.00 0.00 C ATOM 1529 CG LEU A 94 6.275 -1.528 -3.625 1.00 0.00 C ATOM 1530 CD1 LEU A 94 5.817 -0.789 -4.876 1.00 0.00 C ATOM 1531 CD2 LEU A 94 6.255 -0.599 -2.420 1.00 0.00 C ATOM 0 H LEU A 94 7.307 -3.320 -1.708 1.00 0.00 H new ATOM 0 HA LEU A 94 5.432 -4.909 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.660 -2.834 -4.167 1.00 0.00 H new ATOM 0 HB3 LEU A 94 4.850 -2.610 -2.440 1.00 0.00 H new ATOM 0 HG LEU A 94 7.299 -1.866 -3.784 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.453 0.082 -5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.886 -1.454 -5.737 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.784 -0.465 -4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.882 0.270 -2.620 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.233 -0.273 -2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 94 6.636 -1.128 -1.546 1.00 0.00 H new ATOM 1543 N GLY A 95 8.257 -4.868 -4.214 1.00 0.00 N ATOM 1544 CA GLY A 95 9.238 -5.052 -5.265 1.00 0.00 C ATOM 1545 C GLY A 95 9.838 -6.445 -5.259 1.00 0.00 C ATOM 1546 O GLY A 95 9.115 -7.439 -5.235 1.00 0.00 O ATOM 0 H GLY A 95 8.520 -5.258 -3.309 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.770 -4.865 -6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.034 -4.316 -5.148 1.00 0.00 H new ATOM 1550 N THR A 96 11.165 -6.515 -5.281 1.00 0.00 N ATOM 1551 CA THR A 96 11.862 -7.796 -5.278 1.00 0.00 C ATOM 1552 C THR A 96 12.337 -8.155 -3.873 1.00 0.00 C ATOM 1553 O THR A 96 12.157 -9.284 -3.417 1.00 0.00 O ATOM 1554 CB THR A 96 13.054 -7.753 -6.236 1.00 0.00 C ATOM 1555 OG1 THR A 96 13.691 -9.018 -6.301 1.00 0.00 O ATOM 1556 CG2 THR A 96 14.101 -6.733 -5.843 1.00 0.00 C ATOM 0 H THR A 96 11.779 -5.701 -5.301 1.00 0.00 H new ATOM 0 HA THR A 96 11.163 -8.562 -5.612 1.00 0.00 H new ATOM 0 HB THR A 96 12.638 -7.469 -7.203 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.450 -8.971 -6.920 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.918 -6.754 -6.564 1.00 0.00 H new ATOM 0 HG22 THR A 96 13.654 -5.739 -5.831 1.00 0.00 H new ATOM 0 HG23 THR A 96 14.486 -6.970 -4.851 1.00 0.00 H new ATOM 1564 N GLY A 97 12.941 -7.186 -3.193 1.00 0.00 N ATOM 1565 CA GLY A 97 13.432 -7.420 -1.847 1.00 0.00 C ATOM 1566 C GLY A 97 14.928 -7.205 -1.729 1.00 0.00 C ATOM 1567 O GLY A 97 15.672 -7.439 -2.681 1.00 0.00 O ATOM 0 H GLY A 97 13.099 -6.243 -3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 97 12.917 -6.754 -1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 97 13.190 -8.440 -1.548 1.00 0.00 H new ATOM 1571 N ASN A 98 15.369 -6.757 -0.558 1.00 0.00 N ATOM 1572 CA ASN A 98 16.786 -6.510 -0.320 1.00 0.00 C ATOM 1573 C ASN A 98 17.029 -6.088 1.126 1.00 0.00 C ATOM 1574 O ASN A 98 17.934 -6.597 1.788 1.00 0.00 O ATOM 1575 CB ASN A 98 17.305 -5.431 -1.271 1.00 0.00 C ATOM 1576 CG ASN A 98 18.734 -5.684 -1.709 1.00 0.00 C ATOM 1577 OD1 ASN A 98 19.683 -5.272 -1.041 1.00 0.00 O ATOM 1578 ND2 ASN A 98 18.896 -6.364 -2.838 1.00 0.00 N ATOM 0 H ASN A 98 14.766 -6.558 0.240 1.00 0.00 H new ATOM 0 HA ASN A 98 17.326 -7.438 -0.506 1.00 0.00 H new ATOM 0 HB2 ASN A 98 16.662 -5.385 -2.150 1.00 0.00 H new ATOM 0 HB3 ASN A 98 17.245 -4.459 -0.781 1.00 0.00 H new ATOM 0 HD21 ASN A 98 19.835 -6.564 -3.183 1.00 0.00 H new ATOM 0 HD22 ASN A 98 18.081 -6.687 -3.360 1.00 0.00 H new ATOM 1585 N ASN A 99 16.215 -5.157 1.611 1.00 0.00 N ATOM 1586 CA ASN A 99 16.342 -4.666 2.978 1.00 0.00 C ATOM 1587 C ASN A 99 14.973 -4.350 3.571 1.00 0.00 C ATOM 1588 O ASN A 99 14.822 -3.394 4.333 1.00 0.00 O ATOM 1589 CB ASN A 99 17.228 -3.420 3.015 1.00 0.00 C ATOM 1590 CG ASN A 99 17.886 -3.219 4.366 1.00 0.00 C ATOM 1591 OD1 ASN A 99 17.998 -4.153 5.160 1.00 0.00 O ATOM 1592 ND2 ASN A 99 18.327 -1.995 4.633 1.00 0.00 N ATOM 0 H ASN A 99 15.460 -4.727 1.077 1.00 0.00 H new ATOM 0 HA ASN A 99 16.806 -5.449 3.578 1.00 0.00 H new ATOM 0 HB2 ASN A 99 17.998 -3.502 2.248 1.00 0.00 H new ATOM 0 HB3 ASN A 99 16.628 -2.543 2.772 1.00 0.00 H new ATOM 0 HD21 ASN A 99 18.780 -1.799 5.526 1.00 0.00 H new ATOM 0 HD22 ASN A 99 18.213 -1.251 3.945 1.00 0.00 H new ATOM 1599 N ASN A 100 13.979 -5.158 3.216 1.00 0.00 N ATOM 1600 CA ASN A 100 12.619 -4.969 3.711 1.00 0.00 C ATOM 1601 C ASN A 100 12.049 -3.630 3.249 1.00 0.00 C ATOM 1602 O ASN A 100 11.283 -3.570 2.287 1.00 0.00 O ATOM 1603 CB ASN A 100 12.589 -5.056 5.238 1.00 0.00 C ATOM 1604 CG ASN A 100 12.865 -6.458 5.744 1.00 0.00 C ATOM 1605 OD1 ASN A 100 11.947 -7.188 6.117 1.00 0.00 O ATOM 1606 ND2 ASN A 100 14.137 -6.843 5.757 1.00 0.00 N ATOM 0 H ASN A 100 14.090 -5.952 2.586 1.00 0.00 H new ATOM 0 HA ASN A 100 11.998 -5.765 3.300 1.00 0.00 H new ATOM 0 HB2 ASN A 100 13.329 -4.371 5.653 1.00 0.00 H new ATOM 0 HB3 ASN A 100 11.614 -4.728 5.599 1.00 0.00 H new ATOM 0 HD21 ASN A 100 14.384 -7.777 6.085 1.00 0.00 H new ATOM 0 HD22 ASN A 100 14.866 -6.205 5.439 1.00 0.00 H new ATOM 1613 N LYS A 101 12.426 -2.557 3.940 1.00 0.00 N ATOM 1614 CA LYS A 101 11.953 -1.221 3.605 1.00 0.00 C ATOM 1615 C LYS A 101 12.132 -0.928 2.118 1.00 0.00 C ATOM 1616 O LYS A 101 13.251 -0.718 1.647 1.00 0.00 O ATOM 1617 CB LYS A 101 12.696 -0.172 4.436 1.00 0.00 C ATOM 1618 CG LYS A 101 12.140 -0.005 5.840 1.00 0.00 C ATOM 1619 CD LYS A 101 12.673 1.255 6.503 1.00 0.00 C ATOM 1620 CE LYS A 101 14.022 1.012 7.159 1.00 0.00 C ATOM 1621 NZ LYS A 101 13.894 0.225 8.416 1.00 0.00 N ATOM 0 H LYS A 101 13.060 -2.590 4.738 1.00 0.00 H new ATOM 0 HA LYS A 101 10.889 -1.175 3.836 1.00 0.00 H new ATOM 0 HB2 LYS A 101 13.748 -0.450 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.651 0.787 3.920 1.00 0.00 H new ATOM 0 HG2 LYS A 101 11.052 0.036 5.799 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.403 -0.874 6.443 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.766 2.047 5.760 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.961 1.603 7.251 1.00 0.00 H new ATOM 0 HE2 LYS A 101 14.674 0.483 6.464 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.498 1.968 7.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 14.789 0.267 8.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.129 0.622 8.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 13.674 -0.765 8.185 1.00 0.00 H new ATOM 1635 N ILE A 102 11.024 -0.916 1.384 1.00 0.00 N ATOM 1636 CA ILE A 102 11.060 -0.649 -0.049 1.00 0.00 C ATOM 1637 C ILE A 102 10.919 0.842 -0.334 1.00 0.00 C ATOM 1638 O ILE A 102 9.833 1.323 -0.659 1.00 0.00 O ATOM 1639 CB ILE A 102 9.947 -1.413 -0.792 1.00 0.00 C ATOM 1640 CG1 ILE A 102 9.978 -2.895 -0.415 1.00 0.00 C ATOM 1641 CG2 ILE A 102 10.097 -1.240 -2.296 1.00 0.00 C ATOM 1642 CD1 ILE A 102 11.264 -3.591 -0.805 1.00 0.00 C ATOM 0 H ILE A 102 10.091 -1.088 1.758 1.00 0.00 H new ATOM 0 HA ILE A 102 12.029 -0.994 -0.411 1.00 0.00 H new ATOM 0 HB ILE A 102 8.983 -1.001 -0.494 1.00 0.00 H new ATOM 0 HG12 ILE A 102 9.834 -2.991 0.661 1.00 0.00 H new ATOM 0 HG13 ILE A 102 9.140 -3.401 -0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 102 9.303 -1.786 -2.806 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.030 -0.182 -2.549 1.00 0.00 H new ATOM 0 HG23 ILE A 102 11.065 -1.628 -2.612 1.00 0.00 H new ATOM 0 HD11 ILE A 102 11.216 -4.638 -0.507 1.00 0.00 H new ATOM 0 HD12 ILE A 102 11.400 -3.527 -1.885 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.104 -3.110 -0.304 1.00 0.00 H new ATOM 1654 N ASN A 103 12.026 1.567 -0.213 1.00 0.00 N ATOM 1655 CA ASN A 103 12.027 3.004 -0.461 1.00 0.00 C ATOM 1656 C ASN A 103 12.195 3.300 -1.951 1.00 0.00 C ATOM 1657 O ASN A 103 11.872 4.395 -2.413 1.00 0.00 O ATOM 1658 CB ASN A 103 13.147 3.680 0.334 1.00 0.00 C ATOM 1659 CG ASN A 103 13.243 3.165 1.757 1.00 0.00 C ATOM 1660 OD1 ASN A 103 14.003 2.240 2.045 1.00 0.00 O ATOM 1661 ND2 ASN A 103 12.471 3.763 2.657 1.00 0.00 N ATOM 0 H ASN A 103 12.933 1.184 0.055 1.00 0.00 H new ATOM 0 HA ASN A 103 11.067 3.404 -0.135 1.00 0.00 H new ATOM 0 HB2 ASN A 103 14.098 3.516 -0.173 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.977 4.756 0.352 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.493 3.459 3.630 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.856 4.526 2.375 1.00 0.00 H new ATOM 1668 N TRP A 104 12.698 2.320 -2.696 1.00 0.00 N ATOM 1669 CA TRP A 104 12.906 2.476 -4.131 1.00 0.00 C ATOM 1670 C TRP A 104 12.399 1.249 -4.885 1.00 0.00 C ATOM 1671 O TRP A 104 13.165 0.337 -5.194 1.00 0.00 O ATOM 1672 CB TRP A 104 14.389 2.696 -4.434 1.00 0.00 C ATOM 1673 CG TRP A 104 14.632 3.401 -5.733 1.00 0.00 C ATOM 1674 CD1 TRP A 104 14.377 2.923 -6.986 1.00 0.00 C ATOM 1675 CD2 TRP A 104 15.180 4.713 -5.908 1.00 0.00 C ATOM 1676 NE1 TRP A 104 14.733 3.856 -7.929 1.00 0.00 N ATOM 1677 CE2 TRP A 104 15.228 4.964 -7.292 1.00 0.00 C ATOM 1678 CE3 TRP A 104 15.633 5.700 -5.028 1.00 0.00 C ATOM 1679 CZ2 TRP A 104 15.711 6.160 -7.817 1.00 0.00 C ATOM 1680 CZ3 TRP A 104 16.114 6.888 -5.550 1.00 0.00 C ATOM 1681 CH2 TRP A 104 16.149 7.109 -6.932 1.00 0.00 C ATOM 0 H TRP A 104 12.969 1.408 -2.328 1.00 0.00 H new ATOM 0 HA TRP A 104 12.343 3.348 -4.463 1.00 0.00 H new ATOM 0 HB2 TRP A 104 14.835 3.275 -3.626 1.00 0.00 H new ATOM 0 HB3 TRP A 104 14.896 1.731 -4.452 1.00 0.00 H new ATOM 0 HD1 TRP A 104 13.957 1.952 -7.204 1.00 0.00 H new ATOM 0 HE1 TRP A 104 14.644 3.743 -8.939 1.00 0.00 H new ATOM 0 HE3 TRP A 104 15.608 5.538 -3.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 15.739 6.333 -8.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 16.468 7.657 -4.880 1.00 0.00 H new ATOM 0 HH2 TRP A 104 16.529 8.047 -7.308 1.00 0.00 H new ATOM 1692 N ALA A 105 11.101 1.233 -5.173 1.00 0.00 N ATOM 1693 CA ALA A 105 10.488 0.117 -5.884 1.00 0.00 C ATOM 1694 C ALA A 105 11.009 0.013 -7.314 1.00 0.00 C ATOM 1695 O ALA A 105 11.552 0.974 -7.859 1.00 0.00 O ATOM 1696 CB ALA A 105 8.973 0.261 -5.881 1.00 0.00 C ATOM 0 H ALA A 105 10.453 1.981 -4.925 1.00 0.00 H new ATOM 0 HA ALA A 105 10.759 -0.802 -5.364 1.00 0.00 H new ATOM 0 HB1 ALA A 105 8.527 -0.578 -6.415 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.611 0.271 -4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 105 8.695 1.193 -6.373 1.00 0.00 H new ATOM 1702 N MET A 106 10.838 -1.160 -7.915 1.00 0.00 N ATOM 1703 CA MET A 106 11.288 -1.395 -9.283 1.00 0.00 C ATOM 1704 C MET A 106 10.343 -2.346 -10.010 1.00 0.00 C ATOM 1705 O MET A 106 9.605 -3.105 -9.381 1.00 0.00 O ATOM 1706 CB MET A 106 12.707 -1.968 -9.284 1.00 0.00 C ATOM 1707 CG MET A 106 13.315 -2.083 -10.672 1.00 0.00 C ATOM 1708 SD MET A 106 15.105 -1.870 -10.666 1.00 0.00 S ATOM 1709 CE MET A 106 15.520 -2.429 -12.317 1.00 0.00 C ATOM 0 H MET A 106 10.390 -1.964 -7.476 1.00 0.00 H new ATOM 0 HA MET A 106 11.289 -0.440 -9.808 1.00 0.00 H new ATOM 0 HB2 MET A 106 13.346 -1.335 -8.668 1.00 0.00 H new ATOM 0 HB3 MET A 106 12.692 -2.954 -8.820 1.00 0.00 H new ATOM 0 HG2 MET A 106 13.071 -3.059 -11.092 1.00 0.00 H new ATOM 0 HG3 MET A 106 12.866 -1.334 -11.324 1.00 0.00 H new ATOM 0 HE1 MET A 106 16.457 -1.969 -12.632 1.00 0.00 H new ATOM 0 HE2 MET A 106 15.630 -3.513 -12.317 1.00 0.00 H new ATOM 0 HE3 MET A 106 14.726 -2.145 -13.008 1.00 0.00 H new ATOM 1719 N GLU A 107 10.365 -2.297 -11.340 1.00 0.00 N ATOM 1720 CA GLU A 107 9.505 -3.148 -12.153 1.00 0.00 C ATOM 1721 C GLU A 107 8.041 -2.801 -11.924 1.00 0.00 C ATOM 1722 O GLU A 107 7.455 -3.153 -10.900 1.00 0.00 O ATOM 1723 CB GLU A 107 9.750 -4.623 -11.842 1.00 0.00 C ATOM 1724 CG GLU A 107 11.218 -4.973 -11.646 1.00 0.00 C ATOM 1725 CD GLU A 107 12.083 -4.544 -12.817 1.00 0.00 C ATOM 1726 OE1 GLU A 107 11.520 -4.159 -13.863 1.00 0.00 O ATOM 1727 OE2 GLU A 107 13.323 -4.593 -12.686 1.00 0.00 O ATOM 0 H GLU A 107 10.970 -1.676 -11.876 1.00 0.00 H new ATOM 0 HA GLU A 107 9.748 -2.971 -13.201 1.00 0.00 H new ATOM 0 HB2 GLU A 107 9.199 -4.891 -10.941 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.347 -5.228 -12.654 1.00 0.00 H new ATOM 0 HG2 GLU A 107 11.583 -4.496 -10.736 1.00 0.00 H new ATOM 0 HG3 GLU A 107 11.315 -6.049 -11.503 1.00 0.00 H new ATOM 1734 N ASP A 108 7.468 -2.094 -12.886 1.00 0.00 N ATOM 1735 CA ASP A 108 6.075 -1.663 -12.811 1.00 0.00 C ATOM 1736 C ASP A 108 5.107 -2.845 -12.735 1.00 0.00 C ATOM 1737 O ASP A 108 4.729 -3.277 -11.647 1.00 0.00 O ATOM 1738 CB ASP A 108 5.735 -0.775 -14.011 1.00 0.00 C ATOM 1739 CG ASP A 108 5.985 0.694 -13.732 1.00 0.00 C ATOM 1740 OD1 ASP A 108 7.054 1.020 -13.174 1.00 0.00 O ATOM 1741 OD2 ASP A 108 5.112 1.521 -14.072 1.00 0.00 O ATOM 0 H ASP A 108 7.949 -1.803 -13.737 1.00 0.00 H new ATOM 0 HA ASP A 108 5.959 -1.091 -11.890 1.00 0.00 H new ATOM 0 HB2 ASP A 108 6.330 -1.085 -14.870 1.00 0.00 H new ATOM 0 HB3 ASP A 108 4.689 -0.918 -14.280 1.00 0.00 H new ATOM 1746 N LYS A 109 4.688 -3.347 -13.894 1.00 0.00 N ATOM 1747 CA LYS A 109 3.741 -4.459 -13.954 1.00 0.00 C ATOM 1748 C LYS A 109 4.401 -5.802 -13.645 1.00 0.00 C ATOM 1749 O LYS A 109 3.743 -6.841 -13.672 1.00 0.00 O ATOM 1750 CB LYS A 109 3.084 -4.514 -15.334 1.00 0.00 C ATOM 1751 CG LYS A 109 2.505 -3.184 -15.786 1.00 0.00 C ATOM 1752 CD LYS A 109 1.808 -3.306 -17.131 1.00 0.00 C ATOM 1753 CE LYS A 109 0.569 -4.182 -17.039 1.00 0.00 C ATOM 1754 NZ LYS A 109 -0.473 -3.775 -18.020 1.00 0.00 N ATOM 0 H LYS A 109 4.989 -3.002 -14.805 1.00 0.00 H new ATOM 0 HA LYS A 109 2.986 -4.280 -13.189 1.00 0.00 H new ATOM 0 HB2 LYS A 109 3.821 -4.847 -16.065 1.00 0.00 H new ATOM 0 HB3 LYS A 109 2.290 -5.260 -15.319 1.00 0.00 H new ATOM 0 HG2 LYS A 109 1.797 -2.822 -15.040 1.00 0.00 H new ATOM 0 HG3 LYS A 109 3.302 -2.444 -15.854 1.00 0.00 H new ATOM 0 HD2 LYS A 109 1.528 -2.315 -17.488 1.00 0.00 H new ATOM 0 HD3 LYS A 109 2.498 -3.726 -17.863 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.846 -5.222 -17.214 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.159 -4.127 -16.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -1.415 -3.979 -17.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -0.391 -2.756 -18.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -0.342 -4.305 -18.905 1.00 0.00 H new ATOM 1768 N GLN A 110 5.697 -5.790 -13.359 1.00 0.00 N ATOM 1769 CA GLN A 110 6.411 -7.023 -13.054 1.00 0.00 C ATOM 1770 C GLN A 110 6.387 -7.325 -11.558 1.00 0.00 C ATOM 1771 O GLN A 110 5.878 -8.364 -11.135 1.00 0.00 O ATOM 1772 CB GLN A 110 7.854 -6.937 -13.556 1.00 0.00 C ATOM 1773 CG GLN A 110 8.147 -7.867 -14.721 1.00 0.00 C ATOM 1774 CD GLN A 110 8.305 -9.311 -14.288 1.00 0.00 C ATOM 1775 OE1 GLN A 110 8.311 -9.618 -13.095 1.00 0.00 O ATOM 1776 NE2 GLN A 110 8.433 -10.210 -15.257 1.00 0.00 N ATOM 0 H GLN A 110 6.271 -4.947 -13.332 1.00 0.00 H new ATOM 0 HA GLN A 110 5.904 -7.840 -13.567 1.00 0.00 H new ATOM 0 HB2 GLN A 110 8.064 -5.911 -13.859 1.00 0.00 H new ATOM 0 HB3 GLN A 110 8.531 -7.172 -12.735 1.00 0.00 H new ATOM 0 HG2 GLN A 110 7.339 -7.796 -15.450 1.00 0.00 H new ATOM 0 HG3 GLN A 110 9.058 -7.540 -15.222 1.00 0.00 H new ATOM 0 HE21 GLN A 110 8.423 -9.913 -16.233 1.00 0.00 H new ATOM 0 HE22 GLN A 110 8.542 -11.197 -15.025 1.00 0.00 H new ATOM 1785 N GLU A 111 6.945 -6.419 -10.760 1.00 0.00 N ATOM 1786 CA GLU A 111 6.990 -6.603 -9.313 1.00 0.00 C ATOM 1787 C GLU A 111 5.600 -6.491 -8.695 1.00 0.00 C ATOM 1788 O GLU A 111 5.107 -7.436 -8.078 1.00 0.00 O ATOM 1789 CB GLU A 111 7.931 -5.578 -8.674 1.00 0.00 C ATOM 1790 CG GLU A 111 9.281 -6.157 -8.279 1.00 0.00 C ATOM 1791 CD GLU A 111 10.062 -6.688 -9.464 1.00 0.00 C ATOM 1792 OE1 GLU A 111 9.429 -7.073 -10.470 1.00 0.00 O ATOM 1793 OE2 GLU A 111 11.308 -6.720 -9.388 1.00 0.00 O ATOM 0 H GLU A 111 7.371 -5.553 -11.090 1.00 0.00 H new ATOM 0 HA GLU A 111 7.368 -7.606 -9.118 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.088 -4.756 -9.372 1.00 0.00 H new ATOM 0 HB3 GLU A 111 7.452 -5.158 -7.790 1.00 0.00 H new ATOM 0 HG2 GLU A 111 9.868 -5.388 -7.778 1.00 0.00 H new ATOM 0 HG3 GLU A 111 9.130 -6.962 -7.560 1.00 0.00 H new ATOM 1800 N MET A 112 4.972 -5.330 -8.859 1.00 0.00 N ATOM 1801 CA MET A 112 3.638 -5.092 -8.312 1.00 0.00 C ATOM 1802 C MET A 112 2.695 -6.252 -8.627 1.00 0.00 C ATOM 1803 O MET A 112 2.194 -6.920 -7.723 1.00 0.00 O ATOM 1804 CB MET A 112 3.068 -3.784 -8.865 1.00 0.00 C ATOM 1805 CG MET A 112 3.335 -2.578 -7.976 1.00 0.00 C ATOM 1806 SD MET A 112 5.063 -2.442 -7.476 1.00 0.00 S ATOM 1807 CE MET A 112 5.704 -1.356 -8.747 1.00 0.00 C ATOM 0 H MET A 112 5.365 -4.538 -9.367 1.00 0.00 H new ATOM 0 HA MET A 112 3.726 -5.014 -7.228 1.00 0.00 H new ATOM 0 HB2 MET A 112 3.495 -3.600 -9.851 1.00 0.00 H new ATOM 0 HB3 MET A 112 1.992 -3.895 -8.999 1.00 0.00 H new ATOM 0 HG2 MET A 112 3.043 -1.671 -8.505 1.00 0.00 H new ATOM 0 HG3 MET A 112 2.709 -2.643 -7.086 1.00 0.00 H new ATOM 0 HE1 MET A 112 6.730 -1.638 -8.984 1.00 0.00 H new ATOM 0 HE2 MET A 112 5.089 -1.441 -9.643 1.00 0.00 H new ATOM 0 HE3 MET A 112 5.684 -0.326 -8.390 1.00 0.00 H new ATOM 1817 N VAL A 113 2.462 -6.490 -9.913 1.00 0.00 N ATOM 1818 CA VAL A 113 1.583 -7.574 -10.343 1.00 0.00 C ATOM 1819 C VAL A 113 1.912 -8.872 -9.609 1.00 0.00 C ATOM 1820 O VAL A 113 1.022 -9.655 -9.277 1.00 0.00 O ATOM 1821 CB VAL A 113 1.694 -7.808 -11.862 1.00 0.00 C ATOM 1822 CG1 VAL A 113 0.842 -8.994 -12.295 1.00 0.00 C ATOM 1823 CG2 VAL A 113 1.292 -6.553 -12.621 1.00 0.00 C ATOM 0 H VAL A 113 2.868 -5.948 -10.676 1.00 0.00 H new ATOM 0 HA VAL A 113 0.563 -7.276 -10.101 1.00 0.00 H new ATOM 0 HB VAL A 113 2.733 -8.038 -12.097 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.938 -9.137 -13.371 1.00 0.00 H new ATOM 0 HG12 VAL A 113 1.179 -9.892 -11.778 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.202 -8.802 -12.046 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.375 -6.734 -13.693 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.262 -6.294 -12.376 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.950 -5.731 -12.339 1.00 0.00 H new ATOM 1833 N ASP A 114 3.198 -9.091 -9.365 1.00 0.00 N ATOM 1834 CA ASP A 114 3.655 -10.293 -8.676 1.00 0.00 C ATOM 1835 C ASP A 114 3.299 -10.256 -7.190 1.00 0.00 C ATOM 1836 O ASP A 114 2.776 -11.229 -6.645 1.00 0.00 O ATOM 1837 CB ASP A 114 5.167 -10.455 -8.842 1.00 0.00 C ATOM 1838 CG ASP A 114 5.531 -11.204 -10.110 1.00 0.00 C ATOM 1839 OD1 ASP A 114 5.077 -10.788 -11.197 1.00 0.00 O ATOM 1840 OD2 ASP A 114 6.272 -12.206 -10.015 1.00 0.00 O ATOM 0 H ASP A 114 3.945 -8.451 -9.634 1.00 0.00 H new ATOM 0 HA ASP A 114 3.147 -11.146 -9.126 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.636 -9.471 -8.857 1.00 0.00 H new ATOM 0 HB3 ASP A 114 5.570 -10.987 -7.980 1.00 0.00 H new ATOM 1845 N ILE A 115 3.589 -9.133 -6.535 1.00 0.00 N ATOM 1846 CA ILE A 115 3.302 -8.991 -5.111 1.00 0.00 C ATOM 1847 C ILE A 115 1.803 -9.043 -4.842 1.00 0.00 C ATOM 1848 O ILE A 115 1.353 -9.712 -3.912 1.00 0.00 O ATOM 1849 CB ILE A 115 3.893 -7.683 -4.529 1.00 0.00 C ATOM 1850 CG1 ILE A 115 4.196 -7.860 -3.041 1.00 0.00 C ATOM 1851 CG2 ILE A 115 2.955 -6.496 -4.741 1.00 0.00 C ATOM 1852 CD1 ILE A 115 5.393 -8.745 -2.769 1.00 0.00 C ATOM 0 H ILE A 115 4.019 -8.314 -6.965 1.00 0.00 H new ATOM 0 HA ILE A 115 3.781 -9.833 -4.611 1.00 0.00 H new ATOM 0 HB ILE A 115 4.820 -7.470 -5.062 1.00 0.00 H new ATOM 0 HG12 ILE A 115 4.369 -6.881 -2.595 1.00 0.00 H new ATOM 0 HG13 ILE A 115 3.321 -8.284 -2.548 1.00 0.00 H new ATOM 0 HG21 ILE A 115 3.405 -5.597 -4.319 1.00 0.00 H new ATOM 0 HG22 ILE A 115 2.787 -6.351 -5.808 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.003 -6.692 -4.247 1.00 0.00 H new ATOM 0 HD11 ILE A 115 5.549 -8.826 -1.693 1.00 0.00 H new ATOM 0 HD12 ILE A 115 5.215 -9.736 -3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 115 6.279 -8.311 -3.232 1.00 0.00 H new ATOM 1864 N ILE A 116 1.034 -8.324 -5.653 1.00 0.00 N ATOM 1865 CA ILE A 116 -0.409 -8.287 -5.485 1.00 0.00 C ATOM 1866 C ILE A 116 -1.004 -9.687 -5.591 1.00 0.00 C ATOM 1867 O ILE A 116 -1.988 -10.009 -4.924 1.00 0.00 O ATOM 1868 CB ILE A 116 -1.079 -7.369 -6.527 1.00 0.00 C ATOM 1869 CG1 ILE A 116 -0.470 -5.966 -6.468 1.00 0.00 C ATOM 1870 CG2 ILE A 116 -2.583 -7.309 -6.299 1.00 0.00 C ATOM 1871 CD1 ILE A 116 -0.083 -5.421 -7.824 1.00 0.00 C ATOM 0 H ILE A 116 1.386 -7.763 -6.428 1.00 0.00 H new ATOM 0 HA ILE A 116 -0.603 -7.885 -4.491 1.00 0.00 H new ATOM 0 HB ILE A 116 -0.900 -7.783 -7.519 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -1.185 -5.287 -6.003 1.00 0.00 H new ATOM 0 HG13 ILE A 116 0.412 -5.988 -5.828 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -3.038 -6.656 -7.044 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -3.005 -8.310 -6.388 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -2.785 -6.917 -5.302 1.00 0.00 H new ATOM 0 HD11 ILE A 116 0.342 -4.424 -7.708 1.00 0.00 H new ATOM 0 HD12 ILE A 116 0.655 -6.079 -8.283 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -0.966 -5.367 -8.460 1.00 0.00 H new ATOM 1883 N GLU A 117 -0.396 -10.519 -6.431 1.00 0.00 N ATOM 1884 CA GLU A 117 -0.859 -11.888 -6.622 1.00 0.00 C ATOM 1885 C GLU A 117 -0.719 -12.687 -5.333 1.00 0.00 C ATOM 1886 O GLU A 117 -1.664 -13.339 -4.888 1.00 0.00 O ATOM 1887 CB GLU A 117 -0.072 -12.563 -7.746 1.00 0.00 C ATOM 1888 CG GLU A 117 -0.907 -13.512 -8.589 1.00 0.00 C ATOM 1889 CD GLU A 117 -0.068 -14.564 -9.289 1.00 0.00 C ATOM 1890 OE1 GLU A 117 0.419 -15.488 -8.604 1.00 0.00 O ATOM 1891 OE2 GLU A 117 0.102 -14.463 -10.522 1.00 0.00 O ATOM 0 H GLU A 117 0.419 -10.268 -6.990 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.913 -11.857 -6.898 1.00 0.00 H new ATOM 0 HB2 GLU A 117 0.353 -11.795 -8.392 1.00 0.00 H new ATOM 0 HB3 GLU A 117 0.763 -13.114 -7.313 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.643 -14.004 -7.954 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -1.460 -12.939 -9.334 1.00 0.00 H new ATOM 1898 N THR A 118 0.468 -12.630 -4.733 1.00 0.00 N ATOM 1899 CA THR A 118 0.728 -13.346 -3.490 1.00 0.00 C ATOM 1900 C THR A 118 -0.213 -12.872 -2.388 1.00 0.00 C ATOM 1901 O THR A 118 -0.688 -13.669 -1.579 1.00 0.00 O ATOM 1902 CB THR A 118 2.182 -13.146 -3.057 1.00 0.00 C ATOM 1903 OG1 THR A 118 3.017 -12.938 -4.182 1.00 0.00 O ATOM 1904 CG2 THR A 118 2.742 -14.318 -2.281 1.00 0.00 C ATOM 0 H THR A 118 1.262 -12.097 -5.088 1.00 0.00 H new ATOM 0 HA THR A 118 0.552 -14.407 -3.664 1.00 0.00 H new ATOM 0 HB THR A 118 2.171 -12.272 -2.406 1.00 0.00 H new ATOM 0 HG1 THR A 118 3.942 -12.811 -3.884 1.00 0.00 H new ATOM 0 HG21 THR A 118 3.776 -14.111 -2.005 1.00 0.00 H new ATOM 0 HG22 THR A 118 2.150 -14.474 -1.379 1.00 0.00 H new ATOM 0 HG23 THR A 118 2.704 -15.215 -2.899 1.00 0.00 H new ATOM 1912 N VAL A 119 -0.483 -11.571 -2.369 1.00 0.00 N ATOM 1913 CA VAL A 119 -1.371 -10.987 -1.372 1.00 0.00 C ATOM 1914 C VAL A 119 -2.829 -11.308 -1.689 1.00 0.00 C ATOM 1915 O VAL A 119 -3.666 -11.388 -0.791 1.00 0.00 O ATOM 1916 CB VAL A 119 -1.196 -9.456 -1.292 1.00 0.00 C ATOM 1917 CG1 VAL A 119 -2.176 -8.850 -0.298 1.00 0.00 C ATOM 1918 CG2 VAL A 119 0.236 -9.103 -0.921 1.00 0.00 C ATOM 0 H VAL A 119 -0.098 -10.900 -3.034 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.105 -11.424 -0.409 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.410 -9.035 -2.275 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.034 -7.770 -0.259 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.196 -9.070 -0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.001 -9.275 0.690 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.342 -8.019 -0.869 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.479 -9.538 0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.915 -9.498 -1.676 1.00 0.00 H new ATOM 1928 N TYR A 120 -3.126 -11.485 -2.971 1.00 0.00 N ATOM 1929 CA TYR A 120 -4.483 -11.793 -3.405 1.00 0.00 C ATOM 1930 C TYR A 120 -4.959 -13.112 -2.803 1.00 0.00 C ATOM 1931 O TYR A 120 -6.116 -13.244 -2.406 1.00 0.00 O ATOM 1932 CB TYR A 120 -4.546 -11.850 -4.937 1.00 0.00 C ATOM 1933 CG TYR A 120 -5.816 -12.467 -5.489 1.00 0.00 C ATOM 1934 CD1 TYR A 120 -7.026 -12.342 -4.816 1.00 0.00 C ATOM 1935 CD2 TYR A 120 -5.801 -13.174 -6.685 1.00 0.00 C ATOM 1936 CE1 TYR A 120 -8.183 -12.905 -5.320 1.00 0.00 C ATOM 1937 CE2 TYR A 120 -6.955 -13.739 -7.194 1.00 0.00 C ATOM 1938 CZ TYR A 120 -8.143 -13.602 -6.508 1.00 0.00 C ATOM 1939 OH TYR A 120 -9.294 -14.163 -7.013 1.00 0.00 O ATOM 0 H TYR A 120 -2.445 -11.420 -3.728 1.00 0.00 H new ATOM 0 HA TYR A 120 -5.146 -11.002 -3.054 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -4.447 -10.838 -5.330 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -3.691 -12.419 -5.303 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -7.062 -11.796 -3.885 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.873 -13.284 -7.226 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -9.115 -12.799 -4.785 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.926 -14.285 -8.125 1.00 0.00 H new ATOM 0 HH TYR A 120 -9.093 -14.618 -7.857 1.00 0.00 H new ATOM 1949 N ARG A 121 -4.059 -14.083 -2.742 1.00 0.00 N ATOM 1950 CA ARG A 121 -4.386 -15.393 -2.192 1.00 0.00 C ATOM 1951 C ARG A 121 -4.209 -15.410 -0.677 1.00 0.00 C ATOM 1952 O ARG A 121 -4.973 -16.056 0.040 1.00 0.00 O ATOM 1953 CB ARG A 121 -3.512 -16.473 -2.832 1.00 0.00 C ATOM 1954 CG ARG A 121 -4.106 -17.062 -4.102 1.00 0.00 C ATOM 1955 CD ARG A 121 -3.762 -18.535 -4.245 1.00 0.00 C ATOM 1956 NE ARG A 121 -2.331 -18.782 -4.083 1.00 0.00 N ATOM 1957 CZ ARG A 121 -1.750 -19.955 -4.323 1.00 0.00 C ATOM 1958 NH1 ARG A 121 -2.473 -20.990 -4.735 1.00 0.00 N ATOM 1959 NH2 ARG A 121 -0.443 -20.095 -4.150 1.00 0.00 N ATOM 0 H ARG A 121 -3.096 -13.990 -3.066 1.00 0.00 H new ATOM 0 HA ARG A 121 -5.432 -15.601 -2.419 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -2.534 -16.049 -3.061 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -3.352 -17.274 -2.110 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -5.189 -16.940 -4.089 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -3.733 -16.514 -4.968 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -4.315 -19.110 -3.503 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -4.082 -18.888 -5.225 1.00 0.00 H new ATOM 0 HE ARG A 121 -1.743 -18.010 -3.768 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -3.479 -20.888 -4.869 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -2.022 -21.887 -4.917 1.00 0.00 H new ATOM 0 HH21 ARG A 121 0.117 -19.304 -3.833 1.00 0.00 H new ATOM 0 HH22 ARG A 121 0.002 -20.994 -4.334 1.00 0.00 H new ATOM 1973 N GLY A 122 -3.196 -14.698 -0.200 1.00 0.00 N ATOM 1974 CA GLY A 122 -2.936 -14.643 1.227 1.00 0.00 C ATOM 1975 C GLY A 122 -3.939 -13.781 1.966 1.00 0.00 C ATOM 1976 O GLY A 122 -4.383 -14.130 3.059 1.00 0.00 O ATOM 0 H GLY A 122 -2.550 -14.158 -0.775 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -2.958 -15.653 1.636 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -1.932 -14.253 1.396 1.00 0.00 H new ATOM 1980 N ALA A 123 -4.295 -12.652 1.365 1.00 0.00 N ATOM 1981 CA ALA A 123 -5.251 -11.730 1.967 1.00 0.00 C ATOM 1982 C ALA A 123 -6.682 -12.095 1.584 1.00 0.00 C ATOM 1983 O ALA A 123 -7.432 -11.261 1.078 1.00 0.00 O ATOM 1984 CB ALA A 123 -4.937 -10.301 1.548 1.00 0.00 C ATOM 0 H ALA A 123 -3.935 -12.352 0.459 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.163 -11.808 3.051 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.657 -9.622 2.004 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -3.932 -10.038 1.877 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -4.997 -10.219 0.463 1.00 0.00 H new ATOM 1990 N ARG A 124 -7.055 -13.347 1.829 1.00 0.00 N ATOM 1991 CA ARG A 124 -8.396 -13.820 1.510 1.00 0.00 C ATOM 1992 C ARG A 124 -9.326 -13.674 2.710 1.00 0.00 C ATOM 1993 O ARG A 124 -10.449 -13.188 2.583 1.00 0.00 O ATOM 1994 CB ARG A 124 -8.350 -15.282 1.060 1.00 0.00 C ATOM 1995 CG ARG A 124 -7.890 -16.240 2.147 1.00 0.00 C ATOM 1996 CD ARG A 124 -7.476 -17.582 1.566 1.00 0.00 C ATOM 1997 NE ARG A 124 -6.882 -18.456 2.576 1.00 0.00 N ATOM 1998 CZ ARG A 124 -5.668 -18.275 3.090 1.00 0.00 C ATOM 1999 NH1 ARG A 124 -4.916 -17.255 2.694 1.00 0.00 N ATOM 2000 NH2 ARG A 124 -5.203 -19.117 4.005 1.00 0.00 N ATOM 0 H ARG A 124 -6.447 -14.051 2.247 1.00 0.00 H new ATOM 0 HA ARG A 124 -8.785 -13.208 0.696 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -9.342 -15.580 0.721 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -7.681 -15.369 0.204 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -7.051 -15.802 2.689 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -8.694 -16.387 2.868 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -8.346 -18.072 1.129 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -6.761 -17.423 0.759 1.00 0.00 H new ATOM 0 HE ARG A 124 -7.430 -19.251 2.906 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -5.268 -16.604 1.992 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -3.986 -17.122 3.092 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -5.776 -19.902 4.314 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -4.273 -18.979 4.399 1.00 0.00 H new ATOM 2014 N LYS A 125 -8.849 -14.098 3.877 1.00 0.00 N ATOM 2015 CA LYS A 125 -9.637 -14.012 5.101 1.00 0.00 C ATOM 2016 C LYS A 125 -8.829 -14.489 6.302 1.00 0.00 C ATOM 2017 O LYS A 125 -7.917 -15.305 6.166 1.00 0.00 O ATOM 2018 CB LYS A 125 -10.915 -14.844 4.968 1.00 0.00 C ATOM 2019 CG LYS A 125 -10.660 -16.298 4.604 1.00 0.00 C ATOM 2020 CD LYS A 125 -11.781 -17.199 5.095 1.00 0.00 C ATOM 2021 CE LYS A 125 -12.084 -18.305 4.097 1.00 0.00 C ATOM 2022 NZ LYS A 125 -11.421 -19.586 4.468 1.00 0.00 N ATOM 0 H LYS A 125 -7.921 -14.504 4.000 1.00 0.00 H new ATOM 0 HA LYS A 125 -9.906 -12.968 5.259 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -11.464 -14.805 5.909 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -11.554 -14.394 4.208 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -10.563 -16.392 3.522 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -9.714 -16.622 5.038 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -11.503 -17.638 6.053 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -12.679 -16.605 5.265 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -13.162 -18.457 4.040 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -11.753 -17.999 3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -11.653 -20.314 3.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -10.391 -19.448 4.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -11.756 -19.892 5.404 1.00 0.00 H new ATOM 2036 N GLY A 126 -9.170 -13.975 7.480 1.00 0.00 N ATOM 2037 CA GLY A 126 -8.467 -14.361 8.690 1.00 0.00 C ATOM 2038 C GLY A 126 -9.084 -15.572 9.358 1.00 0.00 C ATOM 2039 O GLY A 126 -8.838 -16.708 8.951 1.00 0.00 O ATOM 0 H GLY A 126 -9.921 -13.298 7.618 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -7.426 -14.574 8.449 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.468 -13.525 9.389 1.00 0.00 H new ATOM 2043 N ARG A 127 -9.889 -15.332 10.389 1.00 0.00 N ATOM 2044 CA ARG A 127 -10.544 -16.414 11.116 1.00 0.00 C ATOM 2045 C ARG A 127 -11.471 -15.861 12.193 1.00 0.00 C ATOM 2046 O ARG A 127 -11.086 -15.740 13.356 1.00 0.00 O ATOM 2047 CB ARG A 127 -9.500 -17.335 11.748 1.00 0.00 C ATOM 2048 CG ARG A 127 -9.900 -18.802 11.742 1.00 0.00 C ATOM 2049 CD ARG A 127 -10.795 -19.141 12.923 1.00 0.00 C ATOM 2050 NE ARG A 127 -10.043 -19.732 14.027 1.00 0.00 N ATOM 2051 CZ ARG A 127 -10.601 -20.429 15.015 1.00 0.00 C ATOM 2052 NH1 ARG A 127 -11.913 -20.623 15.039 1.00 0.00 N ATOM 2053 NH2 ARG A 127 -9.844 -20.932 15.980 1.00 0.00 N ATOM 0 H ARG A 127 -10.103 -14.398 10.739 1.00 0.00 H new ATOM 0 HA ARG A 127 -11.142 -16.987 10.407 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -8.557 -17.222 11.214 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -9.324 -17.019 12.776 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -10.419 -19.035 10.812 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -9.005 -19.424 11.772 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -11.297 -18.237 13.269 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -11.572 -19.834 12.602 1.00 0.00 H new ATOM 0 HE ARG A 127 -9.031 -19.603 14.042 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -12.499 -20.238 14.299 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -12.336 -21.158 15.798 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -8.835 -20.785 15.965 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -10.271 -21.466 16.737 1.00 0.00 H new ATOM 2067 N GLY A 128 -12.695 -15.526 11.798 1.00 0.00 N ATOM 2068 CA GLY A 128 -13.659 -14.991 12.742 1.00 0.00 C ATOM 2069 C GLY A 128 -14.667 -16.029 13.194 1.00 0.00 C ATOM 2070 O GLY A 128 -15.708 -16.179 12.519 1.00 0.02 O ATOM 2071 OXT GLY A 128 -14.416 -16.692 14.222 1.00 0.02 O ATOM 0 H GLY A 128 -13.037 -15.615 10.841 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -13.132 -14.599 13.612 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -14.185 -14.154 12.284 1.00 0.00 H new TER 2075 GLY A 128