USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 805 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 86 THR OG1 : rot -103:sc= 0.006 USER MOD Set 1.2: A 91 GLN : amide:sc= -0.256 K(o=-0.25,f=-1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0063 USER MOD Single : A 11 HIS : no HD1:sc= -3.31! C(o=-3.3!,f=-4.3!) USER MOD Single : A 14 GLN : amide:sc= -0.102 K(o=-0.1,f=-0.85) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.0347 X(o=-0.035,f=-0.33) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 CYS SG : rot -56:sc= 0.738 USER MOD Single : A 29 MET CE :methyl -166:sc= -0.685 (180deg=-1.12) USER MOD Single : A 31 CYS SG : rot -24:sc= 0.468 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 34:sc= 0.0521 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= -0.0217 USER MOD Single : A 56 HIS : no HD1:sc= -0.109 X(o=-0.11,f=-0.56) USER MOD Single : A 57 LYS NZ :NH3+ -149:sc= -0.788 (180deg=-2!) USER MOD Single : A 58 MET CE :methyl 164:sc= -0.968 (180deg=-2.01!) USER MOD Single : A 63 ASN : amide:sc= 0.441 K(o=0.44,f=-10!) USER MOD Single : A 66 HIS : no HE2:sc= -3.3! C(o=-3.3!,f=-4.4!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 133:sc= 1.13 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot 150:sc= -5.23! USER MOD Single : A 87 ASN : amide:sc= -0.457 K(o=-0.46,f=-2.9!) USER MOD Single : A 92 ASN : amide:sc= -2.68! C(o=-2.7!,f=-5.1!) USER MOD Single : A 93 SER OG : rot 180:sc= -1.15 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 143:sc= -0.102 (180deg=-0.601) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.966 37.642 4.510 1.00 0.00 N ATOM 2 CA GLY A 1 -8.886 38.064 5.896 1.00 0.00 C ATOM 3 C GLY A 1 -7.596 37.627 6.562 1.00 0.00 C ATOM 4 O GLY A 1 -6.678 38.428 6.738 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.866 37.965 4.100 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.174 38.054 3.976 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.915 36.604 4.460 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.968 39.150 5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.733 37.654 6.447 1.00 0.00 H new ATOM 8 N SER A 2 -7.526 36.353 6.934 1.00 0.00 N ATOM 9 CA SER A 2 -6.341 35.812 7.590 1.00 0.00 C ATOM 10 C SER A 2 -5.229 35.556 6.577 1.00 0.00 C ATOM 11 O SER A 2 -5.415 35.745 5.375 1.00 0.00 O ATOM 12 CB SER A 2 -6.686 34.514 8.324 1.00 0.00 C ATOM 13 OG SER A 2 -7.323 33.592 7.457 1.00 0.00 O ATOM 0 H SER A 2 -8.276 35.676 6.792 1.00 0.00 H new ATOM 0 HA SER A 2 -5.988 36.547 8.313 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.777 34.069 8.729 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.338 34.733 9.170 1.00 0.00 H new ATOM 0 HG SER A 2 -7.532 32.771 7.949 1.00 0.00 H new ATOM 19 N SER A 3 -4.073 35.127 7.072 1.00 0.00 N ATOM 20 CA SER A 3 -2.929 34.848 6.212 1.00 0.00 C ATOM 21 C SER A 3 -2.010 33.811 6.849 1.00 0.00 C ATOM 22 O SER A 3 -1.520 33.999 7.962 1.00 0.00 O ATOM 23 CB SER A 3 -2.149 36.135 5.934 1.00 0.00 C ATOM 24 OG SER A 3 -1.139 35.919 4.964 1.00 0.00 O ATOM 0 H SER A 3 -3.904 34.965 8.065 1.00 0.00 H new ATOM 0 HA SER A 3 -3.303 34.446 5.270 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.832 36.910 5.586 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.699 36.498 6.858 1.00 0.00 H new ATOM 0 HG SER A 3 -0.656 36.756 4.803 1.00 0.00 H new ATOM 30 N GLY A 4 -1.781 32.713 6.134 1.00 0.00 N ATOM 31 CA GLY A 4 -0.922 31.661 6.645 1.00 0.00 C ATOM 32 C GLY A 4 -1.314 30.291 6.128 1.00 0.00 C ATOM 33 O GLY A 4 -1.683 29.409 6.904 1.00 0.00 O ATOM 0 H GLY A 4 -2.175 32.534 5.210 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.110 31.870 6.364 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.962 31.660 7.734 1.00 0.00 H new ATOM 37 N SER A 5 -1.236 30.111 4.813 1.00 0.00 N ATOM 38 CA SER A 5 -1.591 28.840 4.193 1.00 0.00 C ATOM 39 C SER A 5 -0.486 28.366 3.255 1.00 0.00 C ATOM 40 O SER A 5 -0.510 28.647 2.056 1.00 0.00 O ATOM 41 CB SER A 5 -2.907 28.974 3.423 1.00 0.00 C ATOM 42 OG SER A 5 -4.020 28.846 4.290 1.00 0.00 O ATOM 0 H SER A 5 -0.930 30.829 4.157 1.00 0.00 H new ATOM 0 HA SER A 5 -1.715 28.100 4.984 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.942 29.941 2.922 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.957 28.211 2.647 1.00 0.00 H new ATOM 0 HG SER A 5 -4.848 28.937 3.774 1.00 0.00 H new ATOM 48 N SER A 6 0.484 27.645 3.809 1.00 0.00 N ATOM 49 CA SER A 6 1.601 27.135 3.024 1.00 0.00 C ATOM 50 C SER A 6 1.490 25.624 2.839 1.00 0.00 C ATOM 51 O SER A 6 0.773 24.948 3.576 1.00 0.00 O ATOM 52 CB SER A 6 2.929 27.481 3.701 1.00 0.00 C ATOM 53 OG SER A 6 4.027 27.155 2.867 1.00 0.00 O ATOM 0 H SER A 6 0.518 27.401 4.799 1.00 0.00 H new ATOM 0 HA SER A 6 1.568 27.608 2.042 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.953 28.544 3.940 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.012 26.941 4.644 1.00 0.00 H new ATOM 0 HG SER A 6 4.863 27.387 3.322 1.00 0.00 H new ATOM 59 N GLY A 7 2.207 25.101 1.849 1.00 0.00 N ATOM 60 CA GLY A 7 2.175 23.674 1.584 1.00 0.00 C ATOM 61 C GLY A 7 3.553 23.106 1.304 1.00 0.00 C ATOM 62 O GLY A 7 4.432 23.808 0.805 1.00 0.00 O ATOM 0 H GLY A 7 2.809 25.639 1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.740 23.158 2.440 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.525 23.480 0.731 1.00 0.00 H new ATOM 66 N PHE A 8 3.742 21.832 1.629 1.00 0.00 N ATOM 67 CA PHE A 8 5.023 21.170 1.413 1.00 0.00 C ATOM 68 C PHE A 8 4.907 20.099 0.333 1.00 0.00 C ATOM 69 O PHE A 8 3.872 19.444 0.202 1.00 0.00 O ATOM 70 CB PHE A 8 5.525 20.544 2.716 1.00 0.00 C ATOM 71 CG PHE A 8 5.354 21.435 3.913 1.00 0.00 C ATOM 72 CD1 PHE A 8 6.254 22.458 4.166 1.00 0.00 C ATOM 73 CD2 PHE A 8 4.294 21.250 4.786 1.00 0.00 C ATOM 74 CE1 PHE A 8 6.100 23.278 5.267 1.00 0.00 C ATOM 75 CE2 PHE A 8 4.134 22.067 5.889 1.00 0.00 C ATOM 76 CZ PHE A 8 5.038 23.083 6.129 1.00 0.00 C ATOM 0 H PHE A 8 3.024 21.237 2.043 1.00 0.00 H new ATOM 0 HA PHE A 8 5.739 21.921 1.080 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.992 19.609 2.890 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.580 20.294 2.607 1.00 0.00 H new ATOM 0 HD1 PHE A 8 7.085 22.616 3.495 1.00 0.00 H new ATOM 0 HD2 PHE A 8 3.584 20.457 4.602 1.00 0.00 H new ATOM 0 HE1 PHE A 8 6.809 24.071 5.454 1.00 0.00 H new ATOM 0 HE2 PHE A 8 3.304 21.911 6.562 1.00 0.00 H new ATOM 0 HZ PHE A 8 4.915 23.724 6.989 1.00 0.00 H new ATOM 86 N ARG A 9 5.974 19.927 -0.440 1.00 0.00 N ATOM 87 CA ARG A 9 5.992 18.937 -1.510 1.00 0.00 C ATOM 88 C ARG A 9 5.801 17.529 -0.952 1.00 0.00 C ATOM 89 O ARG A 9 6.324 17.179 0.106 1.00 0.00 O ATOM 90 CB ARG A 9 7.309 19.015 -2.285 1.00 0.00 C ATOM 91 CG ARG A 9 7.421 17.989 -3.401 1.00 0.00 C ATOM 92 CD ARG A 9 8.858 17.833 -3.871 1.00 0.00 C ATOM 93 NE ARG A 9 9.360 19.046 -4.510 1.00 0.00 N ATOM 94 CZ ARG A 9 10.651 19.299 -4.697 1.00 0.00 C ATOM 95 NH1 ARG A 9 11.565 18.426 -4.297 1.00 0.00 N ATOM 96 NH2 ARG A 9 11.030 20.425 -5.287 1.00 0.00 N ATOM 0 H ARG A 9 6.838 20.461 -0.345 1.00 0.00 H new ATOM 0 HA ARG A 9 5.166 19.157 -2.187 1.00 0.00 H new ATOM 0 HB2 ARG A 9 7.412 20.014 -2.709 1.00 0.00 H new ATOM 0 HB3 ARG A 9 8.138 18.876 -1.591 1.00 0.00 H new ATOM 0 HG2 ARG A 9 7.045 17.027 -3.052 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.794 18.292 -4.239 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.492 17.582 -3.021 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.922 17.001 -4.572 1.00 0.00 H new ATOM 0 HE ARG A 9 8.682 19.737 -4.831 1.00 0.00 H new ATOM 0 HH11 ARG A 9 11.278 17.558 -3.845 1.00 0.00 H new ATOM 0 HH12 ARG A 9 12.555 18.622 -4.442 1.00 0.00 H new ATOM 0 HH21 ARG A 9 10.330 21.098 -5.598 1.00 0.00 H new ATOM 0 HH22 ARG A 9 12.021 20.617 -5.430 1.00 0.00 H new ATOM 110 N PRO A 10 5.034 16.703 -1.678 1.00 0.00 N ATOM 111 CA PRO A 10 4.756 15.321 -1.276 1.00 0.00 C ATOM 112 C PRO A 10 5.988 14.429 -1.380 1.00 0.00 C ATOM 113 O PRO A 10 6.383 14.025 -2.475 1.00 0.00 O ATOM 114 CB PRO A 10 3.683 14.871 -2.270 1.00 0.00 C ATOM 115 CG PRO A 10 3.893 15.730 -3.469 1.00 0.00 C ATOM 116 CD PRO A 10 4.379 17.055 -2.950 1.00 0.00 C ATOM 0 HA PRO A 10 4.444 15.254 -0.234 1.00 0.00 H new ATOM 0 HB2 PRO A 10 3.790 13.815 -2.516 1.00 0.00 H new ATOM 0 HB3 PRO A 10 2.682 15.003 -1.859 1.00 0.00 H new ATOM 0 HG2 PRO A 10 4.623 15.284 -4.145 1.00 0.00 H new ATOM 0 HG3 PRO A 10 2.967 15.847 -4.032 1.00 0.00 H new ATOM 0 HD2 PRO A 10 5.075 17.527 -3.643 1.00 0.00 H new ATOM 0 HD3 PRO A 10 3.556 17.754 -2.799 1.00 0.00 H new ATOM 124 N HIS A 11 6.591 14.123 -0.236 1.00 0.00 N ATOM 125 CA HIS A 11 7.778 13.276 -0.199 1.00 0.00 C ATOM 126 C HIS A 11 7.581 12.105 0.758 1.00 0.00 C ATOM 127 O HIS A 11 7.251 12.296 1.929 1.00 0.00 O ATOM 128 CB HIS A 11 9.000 14.093 0.221 1.00 0.00 C ATOM 129 CG HIS A 11 10.093 13.267 0.827 1.00 0.00 C ATOM 130 ND1 HIS A 11 10.534 12.082 0.278 1.00 0.00 N ATOM 131 CD2 HIS A 11 10.835 13.462 1.943 1.00 0.00 C ATOM 132 CE1 HIS A 11 11.499 11.583 1.030 1.00 0.00 C ATOM 133 NE2 HIS A 11 11.701 12.402 2.046 1.00 0.00 N ATOM 0 H HIS A 11 6.277 14.449 0.678 1.00 0.00 H new ATOM 0 HA HIS A 11 7.942 12.879 -1.201 1.00 0.00 H new ATOM 0 HB2 HIS A 11 9.393 14.618 -0.650 1.00 0.00 H new ATOM 0 HB3 HIS A 11 8.690 14.853 0.938 1.00 0.00 H new ATOM 0 HD2 HIS A 11 10.759 14.296 2.625 1.00 0.00 H new ATOM 0 HE1 HIS A 11 12.032 10.662 0.845 1.00 0.00 H new ATOM 0 HE2 HIS A 11 12.389 12.269 2.787 1.00 0.00 H new ATOM 141 N PHE A 12 7.784 10.893 0.253 1.00 0.00 N ATOM 142 CA PHE A 12 7.626 9.690 1.063 1.00 0.00 C ATOM 143 C PHE A 12 8.828 9.493 1.982 1.00 0.00 C ATOM 144 O PHE A 12 9.913 9.121 1.534 1.00 0.00 O ATOM 145 CB PHE A 12 7.450 8.464 0.164 1.00 0.00 C ATOM 146 CG PHE A 12 6.117 8.413 -0.525 1.00 0.00 C ATOM 147 CD1 PHE A 12 4.966 8.108 0.184 1.00 0.00 C ATOM 148 CD2 PHE A 12 6.015 8.668 -1.883 1.00 0.00 C ATOM 149 CE1 PHE A 12 3.738 8.060 -0.448 1.00 0.00 C ATOM 150 CE2 PHE A 12 4.789 8.622 -2.520 1.00 0.00 C ATOM 151 CZ PHE A 12 3.649 8.317 -1.802 1.00 0.00 C ATOM 0 H PHE A 12 8.058 10.717 -0.714 1.00 0.00 H new ATOM 0 HA PHE A 12 6.735 9.810 1.679 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.239 8.458 -0.588 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.575 7.563 0.764 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.029 7.905 1.243 1.00 0.00 H new ATOM 0 HD2 PHE A 12 6.903 8.905 -2.450 1.00 0.00 H new ATOM 0 HE1 PHE A 12 2.849 7.822 0.116 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.722 8.824 -3.579 1.00 0.00 H new ATOM 0 HZ PHE A 12 2.690 8.280 -2.298 1.00 0.00 H new ATOM 161 N LEU A 13 8.626 9.745 3.271 1.00 0.00 N ATOM 162 CA LEU A 13 9.693 9.596 4.255 1.00 0.00 C ATOM 163 C LEU A 13 9.945 8.124 4.566 1.00 0.00 C ATOM 164 O LEU A 13 11.092 7.690 4.670 1.00 0.00 O ATOM 165 CB LEU A 13 9.336 10.346 5.540 1.00 0.00 C ATOM 166 CG LEU A 13 8.929 11.810 5.372 1.00 0.00 C ATOM 167 CD1 LEU A 13 8.299 12.340 6.651 1.00 0.00 C ATOM 168 CD2 LEU A 13 10.131 12.655 4.977 1.00 0.00 C ATOM 0 H LEU A 13 7.734 10.053 3.659 1.00 0.00 H new ATOM 0 HA LEU A 13 10.604 10.021 3.834 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.519 9.817 6.031 1.00 0.00 H new ATOM 0 HB3 LEU A 13 10.193 10.303 6.212 1.00 0.00 H new ATOM 0 HG LEU A 13 8.188 11.872 4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 13 8.016 13.383 6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 13 7.413 11.752 6.891 1.00 0.00 H new ATOM 0 HD13 LEU A 13 9.016 12.265 7.468 1.00 0.00 H new ATOM 0 HD21 LEU A 13 9.823 13.694 4.862 1.00 0.00 H new ATOM 0 HD22 LEU A 13 10.894 12.587 5.752 1.00 0.00 H new ATOM 0 HD23 LEU A 13 10.538 12.290 4.034 1.00 0.00 H new ATOM 180 N GLN A 14 8.866 7.361 4.710 1.00 0.00 N ATOM 181 CA GLN A 14 8.972 5.937 5.007 1.00 0.00 C ATOM 182 C GLN A 14 8.214 5.109 3.975 1.00 0.00 C ATOM 183 O GLN A 14 6.993 5.213 3.856 1.00 0.00 O ATOM 184 CB GLN A 14 8.434 5.646 6.408 1.00 0.00 C ATOM 185 CG GLN A 14 8.873 4.299 6.961 1.00 0.00 C ATOM 186 CD GLN A 14 8.984 4.297 8.473 1.00 0.00 C ATOM 187 OE1 GLN A 14 9.441 5.269 9.075 1.00 0.00 O ATOM 188 NE2 GLN A 14 8.565 3.202 9.096 1.00 0.00 N ATOM 0 H GLN A 14 7.909 7.705 4.626 1.00 0.00 H new ATOM 0 HA GLN A 14 10.025 5.659 4.966 1.00 0.00 H new ATOM 0 HB2 GLN A 14 8.765 6.433 7.086 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.345 5.682 6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.161 3.534 6.652 1.00 0.00 H new ATOM 0 HG3 GLN A 14 9.837 4.030 6.529 1.00 0.00 H new ATOM 0 HE21 GLN A 14 8.193 2.420 8.558 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.615 3.143 10.113 1.00 0.00 H new ATOM 197 N ALA A 15 8.945 4.285 3.231 1.00 0.00 N ATOM 198 CA ALA A 15 8.342 3.437 2.211 1.00 0.00 C ATOM 199 C ALA A 15 8.671 1.968 2.452 1.00 0.00 C ATOM 200 O ALA A 15 9.743 1.621 2.950 1.00 0.00 O ATOM 201 CB ALA A 15 8.807 3.864 0.827 1.00 0.00 C ATOM 0 H ALA A 15 9.957 4.187 3.316 1.00 0.00 H new ATOM 0 HA ALA A 15 7.260 3.554 2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.349 3.222 0.075 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.514 4.899 0.648 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.892 3.778 0.765 1.00 0.00 H new ATOM 207 N PRO A 16 7.730 1.083 2.093 1.00 0.00 N ATOM 208 CA PRO A 16 7.899 -0.364 2.261 1.00 0.00 C ATOM 209 C PRO A 16 8.943 -0.940 1.311 1.00 0.00 C ATOM 210 O PRO A 16 9.524 -0.220 0.500 1.00 0.00 O ATOM 211 CB PRO A 16 6.512 -0.923 1.934 1.00 0.00 C ATOM 212 CG PRO A 16 5.894 0.096 1.039 1.00 0.00 C ATOM 213 CD PRO A 16 6.429 1.426 1.494 1.00 0.00 C ATOM 0 HA PRO A 16 8.252 -0.620 3.260 1.00 0.00 H new ATOM 0 HB2 PRO A 16 6.582 -1.893 1.441 1.00 0.00 H new ATOM 0 HB3 PRO A 16 5.920 -1.067 2.838 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.152 -0.092 -0.003 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.807 0.068 1.109 1.00 0.00 H new ATOM 0 HD2 PRO A 16 6.540 2.121 0.661 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.766 1.900 2.218 1.00 0.00 H new ATOM 221 N GLY A 17 9.177 -2.245 1.417 1.00 0.00 N ATOM 222 CA GLY A 17 10.151 -2.896 0.560 1.00 0.00 C ATOM 223 C GLY A 17 9.695 -4.266 0.101 1.00 0.00 C ATOM 224 O GLY A 17 8.528 -4.457 -0.243 1.00 0.00 O ATOM 0 H GLY A 17 8.710 -2.863 2.081 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.341 -2.269 -0.311 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.095 -2.991 1.096 1.00 0.00 H new ATOM 228 N ASP A 18 10.617 -5.223 0.093 1.00 0.00 N ATOM 229 CA ASP A 18 10.303 -6.583 -0.329 1.00 0.00 C ATOM 230 C ASP A 18 9.828 -7.423 0.853 1.00 0.00 C ATOM 231 O ASP A 18 10.626 -7.833 1.697 1.00 0.00 O ATOM 232 CB ASP A 18 11.527 -7.235 -0.974 1.00 0.00 C ATOM 233 CG ASP A 18 12.827 -6.786 -0.334 1.00 0.00 C ATOM 234 OD1 ASP A 18 13.258 -5.645 -0.604 1.00 0.00 O ATOM 235 OD2 ASP A 18 13.411 -7.575 0.437 1.00 0.00 O ATOM 0 H ASP A 18 11.587 -5.082 0.374 1.00 0.00 H new ATOM 0 HA ASP A 18 9.498 -6.533 -1.063 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.442 -8.319 -0.895 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.546 -6.993 -2.037 1.00 0.00 H new ATOM 240 N LEU A 19 8.525 -7.674 0.907 1.00 0.00 N ATOM 241 CA LEU A 19 7.943 -8.464 1.986 1.00 0.00 C ATOM 242 C LEU A 19 7.510 -9.838 1.483 1.00 0.00 C ATOM 243 O LEU A 19 7.335 -10.045 0.282 1.00 0.00 O ATOM 244 CB LEU A 19 6.746 -7.731 2.594 1.00 0.00 C ATOM 245 CG LEU A 19 6.994 -6.286 3.028 1.00 0.00 C ATOM 246 CD1 LEU A 19 5.699 -5.636 3.488 1.00 0.00 C ATOM 247 CD2 LEU A 19 8.041 -6.232 4.131 1.00 0.00 C ATOM 0 H LEU A 19 7.852 -7.342 0.217 1.00 0.00 H new ATOM 0 HA LEU A 19 8.705 -8.602 2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.934 -7.737 1.867 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.402 -8.296 3.460 1.00 0.00 H new ATOM 0 HG LEU A 19 7.370 -5.730 2.170 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.896 -4.608 3.793 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.979 -5.640 2.670 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.292 -6.193 4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.204 -5.196 4.427 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.693 -6.805 4.991 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.976 -6.657 3.766 1.00 0.00 H new ATOM 259 N THR A 20 7.337 -10.775 2.411 1.00 0.00 N ATOM 260 CA THR A 20 6.923 -12.128 2.062 1.00 0.00 C ATOM 261 C THR A 20 5.701 -12.554 2.867 1.00 0.00 C ATOM 262 O THR A 20 5.667 -12.406 4.089 1.00 0.00 O ATOM 263 CB THR A 20 8.059 -13.141 2.299 1.00 0.00 C ATOM 264 OG1 THR A 20 9.306 -12.590 1.864 1.00 0.00 O ATOM 265 CG2 THR A 20 7.787 -14.442 1.559 1.00 0.00 C ATOM 0 H THR A 20 7.477 -10.621 3.410 1.00 0.00 H new ATOM 0 HA THR A 20 6.670 -12.118 1.002 1.00 0.00 H new ATOM 0 HB THR A 20 8.110 -13.353 3.367 1.00 0.00 H new ATOM 0 HG1 THR A 20 10.023 -13.240 2.020 1.00 0.00 H new ATOM 0 HG21 THR A 20 8.603 -15.142 1.741 1.00 0.00 H new ATOM 0 HG22 THR A 20 6.852 -14.874 1.915 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.711 -14.244 0.490 1.00 0.00 H new ATOM 273 N VAL A 21 4.697 -13.084 2.175 1.00 0.00 N ATOM 274 CA VAL A 21 3.473 -13.534 2.827 1.00 0.00 C ATOM 275 C VAL A 21 2.943 -14.809 2.181 1.00 0.00 C ATOM 276 O VAL A 21 2.907 -14.927 0.957 1.00 0.00 O ATOM 277 CB VAL A 21 2.379 -12.451 2.773 1.00 0.00 C ATOM 278 CG1 VAL A 21 1.076 -12.980 3.354 1.00 0.00 C ATOM 279 CG2 VAL A 21 2.831 -11.200 3.509 1.00 0.00 C ATOM 0 H VAL A 21 4.707 -13.212 1.163 1.00 0.00 H new ATOM 0 HA VAL A 21 3.724 -13.736 3.868 1.00 0.00 H new ATOM 0 HB VAL A 21 2.204 -12.187 1.730 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.314 -12.202 3.308 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.746 -13.845 2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.233 -13.273 4.392 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.046 -10.446 3.461 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.035 -11.445 4.551 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.737 -10.811 3.044 1.00 0.00 H new ATOM 289 N GLN A 22 2.533 -15.761 3.013 1.00 0.00 N ATOM 290 CA GLN A 22 2.005 -17.029 2.522 1.00 0.00 C ATOM 291 C GLN A 22 0.548 -16.883 2.098 1.00 0.00 C ATOM 292 O GLN A 22 -0.241 -16.220 2.771 1.00 0.00 O ATOM 293 CB GLN A 22 2.131 -18.108 3.598 1.00 0.00 C ATOM 294 CG GLN A 22 2.257 -19.515 3.037 1.00 0.00 C ATOM 295 CD GLN A 22 2.084 -20.585 4.097 1.00 0.00 C ATOM 296 OE1 GLN A 22 0.963 -20.980 4.420 1.00 0.00 O ATOM 297 NE2 GLN A 22 3.196 -21.060 4.646 1.00 0.00 N ATOM 0 H GLN A 22 2.556 -15.679 4.029 1.00 0.00 H new ATOM 0 HA GLN A 22 2.589 -17.325 1.651 1.00 0.00 H new ATOM 0 HB2 GLN A 22 3.003 -17.893 4.216 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.259 -18.063 4.250 1.00 0.00 H new ATOM 0 HG2 GLN A 22 1.510 -19.659 2.256 1.00 0.00 H new ATOM 0 HG3 GLN A 22 3.234 -19.629 2.568 1.00 0.00 H new ATOM 0 HE21 GLN A 22 4.104 -20.704 4.348 1.00 0.00 H new ATOM 0 HE22 GLN A 22 3.142 -21.781 5.366 1.00 0.00 H new ATOM 306 N GLU A 23 0.197 -17.508 0.978 1.00 0.00 N ATOM 307 CA GLU A 23 -1.166 -17.446 0.464 1.00 0.00 C ATOM 308 C GLU A 23 -2.180 -17.626 1.590 1.00 0.00 C ATOM 309 O GLU A 23 -2.048 -18.522 2.422 1.00 0.00 O ATOM 310 CB GLU A 23 -1.380 -18.518 -0.606 1.00 0.00 C ATOM 311 CG GLU A 23 -2.767 -18.491 -1.226 1.00 0.00 C ATOM 312 CD GLU A 23 -3.151 -19.815 -1.857 1.00 0.00 C ATOM 313 OE1 GLU A 23 -3.302 -20.806 -1.112 1.00 0.00 O ATOM 314 OE2 GLU A 23 -3.301 -19.860 -3.096 1.00 0.00 O ATOM 0 H GLU A 23 0.837 -18.063 0.410 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.315 -16.463 0.018 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.637 -18.387 -1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.208 -19.500 -0.164 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -3.498 -18.233 -0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -2.807 -17.707 -1.982 1.00 0.00 H new ATOM 321 N GLY A 24 -3.194 -16.765 1.609 1.00 0.00 N ATOM 322 CA GLY A 24 -4.216 -16.845 2.636 1.00 0.00 C ATOM 323 C GLY A 24 -3.742 -16.299 3.969 1.00 0.00 C ATOM 324 O GLY A 24 -4.121 -16.804 5.026 1.00 0.00 O ATOM 0 H GLY A 24 -3.325 -16.014 0.931 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.097 -16.290 2.312 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.522 -17.884 2.760 1.00 0.00 H new ATOM 328 N LYS A 25 -2.907 -15.266 3.920 1.00 0.00 N ATOM 329 CA LYS A 25 -2.379 -14.651 5.132 1.00 0.00 C ATOM 330 C LYS A 25 -2.634 -13.147 5.134 1.00 0.00 C ATOM 331 O LYS A 25 -3.072 -12.580 4.132 1.00 0.00 O ATOM 332 CB LYS A 25 -0.879 -14.925 5.256 1.00 0.00 C ATOM 333 CG LYS A 25 -0.546 -16.389 5.488 1.00 0.00 C ATOM 334 CD LYS A 25 -0.925 -16.831 6.892 1.00 0.00 C ATOM 335 CE LYS A 25 0.210 -16.597 7.876 1.00 0.00 C ATOM 336 NZ LYS A 25 -0.079 -17.197 9.208 1.00 0.00 N ATOM 0 H LYS A 25 -2.582 -14.837 3.054 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.894 -15.090 5.986 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.380 -14.587 4.348 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.477 -14.335 6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.073 -17.003 4.758 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.520 -16.550 5.330 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.810 -16.286 7.220 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.188 -17.889 6.883 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.130 -17.024 7.477 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.378 -15.526 7.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.718 -17.016 9.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.943 -16.772 9.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.214 -18.223 9.105 1.00 0.00 H new ATOM 350 N LEU A 26 -2.355 -12.506 6.263 1.00 0.00 N ATOM 351 CA LEU A 26 -2.552 -11.066 6.395 1.00 0.00 C ATOM 352 C LEU A 26 -1.350 -10.300 5.852 1.00 0.00 C ATOM 353 O LEU A 26 -0.204 -10.605 6.186 1.00 0.00 O ATOM 354 CB LEU A 26 -2.788 -10.695 7.860 1.00 0.00 C ATOM 355 CG LEU A 26 -3.208 -9.250 8.127 1.00 0.00 C ATOM 356 CD1 LEU A 26 -2.013 -8.316 8.010 1.00 0.00 C ATOM 357 CD2 LEU A 26 -4.312 -8.829 7.169 1.00 0.00 C ATOM 0 H LEU A 26 -1.992 -12.960 7.101 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.430 -10.790 5.811 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.556 -11.356 8.262 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.872 -10.895 8.417 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.594 -9.187 9.144 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.332 -7.292 8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.254 -8.603 8.738 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.596 -8.383 7.005 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.598 -7.797 7.374 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.953 -8.909 6.143 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.177 -9.479 7.303 1.00 0.00 H new ATOM 369 N CYS A 27 -1.619 -9.305 5.015 1.00 0.00 N ATOM 370 CA CYS A 27 -0.559 -8.493 4.426 1.00 0.00 C ATOM 371 C CYS A 27 -0.862 -7.007 4.581 1.00 0.00 C ATOM 372 O CYS A 27 -1.704 -6.457 3.871 1.00 0.00 O ATOM 373 CB CYS A 27 -0.386 -8.839 2.946 1.00 0.00 C ATOM 374 SG CYS A 27 0.842 -7.825 2.090 1.00 0.00 S ATOM 0 H CYS A 27 -2.562 -9.040 4.728 1.00 0.00 H new ATOM 0 HA CYS A 27 0.369 -8.713 4.954 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -0.100 -9.887 2.860 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -1.347 -8.729 2.443 1.00 0.00 H new ATOM 0 HG CYS A 27 0.537 -6.568 2.225 1.00 0.00 H new ATOM 380 N ARG A 28 -0.172 -6.362 5.516 1.00 0.00 N ATOM 381 CA ARG A 28 -0.369 -4.939 5.767 1.00 0.00 C ATOM 382 C ARG A 28 0.879 -4.144 5.397 1.00 0.00 C ATOM 383 O ARG A 28 2.002 -4.618 5.565 1.00 0.00 O ATOM 384 CB ARG A 28 -0.721 -4.703 7.237 1.00 0.00 C ATOM 385 CG ARG A 28 0.473 -4.802 8.172 1.00 0.00 C ATOM 386 CD ARG A 28 0.039 -5.080 9.603 1.00 0.00 C ATOM 387 NE ARG A 28 1.154 -4.989 10.541 1.00 0.00 N ATOM 388 CZ ARG A 28 1.023 -5.131 11.855 1.00 0.00 C ATOM 389 NH1 ARG A 28 -0.170 -5.371 12.383 1.00 0.00 N ATOM 390 NH2 ARG A 28 2.085 -5.035 12.644 1.00 0.00 N ATOM 0 H ARG A 28 0.529 -6.802 6.112 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.195 -4.596 5.143 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.172 -3.716 7.340 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -1.473 -5.430 7.543 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.138 -5.596 7.832 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.042 -3.873 8.137 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -0.736 -4.370 9.891 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -0.403 -6.075 9.661 1.00 0.00 H new ATOM 0 HE ARG A 28 2.085 -4.806 10.167 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.989 -5.447 11.780 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.268 -5.480 13.392 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.004 -4.852 12.242 1.00 0.00 H new ATOM 0 HH22 ARG A 28 1.982 -5.144 13.653 1.00 0.00 H new ATOM 404 N MET A 29 0.674 -2.932 4.892 1.00 0.00 N ATOM 405 CA MET A 29 1.783 -2.070 4.499 1.00 0.00 C ATOM 406 C MET A 29 1.680 -0.708 5.178 1.00 0.00 C ATOM 407 O MET A 29 0.618 -0.327 5.669 1.00 0.00 O ATOM 408 CB MET A 29 1.807 -1.894 2.979 1.00 0.00 C ATOM 409 CG MET A 29 2.272 -3.134 2.232 1.00 0.00 C ATOM 410 SD MET A 29 0.921 -4.270 1.864 1.00 0.00 S ATOM 411 CE MET A 29 0.902 -4.205 0.074 1.00 0.00 C ATOM 0 H MET A 29 -0.249 -2.525 4.745 1.00 0.00 H new ATOM 0 HA MET A 29 2.710 -2.546 4.817 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.807 -1.627 2.636 1.00 0.00 H new ATOM 0 HB3 MET A 29 2.463 -1.061 2.728 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.753 -2.834 1.301 1.00 0.00 H new ATOM 0 HG3 MET A 29 3.025 -3.651 2.827 1.00 0.00 H new ATOM 0 HE1 MET A 29 -0.022 -4.649 -0.296 1.00 0.00 H new ATOM 0 HE2 MET A 29 0.962 -3.167 -0.253 1.00 0.00 H new ATOM 0 HE3 MET A 29 1.754 -4.759 -0.319 1.00 0.00 H new ATOM 421 N ASP A 30 2.791 0.021 5.203 1.00 0.00 N ATOM 422 CA ASP A 30 2.825 1.341 5.821 1.00 0.00 C ATOM 423 C ASP A 30 3.640 2.316 4.977 1.00 0.00 C ATOM 424 O ASP A 30 4.708 1.971 4.470 1.00 0.00 O ATOM 425 CB ASP A 30 3.414 1.252 7.230 1.00 0.00 C ATOM 426 CG ASP A 30 4.848 0.760 7.229 1.00 0.00 C ATOM 427 OD1 ASP A 30 5.054 -0.467 7.119 1.00 0.00 O ATOM 428 OD2 ASP A 30 5.764 1.602 7.336 1.00 0.00 O ATOM 0 H ASP A 30 3.679 -0.280 4.802 1.00 0.00 H new ATOM 0 HA ASP A 30 1.802 1.712 5.885 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.370 2.234 7.701 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.803 0.581 7.834 1.00 0.00 H new ATOM 433 N CYS A 31 3.128 3.533 4.829 1.00 0.00 N ATOM 434 CA CYS A 31 3.808 4.557 4.044 1.00 0.00 C ATOM 435 C CYS A 31 3.603 5.938 4.659 1.00 0.00 C ATOM 436 O CYS A 31 2.474 6.354 4.917 1.00 0.00 O ATOM 437 CB CYS A 31 3.297 4.547 2.602 1.00 0.00 C ATOM 438 SG CYS A 31 1.561 5.024 2.431 1.00 0.00 S ATOM 0 H CYS A 31 2.245 3.834 5.242 1.00 0.00 H new ATOM 0 HA CYS A 31 4.875 4.333 4.045 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.909 5.224 2.006 1.00 0.00 H new ATOM 0 HB3 CYS A 31 3.431 3.548 2.187 1.00 0.00 H new ATOM 0 HG CYS A 31 0.938 4.804 3.551 1.00 0.00 H new ATOM 444 N LYS A 32 4.704 6.644 4.893 1.00 0.00 N ATOM 445 CA LYS A 32 4.647 7.979 5.478 1.00 0.00 C ATOM 446 C LYS A 32 4.937 9.046 4.428 1.00 0.00 C ATOM 447 O LYS A 32 5.976 9.017 3.769 1.00 0.00 O ATOM 448 CB LYS A 32 5.649 8.096 6.630 1.00 0.00 C ATOM 449 CG LYS A 32 5.229 9.086 7.702 1.00 0.00 C ATOM 450 CD LYS A 32 5.464 10.520 7.260 1.00 0.00 C ATOM 451 CE LYS A 32 5.024 11.512 8.326 1.00 0.00 C ATOM 452 NZ LYS A 32 3.574 11.832 8.222 1.00 0.00 N ATOM 0 H LYS A 32 5.647 6.314 4.687 1.00 0.00 H new ATOM 0 HA LYS A 32 3.640 8.138 5.863 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.783 7.115 7.085 1.00 0.00 H new ATOM 0 HB3 LYS A 32 6.617 8.396 6.229 1.00 0.00 H new ATOM 0 HG2 LYS A 32 4.174 8.945 7.936 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.787 8.891 8.618 1.00 0.00 H new ATOM 0 HD2 LYS A 32 6.522 10.665 7.041 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.918 10.711 6.336 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.235 11.101 9.313 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.606 12.429 8.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.314 12.511 8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.376 12.248 7.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.017 10.961 8.338 1.00 0.00 H new ATOM 466 N VAL A 33 4.012 9.989 4.278 1.00 0.00 N ATOM 467 CA VAL A 33 4.169 11.067 3.310 1.00 0.00 C ATOM 468 C VAL A 33 3.907 12.425 3.952 1.00 0.00 C ATOM 469 O VAL A 33 2.953 12.590 4.711 1.00 0.00 O ATOM 470 CB VAL A 33 3.220 10.888 2.110 1.00 0.00 C ATOM 471 CG1 VAL A 33 1.770 11.015 2.552 1.00 0.00 C ATOM 472 CG2 VAL A 33 3.544 11.897 1.019 1.00 0.00 C ATOM 0 H VAL A 33 3.146 10.028 4.815 1.00 0.00 H new ATOM 0 HA VAL A 33 5.200 11.027 2.958 1.00 0.00 H new ATOM 0 HB VAL A 33 3.364 9.888 1.702 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.114 10.886 1.691 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.548 10.249 3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.607 12.001 2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.864 11.756 0.179 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.430 12.907 1.412 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.571 11.752 0.683 1.00 0.00 H new ATOM 482 N SER A 34 4.761 13.395 3.641 1.00 0.00 N ATOM 483 CA SER A 34 4.624 14.739 4.191 1.00 0.00 C ATOM 484 C SER A 34 4.082 15.703 3.140 1.00 0.00 C ATOM 485 O SER A 34 4.501 15.678 1.984 1.00 0.00 O ATOM 486 CB SER A 34 5.973 15.240 4.711 1.00 0.00 C ATOM 487 OG SER A 34 5.827 16.462 5.413 1.00 0.00 O ATOM 0 H SER A 34 5.555 13.276 3.012 1.00 0.00 H new ATOM 0 HA SER A 34 3.917 14.696 5.019 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.414 14.490 5.368 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.660 15.377 3.876 1.00 0.00 H new ATOM 0 HG SER A 34 6.703 16.760 5.736 1.00 0.00 H new ATOM 493 N GLY A 35 3.145 16.552 3.552 1.00 0.00 N ATOM 494 CA GLY A 35 2.560 17.512 2.635 1.00 0.00 C ATOM 495 C GLY A 35 1.344 18.204 3.219 1.00 0.00 C ATOM 496 O GLY A 35 0.665 17.655 4.088 1.00 0.00 O ATOM 0 H GLY A 35 2.781 16.592 4.504 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.308 18.260 2.371 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.277 17.004 1.713 1.00 0.00 H new ATOM 500 N LEU A 36 1.068 19.413 2.744 1.00 0.00 N ATOM 501 CA LEU A 36 -0.074 20.183 3.225 1.00 0.00 C ATOM 502 C LEU A 36 -0.716 20.973 2.089 1.00 0.00 C ATOM 503 O LEU A 36 -0.071 21.783 1.422 1.00 0.00 O ATOM 504 CB LEU A 36 0.361 21.134 4.341 1.00 0.00 C ATOM 505 CG LEU A 36 -0.757 21.921 5.025 1.00 0.00 C ATOM 506 CD1 LEU A 36 -1.472 21.054 6.050 1.00 0.00 C ATOM 507 CD2 LEU A 36 -0.201 23.176 5.682 1.00 0.00 C ATOM 0 H LEU A 36 1.620 19.882 2.026 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.812 19.484 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.887 20.555 5.100 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.077 21.844 3.928 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.480 22.221 4.266 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.264 21.632 6.526 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.905 20.185 5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.760 20.723 6.806 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.011 23.724 6.164 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.543 22.897 6.428 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.264 23.808 4.925 1.00 0.00 H new ATOM 519 N PRO A 37 -2.017 20.736 1.864 1.00 0.00 N ATOM 520 CA PRO A 37 -2.794 19.775 2.652 1.00 0.00 C ATOM 521 C PRO A 37 -2.383 18.332 2.376 1.00 0.00 C ATOM 522 O PRO A 37 -1.520 18.071 1.537 1.00 0.00 O ATOM 523 CB PRO A 37 -4.233 20.018 2.190 1.00 0.00 C ATOM 524 CG PRO A 37 -4.100 20.584 0.818 1.00 0.00 C ATOM 525 CD PRO A 37 -2.829 21.388 0.824 1.00 0.00 C ATOM 0 HA PRO A 37 -2.646 19.913 3.723 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -4.808 19.092 2.182 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.751 20.709 2.855 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.057 19.791 0.071 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.957 21.210 0.569 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.334 21.363 -0.147 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -3.017 22.435 1.059 1.00 0.00 H new ATOM 533 N THR A 38 -3.007 17.398 3.086 1.00 0.00 N ATOM 534 CA THR A 38 -2.705 15.982 2.918 1.00 0.00 C ATOM 535 C THR A 38 -2.570 15.620 1.443 1.00 0.00 C ATOM 536 O THR A 38 -3.429 15.938 0.620 1.00 0.00 O ATOM 537 CB THR A 38 -3.793 15.096 3.555 1.00 0.00 C ATOM 538 OG1 THR A 38 -5.087 15.508 3.101 1.00 0.00 O ATOM 539 CG2 THR A 38 -3.733 15.174 5.073 1.00 0.00 C ATOM 0 H THR A 38 -3.725 17.596 3.783 1.00 0.00 H new ATOM 0 HA THR A 38 -1.756 15.799 3.423 1.00 0.00 H new ATOM 0 HB THR A 38 -3.614 14.064 3.253 1.00 0.00 H new ATOM 0 HG1 THR A 38 -5.024 15.821 2.174 1.00 0.00 H new ATOM 0 HG21 THR A 38 -4.510 14.541 5.501 1.00 0.00 H new ATOM 0 HG22 THR A 38 -2.757 14.832 5.417 1.00 0.00 H new ATOM 0 HG23 THR A 38 -3.889 16.205 5.391 1.00 0.00 H new ATOM 547 N PRO A 39 -1.468 14.938 1.099 1.00 0.00 N ATOM 548 CA PRO A 39 -1.195 14.517 -0.279 1.00 0.00 C ATOM 549 C PRO A 39 -2.141 13.415 -0.746 1.00 0.00 C ATOM 550 O PRO A 39 -2.255 12.370 -0.106 1.00 0.00 O ATOM 551 CB PRO A 39 0.242 13.995 -0.212 1.00 0.00 C ATOM 552 CG PRO A 39 0.429 13.580 1.206 1.00 0.00 C ATOM 553 CD PRO A 39 -0.402 14.526 2.028 1.00 0.00 C ATOM 0 HA PRO A 39 -1.334 15.332 -0.990 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.391 13.157 -0.893 1.00 0.00 H new ATOM 0 HB3 PRO A 39 0.957 14.767 -0.496 1.00 0.00 H new ATOM 0 HG2 PRO A 39 0.109 12.549 1.356 1.00 0.00 H new ATOM 0 HG3 PRO A 39 1.479 13.633 1.493 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -0.808 14.038 2.914 1.00 0.00 H new ATOM 0 HD3 PRO A 39 0.183 15.379 2.373 1.00 0.00 H new ATOM 561 N ASP A 40 -2.816 13.656 -1.864 1.00 0.00 N ATOM 562 CA ASP A 40 -3.751 12.684 -2.418 1.00 0.00 C ATOM 563 C ASP A 40 -3.023 11.669 -3.294 1.00 0.00 C ATOM 564 O ASP A 40 -2.682 11.955 -4.442 1.00 0.00 O ATOM 565 CB ASP A 40 -4.835 13.392 -3.231 1.00 0.00 C ATOM 566 CG ASP A 40 -5.543 14.471 -2.435 1.00 0.00 C ATOM 567 OD1 ASP A 40 -6.166 14.137 -1.405 1.00 0.00 O ATOM 568 OD2 ASP A 40 -5.473 15.650 -2.841 1.00 0.00 O ATOM 0 H ASP A 40 -2.733 14.517 -2.405 1.00 0.00 H new ATOM 0 HA ASP A 40 -4.219 12.153 -1.589 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -4.387 13.835 -4.120 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.565 12.659 -3.574 1.00 0.00 H new ATOM 573 N LEU A 41 -2.788 10.482 -2.745 1.00 0.00 N ATOM 574 CA LEU A 41 -2.100 9.424 -3.475 1.00 0.00 C ATOM 575 C LEU A 41 -3.077 8.334 -3.904 1.00 0.00 C ATOM 576 O LEU A 41 -4.151 8.185 -3.322 1.00 0.00 O ATOM 577 CB LEU A 41 -0.990 8.820 -2.613 1.00 0.00 C ATOM 578 CG LEU A 41 -1.407 8.341 -1.222 1.00 0.00 C ATOM 579 CD1 LEU A 41 -0.405 7.332 -0.682 1.00 0.00 C ATOM 580 CD2 LEU A 41 -1.543 9.521 -0.270 1.00 0.00 C ATOM 0 H LEU A 41 -3.064 10.229 -1.796 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.658 9.863 -4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.557 7.977 -3.151 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.201 9.563 -2.498 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.377 7.851 -1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.718 7.002 0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.357 6.473 -1.352 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.579 7.796 -0.616 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -1.840 9.161 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.587 10.039 -0.194 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.299 10.209 -0.649 1.00 0.00 H new ATOM 592 N SER A 42 -2.695 7.572 -4.924 1.00 0.00 N ATOM 593 CA SER A 42 -3.538 6.496 -5.431 1.00 0.00 C ATOM 594 C SER A 42 -2.715 5.238 -5.692 1.00 0.00 C ATOM 595 O SER A 42 -1.672 5.289 -6.343 1.00 0.00 O ATOM 596 CB SER A 42 -4.242 6.934 -6.717 1.00 0.00 C ATOM 597 OG SER A 42 -5.384 7.722 -6.430 1.00 0.00 O ATOM 0 H SER A 42 -1.808 7.680 -5.415 1.00 0.00 H new ATOM 0 HA SER A 42 -4.288 6.268 -4.674 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.550 7.503 -7.338 1.00 0.00 H new ATOM 0 HB3 SER A 42 -4.537 6.056 -7.291 1.00 0.00 H new ATOM 0 HG SER A 42 -5.815 7.991 -7.268 1.00 0.00 H new ATOM 603 N TRP A 43 -3.193 4.109 -5.180 1.00 0.00 N ATOM 604 CA TRP A 43 -2.502 2.837 -5.357 1.00 0.00 C ATOM 605 C TRP A 43 -2.740 2.278 -6.755 1.00 0.00 C ATOM 606 O TRP A 43 -3.816 2.450 -7.326 1.00 0.00 O ATOM 607 CB TRP A 43 -2.969 1.829 -4.305 1.00 0.00 C ATOM 608 CG TRP A 43 -2.765 2.302 -2.897 1.00 0.00 C ATOM 609 CD1 TRP A 43 -3.587 3.123 -2.181 1.00 0.00 C ATOM 610 CD2 TRP A 43 -1.666 1.982 -2.037 1.00 0.00 C ATOM 611 NE1 TRP A 43 -3.066 3.334 -0.927 1.00 0.00 N ATOM 612 CE2 TRP A 43 -1.888 2.644 -0.814 1.00 0.00 C ATOM 613 CE3 TRP A 43 -0.517 1.200 -2.181 1.00 0.00 C ATOM 614 CZ2 TRP A 43 -1.003 2.547 0.256 1.00 0.00 C ATOM 615 CZ3 TRP A 43 0.361 1.105 -1.118 1.00 0.00 C ATOM 616 CH2 TRP A 43 0.114 1.775 0.088 1.00 0.00 C ATOM 0 H TRP A 43 -4.056 4.049 -4.639 1.00 0.00 H new ATOM 0 HA TRP A 43 -1.433 3.012 -5.233 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -4.027 1.617 -4.460 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -2.432 0.891 -4.447 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -4.512 3.545 -2.546 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -3.488 3.911 -0.199 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -0.319 0.679 -3.106 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -1.191 3.063 1.186 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 1.253 0.504 -1.218 1.00 0.00 H new ATOM 0 HH2 TRP A 43 0.819 1.680 0.901 1.00 0.00 H new ATOM 627 N GLN A 44 -1.729 1.610 -7.301 1.00 0.00 N ATOM 628 CA GLN A 44 -1.829 1.027 -8.633 1.00 0.00 C ATOM 629 C GLN A 44 -1.143 -0.334 -8.685 1.00 0.00 C ATOM 630 O GLN A 44 0.038 -0.458 -8.360 1.00 0.00 O ATOM 631 CB GLN A 44 -1.209 1.964 -9.671 1.00 0.00 C ATOM 632 CG GLN A 44 -1.912 3.308 -9.774 1.00 0.00 C ATOM 633 CD GLN A 44 -1.358 4.172 -10.890 1.00 0.00 C ATOM 634 OE1 GLN A 44 -0.153 4.183 -11.143 1.00 0.00 O ATOM 635 NE2 GLN A 44 -2.238 4.902 -11.565 1.00 0.00 N ATOM 0 H GLN A 44 -0.831 1.459 -6.841 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.886 0.890 -8.863 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.162 2.130 -9.419 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.229 1.477 -10.646 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.977 3.145 -9.940 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.815 3.838 -8.827 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.228 4.862 -11.321 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -1.924 5.503 -12.327 1.00 0.00 H new ATOM 644 N LEU A 45 -1.891 -1.353 -9.096 1.00 0.00 N ATOM 645 CA LEU A 45 -1.355 -2.706 -9.190 1.00 0.00 C ATOM 646 C LEU A 45 -1.180 -3.122 -10.647 1.00 0.00 C ATOM 647 O LEU A 45 -2.159 -3.349 -11.360 1.00 0.00 O ATOM 648 CB LEU A 45 -2.278 -3.693 -8.473 1.00 0.00 C ATOM 649 CG LEU A 45 -1.836 -5.156 -8.486 1.00 0.00 C ATOM 650 CD1 LEU A 45 -0.546 -5.332 -7.699 1.00 0.00 C ATOM 651 CD2 LEU A 45 -2.932 -6.050 -7.923 1.00 0.00 C ATOM 0 H LEU A 45 -2.870 -1.267 -9.369 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.377 -2.717 -8.708 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.381 -3.375 -7.436 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.267 -3.629 -8.926 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.650 -5.449 -9.519 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -0.247 -6.380 -7.720 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.239 -4.722 -8.146 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.704 -5.020 -6.667 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -2.600 -7.088 -7.940 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.150 -5.756 -6.896 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -3.832 -5.947 -8.529 1.00 0.00 H new ATOM 663 N ASP A 46 0.070 -3.223 -11.083 1.00 0.00 N ATOM 664 CA ASP A 46 0.373 -3.616 -12.454 1.00 0.00 C ATOM 665 C ASP A 46 0.011 -2.502 -13.431 1.00 0.00 C ATOM 666 O ASP A 46 -0.678 -2.732 -14.423 1.00 0.00 O ATOM 667 CB ASP A 46 -0.380 -4.896 -12.819 1.00 0.00 C ATOM 668 CG ASP A 46 0.258 -5.633 -13.980 1.00 0.00 C ATOM 669 OD1 ASP A 46 1.314 -6.268 -13.771 1.00 0.00 O ATOM 670 OD2 ASP A 46 -0.297 -5.575 -15.096 1.00 0.00 O ATOM 0 H ASP A 46 0.891 -3.038 -10.506 1.00 0.00 H new ATOM 0 HA ASP A 46 1.445 -3.802 -12.524 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -0.415 -5.554 -11.950 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.411 -4.648 -13.073 1.00 0.00 H new ATOM 675 N GLY A 47 0.481 -1.292 -13.141 1.00 0.00 N ATOM 676 CA GLY A 47 0.195 -0.159 -14.003 1.00 0.00 C ATOM 677 C GLY A 47 -1.287 0.149 -14.083 1.00 0.00 C ATOM 678 O GLY A 47 -1.717 0.960 -14.903 1.00 0.00 O ATOM 0 H GLY A 47 1.054 -1.076 -12.325 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.726 0.718 -13.633 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.575 -0.363 -15.004 1.00 0.00 H new ATOM 682 N LYS A 48 -2.072 -0.502 -13.231 1.00 0.00 N ATOM 683 CA LYS A 48 -3.515 -0.295 -13.209 1.00 0.00 C ATOM 684 C LYS A 48 -3.983 0.117 -11.817 1.00 0.00 C ATOM 685 O LYS A 48 -3.350 -0.190 -10.806 1.00 0.00 O ATOM 686 CB LYS A 48 -4.241 -1.569 -13.647 1.00 0.00 C ATOM 687 CG LYS A 48 -4.194 -1.810 -15.146 1.00 0.00 C ATOM 688 CD LYS A 48 -4.782 -0.641 -15.917 1.00 0.00 C ATOM 689 CE LYS A 48 -5.092 -1.022 -17.357 1.00 0.00 C ATOM 690 NZ LYS A 48 -5.051 0.157 -18.264 1.00 0.00 N ATOM 0 H LYS A 48 -1.733 -1.178 -12.546 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.753 0.508 -13.906 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -3.798 -2.424 -13.136 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.282 -1.512 -13.329 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.162 -1.970 -15.458 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.744 -2.720 -15.387 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.693 -0.301 -15.425 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.082 0.194 -15.903 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.374 -1.767 -17.698 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.078 -1.484 -17.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.268 -0.145 -19.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.754 0.858 -17.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.103 0.583 -18.237 1.00 0.00 H new ATOM 704 N PRO A 49 -5.120 0.827 -11.760 1.00 0.00 N ATOM 705 CA PRO A 49 -5.699 1.294 -10.497 1.00 0.00 C ATOM 706 C PRO A 49 -6.257 0.150 -9.657 1.00 0.00 C ATOM 707 O PRO A 49 -7.143 -0.583 -10.098 1.00 0.00 O ATOM 708 CB PRO A 49 -6.827 2.226 -10.947 1.00 0.00 C ATOM 709 CG PRO A 49 -7.197 1.743 -12.306 1.00 0.00 C ATOM 710 CD PRO A 49 -5.927 1.229 -12.924 1.00 0.00 C ATOM 0 HA PRO A 49 -4.956 1.777 -9.862 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.676 2.178 -10.265 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.496 3.264 -10.972 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.949 0.956 -12.249 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.623 2.549 -12.904 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.116 0.388 -13.591 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.427 1.998 -13.513 1.00 0.00 H new ATOM 718 N VAL A 50 -5.734 0.002 -8.444 1.00 0.00 N ATOM 719 CA VAL A 50 -6.181 -1.052 -7.542 1.00 0.00 C ATOM 720 C VAL A 50 -7.313 -0.564 -6.645 1.00 0.00 C ATOM 721 O VAL A 50 -7.092 0.214 -5.717 1.00 0.00 O ATOM 722 CB VAL A 50 -5.026 -1.564 -6.660 1.00 0.00 C ATOM 723 CG1 VAL A 50 -4.485 -0.443 -5.786 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.486 -2.739 -5.811 1.00 0.00 C ATOM 0 H VAL A 50 -5.000 0.599 -8.063 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.542 -1.870 -8.165 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.220 -1.907 -7.309 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.670 -0.823 -5.170 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.116 0.365 -6.418 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.281 -0.067 -5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.658 -3.088 -5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.309 -2.424 -5.169 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.821 -3.548 -6.460 1.00 0.00 H new ATOM 734 N ARG A 51 -8.526 -1.028 -6.927 1.00 0.00 N ATOM 735 CA ARG A 51 -9.694 -0.638 -6.146 1.00 0.00 C ATOM 736 C ARG A 51 -9.865 -1.547 -4.932 1.00 0.00 C ATOM 737 O ARG A 51 -9.476 -2.715 -4.942 1.00 0.00 O ATOM 738 CB ARG A 51 -10.953 -0.685 -7.013 1.00 0.00 C ATOM 739 CG ARG A 51 -10.932 0.298 -8.172 1.00 0.00 C ATOM 740 CD ARG A 51 -10.210 -0.279 -9.379 1.00 0.00 C ATOM 741 NE ARG A 51 -10.836 -1.510 -9.855 1.00 0.00 N ATOM 742 CZ ARG A 51 -10.274 -2.326 -10.739 1.00 0.00 C ATOM 743 NH1 ARG A 51 -9.080 -2.045 -11.241 1.00 0.00 N ATOM 744 NH2 ARG A 51 -10.907 -3.428 -11.123 1.00 0.00 N ATOM 0 H ARG A 51 -8.726 -1.674 -7.690 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.541 0.383 -5.795 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -11.076 -1.694 -7.406 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.822 -0.478 -6.388 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -11.954 0.558 -8.448 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -10.441 1.220 -7.860 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -10.202 0.457 -10.183 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.171 -0.478 -9.118 1.00 0.00 H new ATOM 0 HE ARG A 51 -11.755 -1.756 -9.488 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.590 -1.200 -10.948 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.651 -2.674 -11.920 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -11.826 -3.648 -10.739 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -10.474 -4.054 -11.802 1.00 0.00 H new ATOM 758 N PRO A 52 -10.460 -1.000 -3.862 1.00 0.00 N ATOM 759 CA PRO A 52 -10.696 -1.745 -2.621 1.00 0.00 C ATOM 760 C PRO A 52 -11.761 -2.823 -2.786 1.00 0.00 C ATOM 761 O PRO A 52 -12.777 -2.610 -3.449 1.00 0.00 O ATOM 762 CB PRO A 52 -11.173 -0.666 -1.646 1.00 0.00 C ATOM 763 CG PRO A 52 -11.756 0.397 -2.512 1.00 0.00 C ATOM 764 CD PRO A 52 -10.949 0.386 -3.781 1.00 0.00 C ATOM 0 HA PRO A 52 -9.804 -2.276 -2.288 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.914 -1.061 -0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.348 -0.280 -1.048 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -12.808 0.200 -2.717 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -11.703 1.370 -2.024 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.557 0.649 -4.646 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.127 1.101 -3.741 1.00 0.00 H new ATOM 772 N ASP A 53 -11.524 -3.980 -2.178 1.00 0.00 N ATOM 773 CA ASP A 53 -12.465 -5.092 -2.256 1.00 0.00 C ATOM 774 C ASP A 53 -12.600 -5.784 -0.903 1.00 0.00 C ATOM 775 O ASP A 53 -11.827 -5.525 0.019 1.00 0.00 O ATOM 776 CB ASP A 53 -12.012 -6.098 -3.315 1.00 0.00 C ATOM 777 CG ASP A 53 -13.162 -6.924 -3.858 1.00 0.00 C ATOM 778 OD1 ASP A 53 -13.799 -6.482 -4.836 1.00 0.00 O ATOM 779 OD2 ASP A 53 -13.424 -8.012 -3.303 1.00 0.00 O ATOM 0 H ASP A 53 -10.688 -4.173 -1.626 1.00 0.00 H new ATOM 0 HA ASP A 53 -13.439 -4.693 -2.539 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -11.532 -5.566 -4.136 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -11.263 -6.762 -2.884 1.00 0.00 H new ATOM 784 N SER A 54 -13.589 -6.666 -0.793 1.00 0.00 N ATOM 785 CA SER A 54 -13.829 -7.393 0.449 1.00 0.00 C ATOM 786 C SER A 54 -12.513 -7.827 1.088 1.00 0.00 C ATOM 787 O SER A 54 -12.435 -8.029 2.299 1.00 0.00 O ATOM 788 CB SER A 54 -14.709 -8.617 0.186 1.00 0.00 C ATOM 789 OG SER A 54 -14.345 -9.256 -1.026 1.00 0.00 O ATOM 0 H SER A 54 -14.236 -6.894 -1.548 1.00 0.00 H new ATOM 0 HA SER A 54 -14.344 -6.724 1.139 1.00 0.00 H new ATOM 0 HB2 SER A 54 -14.616 -9.320 1.014 1.00 0.00 H new ATOM 0 HB3 SER A 54 -15.755 -8.314 0.141 1.00 0.00 H new ATOM 0 HG SER A 54 -14.921 -10.036 -1.170 1.00 0.00 H new ATOM 795 N ALA A 55 -11.480 -7.968 0.263 1.00 0.00 N ATOM 796 CA ALA A 55 -10.167 -8.376 0.746 1.00 0.00 C ATOM 797 C ALA A 55 -9.224 -7.181 0.847 1.00 0.00 C ATOM 798 O ALA A 55 -8.599 -6.956 1.884 1.00 0.00 O ATOM 799 CB ALA A 55 -9.576 -9.441 -0.165 1.00 0.00 C ATOM 0 H ALA A 55 -11.528 -7.806 -0.743 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.289 -8.796 1.745 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.595 -9.736 0.208 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -10.234 -10.310 -0.183 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.475 -9.041 -1.174 1.00 0.00 H new ATOM 805 N HIS A 56 -9.125 -6.418 -0.237 1.00 0.00 N ATOM 806 CA HIS A 56 -8.258 -5.246 -0.270 1.00 0.00 C ATOM 807 C HIS A 56 -8.923 -4.058 0.419 1.00 0.00 C ATOM 808 O HIS A 56 -9.877 -3.480 -0.101 1.00 0.00 O ATOM 809 CB HIS A 56 -7.909 -4.883 -1.714 1.00 0.00 C ATOM 810 CG HIS A 56 -7.233 -5.990 -2.463 1.00 0.00 C ATOM 811 ND1 HIS A 56 -7.899 -7.108 -2.917 1.00 0.00 N ATOM 812 CD2 HIS A 56 -5.942 -6.145 -2.837 1.00 0.00 C ATOM 813 CE1 HIS A 56 -7.047 -7.905 -3.537 1.00 0.00 C ATOM 814 NE2 HIS A 56 -5.852 -7.343 -3.504 1.00 0.00 N ATOM 0 H HIS A 56 -9.634 -6.590 -1.104 1.00 0.00 H new ATOM 0 HA HIS A 56 -7.341 -5.489 0.267 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -8.822 -4.604 -2.240 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -7.260 -4.007 -1.713 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -5.133 -5.455 -2.647 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.287 -8.854 -3.993 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -5.001 -7.735 -3.908 1.00 0.00 H new ATOM 822 N LYS A 57 -8.413 -3.699 1.592 1.00 0.00 N ATOM 823 CA LYS A 57 -8.957 -2.580 2.353 1.00 0.00 C ATOM 824 C LYS A 57 -7.947 -1.440 2.440 1.00 0.00 C ATOM 825 O LYS A 57 -6.821 -1.629 2.900 1.00 0.00 O ATOM 826 CB LYS A 57 -9.349 -3.036 3.760 1.00 0.00 C ATOM 827 CG LYS A 57 -10.064 -1.968 4.569 1.00 0.00 C ATOM 828 CD LYS A 57 -10.540 -2.506 5.908 1.00 0.00 C ATOM 829 CE LYS A 57 -9.461 -2.382 6.973 1.00 0.00 C ATOM 830 NZ LYS A 57 -8.393 -3.406 6.802 1.00 0.00 N ATOM 0 H LYS A 57 -7.623 -4.167 2.037 1.00 0.00 H new ATOM 0 HA LYS A 57 -9.845 -2.218 1.835 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.992 -3.913 3.683 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -8.452 -3.346 4.296 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -9.393 -1.125 4.733 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.917 -1.592 4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -11.430 -1.962 6.225 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.828 -3.552 5.800 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -9.020 -1.386 6.929 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -9.911 -2.488 7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.000 -3.657 7.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.794 -4.255 6.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.637 -3.022 6.199 1.00 0.00 H new ATOM 844 N MET A 58 -8.358 -0.257 1.997 1.00 0.00 N ATOM 845 CA MET A 58 -7.490 0.914 2.028 1.00 0.00 C ATOM 846 C MET A 58 -7.791 1.783 3.245 1.00 0.00 C ATOM 847 O MET A 58 -8.931 2.199 3.457 1.00 0.00 O ATOM 848 CB MET A 58 -7.658 1.735 0.747 1.00 0.00 C ATOM 849 CG MET A 58 -6.747 1.288 -0.385 1.00 0.00 C ATOM 850 SD MET A 58 -7.457 1.602 -2.012 1.00 0.00 S ATOM 851 CE MET A 58 -7.373 -0.033 -2.739 1.00 0.00 C ATOM 0 H MET A 58 -9.287 -0.084 1.612 1.00 0.00 H new ATOM 0 HA MET A 58 -6.459 0.568 2.097 1.00 0.00 H new ATOM 0 HB2 MET A 58 -8.694 1.669 0.416 1.00 0.00 H new ATOM 0 HB3 MET A 58 -7.461 2.784 0.969 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.792 1.806 -0.304 1.00 0.00 H new ATOM 0 HG3 MET A 58 -6.542 0.223 -0.282 1.00 0.00 H new ATOM 0 HE1 MET A 58 -8.019 -0.075 -3.616 1.00 0.00 H new ATOM 0 HE2 MET A 58 -6.346 -0.248 -3.034 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.703 -0.773 -2.010 1.00 0.00 H new ATOM 861 N LEU A 59 -6.763 2.052 4.043 1.00 0.00 N ATOM 862 CA LEU A 59 -6.918 2.871 5.240 1.00 0.00 C ATOM 863 C LEU A 59 -6.375 4.278 5.011 1.00 0.00 C ATOM 864 O LEU A 59 -5.379 4.464 4.312 1.00 0.00 O ATOM 865 CB LEU A 59 -6.200 2.221 6.423 1.00 0.00 C ATOM 866 CG LEU A 59 -6.848 0.957 6.990 1.00 0.00 C ATOM 867 CD1 LEU A 59 -6.536 -0.244 6.111 1.00 0.00 C ATOM 868 CD2 LEU A 59 -6.381 0.712 8.417 1.00 0.00 C ATOM 0 H LEU A 59 -5.814 1.715 3.883 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.982 2.944 5.465 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.183 1.977 6.115 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.123 2.956 7.224 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.928 1.101 7.002 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -7.005 -1.134 6.531 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -6.922 -0.070 5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.457 -0.391 6.065 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.852 -0.191 8.804 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.298 0.590 8.430 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.658 1.562 9.041 1.00 0.00 H new ATOM 880 N VAL A 60 -7.034 5.266 5.608 1.00 0.00 N ATOM 881 CA VAL A 60 -6.615 6.656 5.472 1.00 0.00 C ATOM 882 C VAL A 60 -6.623 7.366 6.821 1.00 0.00 C ATOM 883 O VAL A 60 -7.683 7.690 7.357 1.00 0.00 O ATOM 884 CB VAL A 60 -7.525 7.423 4.495 1.00 0.00 C ATOM 885 CG1 VAL A 60 -7.003 8.835 4.275 1.00 0.00 C ATOM 886 CG2 VAL A 60 -7.638 6.676 3.174 1.00 0.00 C ATOM 0 H VAL A 60 -7.860 5.130 6.190 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.599 6.644 5.077 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.521 7.494 4.933 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.659 9.362 3.582 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.979 9.366 5.226 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.997 8.790 3.859 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.285 7.232 2.496 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.648 6.572 2.729 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.062 5.687 3.350 1.00 0.00 H new ATOM 896 N ARG A 61 -5.434 7.606 7.364 1.00 0.00 N ATOM 897 CA ARG A 61 -5.304 8.278 8.652 1.00 0.00 C ATOM 898 C ARG A 61 -5.406 9.792 8.488 1.00 0.00 C ATOM 899 O ARG A 61 -4.950 10.349 7.490 1.00 0.00 O ATOM 900 CB ARG A 61 -3.971 7.914 9.308 1.00 0.00 C ATOM 901 CG ARG A 61 -3.996 6.581 10.038 1.00 0.00 C ATOM 902 CD ARG A 61 -3.720 5.423 9.092 1.00 0.00 C ATOM 903 NE ARG A 61 -3.988 4.130 9.717 1.00 0.00 N ATOM 904 CZ ARG A 61 -3.163 3.544 10.577 1.00 0.00 C ATOM 905 NH1 ARG A 61 -2.023 4.132 10.913 1.00 0.00 N ATOM 906 NH2 ARG A 61 -3.477 2.367 11.103 1.00 0.00 N ATOM 0 H ARG A 61 -4.547 7.345 6.933 1.00 0.00 H new ATOM 0 HA ARG A 61 -6.120 7.944 9.293 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.195 7.885 8.543 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.696 8.699 10.012 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -3.252 6.587 10.834 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.968 6.442 10.511 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.337 5.529 8.200 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.680 5.460 8.767 1.00 0.00 H new ATOM 0 HE ARG A 61 -4.857 3.651 9.480 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -1.778 5.037 10.511 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -1.391 3.680 11.574 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -4.353 1.911 10.847 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -2.842 1.918 11.763 1.00 0.00 H new ATOM 920 N GLU A 62 -6.008 10.449 9.474 1.00 0.00 N ATOM 921 CA GLU A 62 -6.170 11.898 9.437 1.00 0.00 C ATOM 922 C GLU A 62 -4.841 12.587 9.146 1.00 0.00 C ATOM 923 O GLU A 62 -4.746 13.422 8.247 1.00 0.00 O ATOM 924 CB GLU A 62 -6.739 12.403 10.765 1.00 0.00 C ATOM 925 CG GLU A 62 -7.382 13.777 10.669 1.00 0.00 C ATOM 926 CD GLU A 62 -8.503 13.825 9.649 1.00 0.00 C ATOM 927 OE1 GLU A 62 -8.213 14.069 8.459 1.00 0.00 O ATOM 928 OE2 GLU A 62 -9.671 13.620 10.041 1.00 0.00 O ATOM 0 H GLU A 62 -6.391 10.002 10.307 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.867 12.140 8.635 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.479 11.690 11.128 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.939 12.437 11.504 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.772 14.061 11.646 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.622 14.512 10.404 1.00 0.00 H new ATOM 935 N ASN A 63 -3.815 12.232 9.913 1.00 0.00 N ATOM 936 CA ASN A 63 -2.491 12.817 9.739 1.00 0.00 C ATOM 937 C ASN A 63 -2.097 12.841 8.265 1.00 0.00 C ATOM 938 O ASN A 63 -1.677 13.872 7.740 1.00 0.00 O ATOM 939 CB ASN A 63 -1.453 12.031 10.543 1.00 0.00 C ATOM 940 CG ASN A 63 -1.704 10.536 10.505 1.00 0.00 C ATOM 941 OD1 ASN A 63 -1.493 9.886 9.481 1.00 0.00 O ATOM 942 ND2 ASN A 63 -2.157 9.984 11.624 1.00 0.00 N ATOM 0 H ASN A 63 -3.876 11.542 10.661 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.523 13.843 10.106 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -0.458 12.240 10.149 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.464 12.372 11.578 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -2.345 8.982 11.659 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -2.317 10.562 12.449 1.00 0.00 H new ATOM 949 N GLY A 64 -2.237 11.697 7.602 1.00 0.00 N ATOM 950 CA GLY A 64 -1.892 11.608 6.195 1.00 0.00 C ATOM 951 C GLY A 64 -1.310 10.258 5.825 1.00 0.00 C ATOM 952 O GLY A 64 -1.251 9.901 4.648 1.00 0.00 O ATOM 0 H GLY A 64 -2.583 10.830 8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.782 11.794 5.593 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.173 12.390 5.950 1.00 0.00 H new ATOM 956 N VAL A 65 -0.876 9.507 6.831 1.00 0.00 N ATOM 957 CA VAL A 65 -0.294 8.189 6.606 1.00 0.00 C ATOM 958 C VAL A 65 -1.320 7.230 6.013 1.00 0.00 C ATOM 959 O VAL A 65 -2.440 7.115 6.511 1.00 0.00 O ATOM 960 CB VAL A 65 0.258 7.588 7.912 1.00 0.00 C ATOM 961 CG1 VAL A 65 0.706 6.151 7.692 1.00 0.00 C ATOM 962 CG2 VAL A 65 1.403 8.436 8.446 1.00 0.00 C ATOM 0 H VAL A 65 -0.916 9.788 7.811 1.00 0.00 H new ATOM 0 HA VAL A 65 0.526 8.322 5.901 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.539 7.585 8.655 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.093 5.743 8.626 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.142 5.553 7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.488 6.126 6.933 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.781 7.997 9.369 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.204 8.473 7.707 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.046 9.446 8.645 1.00 0.00 H new ATOM 972 N HIS A 66 -0.930 6.541 4.944 1.00 0.00 N ATOM 973 CA HIS A 66 -1.816 5.590 4.282 1.00 0.00 C ATOM 974 C HIS A 66 -1.288 4.166 4.426 1.00 0.00 C ATOM 975 O HIS A 66 -0.080 3.947 4.515 1.00 0.00 O ATOM 976 CB HIS A 66 -1.965 5.945 2.803 1.00 0.00 C ATOM 977 CG HIS A 66 -2.870 7.113 2.555 1.00 0.00 C ATOM 978 ND1 HIS A 66 -3.488 7.343 1.344 1.00 0.00 N ATOM 979 CD2 HIS A 66 -3.261 8.119 3.372 1.00 0.00 C ATOM 980 CE1 HIS A 66 -4.218 8.440 1.426 1.00 0.00 C ATOM 981 NE2 HIS A 66 -4.098 8.930 2.647 1.00 0.00 N ATOM 0 H HIS A 66 -0.007 6.624 4.518 1.00 0.00 H new ATOM 0 HA HIS A 66 -2.793 5.646 4.761 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -0.981 6.165 2.390 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -2.350 5.078 2.267 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -3.396 6.757 0.514 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -2.969 8.258 4.402 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -4.812 8.865 0.630 1.00 0.00 H new ATOM 989 N SER A 67 -2.202 3.201 4.447 1.00 0.00 N ATOM 990 CA SER A 67 -1.829 1.798 4.584 1.00 0.00 C ATOM 991 C SER A 67 -2.769 0.904 3.781 1.00 0.00 C ATOM 992 O SER A 67 -3.972 1.159 3.705 1.00 0.00 O ATOM 993 CB SER A 67 -1.848 1.385 6.057 1.00 0.00 C ATOM 994 OG SER A 67 -0.959 2.180 6.822 1.00 0.00 O ATOM 0 H SER A 67 -3.206 3.365 4.371 1.00 0.00 H new ATOM 0 HA SER A 67 -0.819 1.677 4.193 1.00 0.00 H new ATOM 0 HB2 SER A 67 -2.859 1.482 6.452 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.570 0.335 6.147 1.00 0.00 H new ATOM 0 HG SER A 67 -0.991 1.897 7.760 1.00 0.00 H new ATOM 1000 N LEU A 68 -2.213 -0.144 3.184 1.00 0.00 N ATOM 1001 CA LEU A 68 -3.001 -1.077 2.386 1.00 0.00 C ATOM 1002 C LEU A 68 -2.979 -2.472 3.000 1.00 0.00 C ATOM 1003 O LEU A 68 -1.952 -3.152 2.984 1.00 0.00 O ATOM 1004 CB LEU A 68 -2.467 -1.130 0.953 1.00 0.00 C ATOM 1005 CG LEU A 68 -3.086 -2.193 0.045 1.00 0.00 C ATOM 1006 CD1 LEU A 68 -4.447 -1.737 -0.459 1.00 0.00 C ATOM 1007 CD2 LEU A 68 -2.160 -2.503 -1.122 1.00 0.00 C ATOM 0 H LEU A 68 -1.220 -0.369 3.237 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.032 -0.723 2.371 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.621 -0.154 0.493 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.391 -1.298 0.994 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.223 -3.105 0.626 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.873 -2.506 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.110 -1.566 0.389 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.334 -0.812 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.617 -3.262 -1.757 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.991 -1.596 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.208 -2.873 -0.742 1.00 0.00 H new ATOM 1019 N ILE A 69 -4.118 -2.894 3.539 1.00 0.00 N ATOM 1020 CA ILE A 69 -4.230 -4.210 4.156 1.00 0.00 C ATOM 1021 C ILE A 69 -5.007 -5.171 3.263 1.00 0.00 C ATOM 1022 O ILE A 69 -6.140 -4.891 2.870 1.00 0.00 O ATOM 1023 CB ILE A 69 -4.921 -4.131 5.530 1.00 0.00 C ATOM 1024 CG1 ILE A 69 -4.104 -3.261 6.487 1.00 0.00 C ATOM 1025 CG2 ILE A 69 -5.115 -5.525 6.107 1.00 0.00 C ATOM 1026 CD1 ILE A 69 -4.807 -2.978 7.797 1.00 0.00 C ATOM 0 H ILE A 69 -4.976 -2.344 3.561 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.215 -4.583 4.290 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.902 -3.673 5.401 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.154 -3.755 6.693 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.872 -2.315 5.997 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.605 -5.452 7.078 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.735 -6.115 5.432 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.145 -6.008 6.225 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.169 -2.356 8.425 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.744 -2.456 7.602 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.015 -3.918 8.309 1.00 0.00 H new ATOM 1038 N ILE A 70 -4.391 -6.305 2.947 1.00 0.00 N ATOM 1039 CA ILE A 70 -5.026 -7.309 2.103 1.00 0.00 C ATOM 1040 C ILE A 70 -5.236 -8.614 2.864 1.00 0.00 C ATOM 1041 O ILE A 70 -4.294 -9.177 3.420 1.00 0.00 O ATOM 1042 CB ILE A 70 -4.191 -7.593 0.840 1.00 0.00 C ATOM 1043 CG1 ILE A 70 -3.780 -6.281 0.169 1.00 0.00 C ATOM 1044 CG2 ILE A 70 -4.975 -8.467 -0.127 1.00 0.00 C ATOM 1045 CD1 ILE A 70 -2.597 -6.424 -0.763 1.00 0.00 C ATOM 0 H ILE A 70 -3.453 -6.551 3.263 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.994 -6.905 1.806 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.287 -8.128 1.131 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -4.628 -5.887 -0.391 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.539 -5.548 0.939 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.372 -8.659 -1.015 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.222 -9.413 0.356 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.894 -7.956 -0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.361 -5.455 -1.203 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.735 -6.788 -0.204 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.841 -7.132 -1.555 1.00 0.00 H new ATOM 1057 N GLU A 71 -6.478 -9.089 2.882 1.00 0.00 N ATOM 1058 CA GLU A 71 -6.811 -10.329 3.574 1.00 0.00 C ATOM 1059 C GLU A 71 -8.208 -10.808 3.190 1.00 0.00 C ATOM 1060 O GLU A 71 -9.197 -10.086 3.322 1.00 0.00 O ATOM 1061 CB GLU A 71 -6.725 -10.132 5.089 1.00 0.00 C ATOM 1062 CG GLU A 71 -6.452 -11.416 5.855 1.00 0.00 C ATOM 1063 CD GLU A 71 -7.577 -12.425 5.721 1.00 0.00 C ATOM 1064 OE1 GLU A 71 -8.754 -12.018 5.817 1.00 0.00 O ATOM 1065 OE2 GLU A 71 -7.279 -13.621 5.521 1.00 0.00 O ATOM 0 H GLU A 71 -7.269 -8.634 2.426 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.090 -11.089 3.272 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.936 -9.413 5.309 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.660 -9.699 5.444 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.525 -11.861 5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.303 -11.181 6.909 1.00 0.00 H new ATOM 1072 N PRO A 72 -8.293 -12.054 2.703 1.00 0.00 N ATOM 1073 CA PRO A 72 -7.122 -12.922 2.541 1.00 0.00 C ATOM 1074 C PRO A 72 -6.197 -12.445 1.427 1.00 0.00 C ATOM 1075 O PRO A 72 -6.408 -11.382 0.844 1.00 0.00 O ATOM 1076 CB PRO A 72 -7.734 -14.279 2.183 1.00 0.00 C ATOM 1077 CG PRO A 72 -9.052 -13.951 1.571 1.00 0.00 C ATOM 1078 CD PRO A 72 -9.538 -12.713 2.273 1.00 0.00 C ATOM 0 HA PRO A 72 -6.502 -12.941 3.437 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -7.100 -14.828 1.487 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.853 -14.905 3.067 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.952 -13.778 0.499 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -9.756 -14.773 1.697 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -10.121 -12.076 1.607 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -10.177 -12.957 3.121 1.00 0.00 H new ATOM 1086 N VAL A 73 -5.170 -13.238 1.136 1.00 0.00 N ATOM 1087 CA VAL A 73 -4.213 -12.897 0.091 1.00 0.00 C ATOM 1088 C VAL A 73 -4.134 -13.997 -0.962 1.00 0.00 C ATOM 1089 O VAL A 73 -4.144 -15.185 -0.638 1.00 0.00 O ATOM 1090 CB VAL A 73 -2.807 -12.658 0.673 1.00 0.00 C ATOM 1091 CG1 VAL A 73 -1.766 -12.642 -0.435 1.00 0.00 C ATOM 1092 CG2 VAL A 73 -2.774 -11.360 1.466 1.00 0.00 C ATOM 0 H VAL A 73 -4.980 -14.121 1.610 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.567 -11.977 -0.374 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.568 -13.478 1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.779 -12.472 -0.005 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.775 -13.599 -0.956 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.997 -11.843 -1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -1.774 -11.206 1.870 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -3.033 -10.527 0.812 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.492 -11.415 2.285 1.00 0.00 H new ATOM 1102 N THR A 74 -4.056 -13.594 -2.226 1.00 0.00 N ATOM 1103 CA THR A 74 -3.976 -14.545 -3.328 1.00 0.00 C ATOM 1104 C THR A 74 -2.666 -14.391 -4.093 1.00 0.00 C ATOM 1105 O THR A 74 -1.866 -13.502 -3.801 1.00 0.00 O ATOM 1106 CB THR A 74 -5.152 -14.370 -4.307 1.00 0.00 C ATOM 1107 OG1 THR A 74 -5.095 -13.076 -4.916 1.00 0.00 O ATOM 1108 CG2 THR A 74 -6.483 -14.541 -3.589 1.00 0.00 C ATOM 0 H THR A 74 -4.047 -12.615 -2.512 1.00 0.00 H new ATOM 0 HA THR A 74 -4.023 -15.542 -2.889 1.00 0.00 H new ATOM 0 HB THR A 74 -5.072 -15.136 -5.078 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.845 -12.974 -5.538 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.299 -14.413 -4.300 1.00 0.00 H new ATOM 0 HG22 THR A 74 -6.535 -15.538 -3.152 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.569 -13.794 -2.800 1.00 0.00 H new ATOM 1116 N SER A 75 -2.454 -15.261 -5.075 1.00 0.00 N ATOM 1117 CA SER A 75 -1.239 -15.223 -5.881 1.00 0.00 C ATOM 1118 C SER A 75 -1.200 -13.968 -6.747 1.00 0.00 C ATOM 1119 O SER A 75 -0.130 -13.511 -7.150 1.00 0.00 O ATOM 1120 CB SER A 75 -1.149 -16.469 -6.765 1.00 0.00 C ATOM 1121 OG SER A 75 0.139 -16.592 -7.343 1.00 0.00 O ATOM 0 H SER A 75 -3.108 -16.001 -5.332 1.00 0.00 H new ATOM 0 HA SER A 75 -0.385 -15.203 -5.204 1.00 0.00 H new ATOM 0 HB2 SER A 75 -1.371 -17.356 -6.172 1.00 0.00 H new ATOM 0 HB3 SER A 75 -1.901 -16.415 -7.552 1.00 0.00 H new ATOM 0 HG SER A 75 0.171 -17.396 -7.902 1.00 0.00 H new ATOM 1127 N ARG A 76 -2.375 -13.414 -7.028 1.00 0.00 N ATOM 1128 CA ARG A 76 -2.477 -12.212 -7.847 1.00 0.00 C ATOM 1129 C ARG A 76 -2.064 -10.976 -7.052 1.00 0.00 C ATOM 1130 O ARG A 76 -1.782 -9.924 -7.625 1.00 0.00 O ATOM 1131 CB ARG A 76 -3.906 -12.043 -8.367 1.00 0.00 C ATOM 1132 CG ARG A 76 -4.041 -10.973 -9.438 1.00 0.00 C ATOM 1133 CD ARG A 76 -3.789 -11.539 -10.826 1.00 0.00 C ATOM 1134 NE ARG A 76 -2.376 -11.481 -11.193 1.00 0.00 N ATOM 1135 CZ ARG A 76 -1.773 -10.378 -11.622 1.00 0.00 C ATOM 1136 NH1 ARG A 76 -2.456 -9.247 -11.738 1.00 0.00 N ATOM 1137 NH2 ARG A 76 -0.485 -10.404 -11.936 1.00 0.00 N ATOM 0 H ARG A 76 -3.270 -13.778 -6.701 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.800 -12.321 -8.694 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -4.252 -12.995 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -4.561 -11.794 -7.532 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.040 -10.539 -9.397 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -3.335 -10.167 -9.239 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -4.131 -12.573 -10.863 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -4.376 -10.983 -11.556 1.00 0.00 H new ATOM 0 HE ARG A 76 -1.822 -12.334 -11.116 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -3.447 -9.223 -11.497 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -1.990 -8.402 -12.068 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.044 -11.272 -11.848 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.023 -9.556 -12.265 1.00 0.00 H new ATOM 1151 N ASP A 77 -2.030 -11.113 -5.732 1.00 0.00 N ATOM 1152 CA ASP A 77 -1.651 -10.008 -4.858 1.00 0.00 C ATOM 1153 C ASP A 77 -0.200 -9.602 -5.095 1.00 0.00 C ATOM 1154 O ASP A 77 0.191 -8.469 -4.816 1.00 0.00 O ATOM 1155 CB ASP A 77 -1.852 -10.397 -3.392 1.00 0.00 C ATOM 1156 CG ASP A 77 -1.844 -9.195 -2.469 1.00 0.00 C ATOM 1157 OD1 ASP A 77 -2.617 -8.247 -2.721 1.00 0.00 O ATOM 1158 OD2 ASP A 77 -1.066 -9.203 -1.493 1.00 0.00 O ATOM 0 H ASP A 77 -2.260 -11.978 -5.243 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.291 -9.157 -5.091 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -2.799 -10.927 -3.286 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -1.065 -11.088 -3.091 1.00 0.00 H new ATOM 1163 N ALA A 78 0.594 -10.535 -5.610 1.00 0.00 N ATOM 1164 CA ALA A 78 2.001 -10.274 -5.885 1.00 0.00 C ATOM 1165 C ALA A 78 2.164 -9.351 -7.088 1.00 0.00 C ATOM 1166 O ALA A 78 1.579 -9.585 -8.145 1.00 0.00 O ATOM 1167 CB ALA A 78 2.746 -11.580 -6.116 1.00 0.00 C ATOM 0 H ALA A 78 0.286 -11.479 -5.845 1.00 0.00 H new ATOM 0 HA ALA A 78 2.428 -9.774 -5.015 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.796 -11.369 -6.320 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.668 -12.206 -5.227 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.309 -12.103 -6.967 1.00 0.00 H new ATOM 1173 N GLY A 79 2.961 -8.300 -6.920 1.00 0.00 N ATOM 1174 CA GLY A 79 3.185 -7.358 -8.000 1.00 0.00 C ATOM 1175 C GLY A 79 3.870 -6.090 -7.531 1.00 0.00 C ATOM 1176 O GLY A 79 4.252 -5.978 -6.365 1.00 0.00 O ATOM 0 H GLY A 79 3.456 -8.084 -6.054 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.793 -7.832 -8.771 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.230 -7.103 -8.459 1.00 0.00 H new ATOM 1180 N ILE A 80 4.029 -5.134 -8.440 1.00 0.00 N ATOM 1181 CA ILE A 80 4.674 -3.868 -8.112 1.00 0.00 C ATOM 1182 C ILE A 80 3.641 -2.783 -7.827 1.00 0.00 C ATOM 1183 O ILE A 80 3.092 -2.177 -8.748 1.00 0.00 O ATOM 1184 CB ILE A 80 5.598 -3.396 -9.250 1.00 0.00 C ATOM 1185 CG1 ILE A 80 6.594 -4.498 -9.618 1.00 0.00 C ATOM 1186 CG2 ILE A 80 6.331 -2.126 -8.845 1.00 0.00 C ATOM 1187 CD1 ILE A 80 7.593 -4.800 -8.524 1.00 0.00 C ATOM 0 H ILE A 80 3.720 -5.212 -9.409 1.00 0.00 H new ATOM 0 HA ILE A 80 5.272 -4.040 -7.217 1.00 0.00 H new ATOM 0 HB ILE A 80 4.988 -3.176 -10.126 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.044 -5.408 -9.858 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.132 -4.204 -10.519 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.980 -1.805 -9.660 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.606 -1.341 -8.628 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.933 -2.321 -7.957 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.267 -5.590 -8.855 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.169 -3.902 -8.299 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.064 -5.125 -7.628 1.00 0.00 H new ATOM 1199 N TYR A 81 3.383 -2.541 -6.547 1.00 0.00 N ATOM 1200 CA TYR A 81 2.416 -1.528 -6.140 1.00 0.00 C ATOM 1201 C TYR A 81 3.014 -0.129 -6.251 1.00 0.00 C ATOM 1202 O TYR A 81 3.799 0.294 -5.402 1.00 0.00 O ATOM 1203 CB TYR A 81 1.951 -1.784 -4.706 1.00 0.00 C ATOM 1204 CG TYR A 81 1.076 -3.009 -4.562 1.00 0.00 C ATOM 1205 CD1 TYR A 81 -0.305 -2.919 -4.689 1.00 0.00 C ATOM 1206 CD2 TYR A 81 1.629 -4.256 -4.299 1.00 0.00 C ATOM 1207 CE1 TYR A 81 -1.109 -4.035 -4.558 1.00 0.00 C ATOM 1208 CE2 TYR A 81 0.834 -5.377 -4.168 1.00 0.00 C ATOM 1209 CZ TYR A 81 -0.535 -5.262 -4.298 1.00 0.00 C ATOM 1210 OH TYR A 81 -1.331 -6.376 -4.167 1.00 0.00 O ATOM 0 H TYR A 81 3.830 -3.032 -5.773 1.00 0.00 H new ATOM 0 HA TYR A 81 1.558 -1.591 -6.809 1.00 0.00 H new ATOM 0 HB2 TYR A 81 2.825 -1.895 -4.064 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.402 -0.912 -4.350 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.758 -1.960 -4.894 1.00 0.00 H new ATOM 0 HD2 TYR A 81 2.700 -4.350 -4.195 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -2.181 -3.947 -4.659 1.00 0.00 H new ATOM 0 HE2 TYR A 81 1.281 -6.339 -3.965 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.955 -7.111 -4.695 1.00 0.00 H new ATOM 1220 N THR A 82 2.635 0.587 -7.305 1.00 0.00 N ATOM 1221 CA THR A 82 3.132 1.939 -7.529 1.00 0.00 C ATOM 1222 C THR A 82 2.077 2.979 -7.170 1.00 0.00 C ATOM 1223 O THR A 82 0.972 2.970 -7.714 1.00 0.00 O ATOM 1224 CB THR A 82 3.561 2.144 -8.994 1.00 0.00 C ATOM 1225 OG1 THR A 82 4.592 1.212 -9.338 1.00 0.00 O ATOM 1226 CG2 THR A 82 4.059 3.564 -9.219 1.00 0.00 C ATOM 0 H THR A 82 1.985 0.253 -8.017 1.00 0.00 H new ATOM 0 HA THR A 82 4.000 2.068 -6.882 1.00 0.00 H new ATOM 0 HB THR A 82 2.692 1.975 -9.630 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.858 1.348 -10.271 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.356 3.685 -10.261 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.262 4.270 -8.985 1.00 0.00 H new ATOM 0 HG23 THR A 82 4.916 3.756 -8.573 1.00 0.00 H new ATOM 1234 N CYS A 83 2.425 3.875 -6.253 1.00 0.00 N ATOM 1235 CA CYS A 83 1.507 4.923 -5.822 1.00 0.00 C ATOM 1236 C CYS A 83 2.042 6.302 -6.194 1.00 0.00 C ATOM 1237 O CYS A 83 3.251 6.536 -6.174 1.00 0.00 O ATOM 1238 CB CYS A 83 1.280 4.842 -4.311 1.00 0.00 C ATOM 1239 SG CYS A 83 -0.337 5.445 -3.773 1.00 0.00 S ATOM 0 H CYS A 83 3.336 3.897 -5.794 1.00 0.00 H new ATOM 0 HA CYS A 83 0.557 4.772 -6.334 1.00 0.00 H new ATOM 0 HB2 CYS A 83 1.393 3.806 -3.993 1.00 0.00 H new ATOM 0 HB3 CYS A 83 2.056 5.417 -3.807 1.00 0.00 H new ATOM 0 HG CYS A 83 -0.705 4.805 -2.703 1.00 0.00 H new ATOM 1245 N ILE A 84 1.134 7.211 -6.535 1.00 0.00 N ATOM 1246 CA ILE A 84 1.516 8.566 -6.913 1.00 0.00 C ATOM 1247 C ILE A 84 0.813 9.599 -6.039 1.00 0.00 C ATOM 1248 O ILE A 84 -0.386 9.838 -6.184 1.00 0.00 O ATOM 1249 CB ILE A 84 1.187 8.852 -8.391 1.00 0.00 C ATOM 1250 CG1 ILE A 84 1.883 7.834 -9.297 1.00 0.00 C ATOM 1251 CG2 ILE A 84 1.601 10.269 -8.760 1.00 0.00 C ATOM 1252 CD1 ILE A 84 1.076 6.575 -9.523 1.00 0.00 C ATOM 0 H ILE A 84 0.130 7.034 -6.557 1.00 0.00 H new ATOM 0 HA ILE A 84 2.594 8.643 -6.767 1.00 0.00 H new ATOM 0 HB ILE A 84 0.110 8.760 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.092 8.300 -10.260 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.844 7.566 -8.858 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.363 10.457 -9.807 1.00 0.00 H new ATOM 0 HG22 ILE A 84 1.064 10.980 -8.132 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.674 10.387 -8.605 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.631 5.899 -10.174 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.889 6.086 -8.567 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.126 6.831 -9.991 1.00 0.00 H new ATOM 1264 N ALA A 85 1.567 10.209 -5.131 1.00 0.00 N ATOM 1265 CA ALA A 85 1.018 11.220 -4.236 1.00 0.00 C ATOM 1266 C ALA A 85 1.083 12.607 -4.866 1.00 0.00 C ATOM 1267 O ALA A 85 2.161 13.185 -5.010 1.00 0.00 O ATOM 1268 CB ALA A 85 1.760 11.207 -2.907 1.00 0.00 C ATOM 0 H ALA A 85 2.560 10.021 -4.996 1.00 0.00 H new ATOM 0 HA ALA A 85 -0.030 10.980 -4.058 1.00 0.00 H new ATOM 0 HB1 ALA A 85 1.340 11.967 -2.248 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.657 10.226 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.816 11.418 -3.078 1.00 0.00 H new ATOM 1274 N THR A 86 -0.077 13.135 -5.243 1.00 0.00 N ATOM 1275 CA THR A 86 -0.151 14.453 -5.861 1.00 0.00 C ATOM 1276 C THR A 86 -0.772 15.471 -4.911 1.00 0.00 C ATOM 1277 O THR A 86 -1.946 15.370 -4.558 1.00 0.00 O ATOM 1278 CB THR A 86 -0.972 14.418 -7.164 1.00 0.00 C ATOM 1279 OG1 THR A 86 -0.814 13.148 -7.807 1.00 0.00 O ATOM 1280 CG2 THR A 86 -0.536 15.528 -8.108 1.00 0.00 C ATOM 0 H THR A 86 -0.978 12.670 -5.131 1.00 0.00 H new ATOM 0 HA THR A 86 0.872 14.751 -6.092 1.00 0.00 H new ATOM 0 HB THR A 86 -2.021 14.569 -6.911 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.201 13.240 -8.566 1.00 0.00 H new ATOM 0 HG21 THR A 86 -1.130 15.483 -9.021 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.684 16.494 -7.626 1.00 0.00 H new ATOM 0 HG23 THR A 86 0.518 15.403 -8.354 1.00 0.00 H new ATOM 1288 N ASN A 87 0.025 16.453 -4.500 1.00 0.00 N ATOM 1289 CA ASN A 87 -0.447 17.490 -3.590 1.00 0.00 C ATOM 1290 C ASN A 87 -0.374 18.865 -4.247 1.00 0.00 C ATOM 1291 O ASN A 87 0.446 19.097 -5.136 1.00 0.00 O ATOM 1292 CB ASN A 87 0.380 17.484 -2.303 1.00 0.00 C ATOM 1293 CG ASN A 87 -0.174 18.429 -1.255 1.00 0.00 C ATOM 1294 OD1 ASN A 87 -1.376 18.695 -1.216 1.00 0.00 O ATOM 1295 ND2 ASN A 87 0.701 18.942 -0.398 1.00 0.00 N ATOM 0 H ASN A 87 1.000 16.552 -4.783 1.00 0.00 H new ATOM 0 HA ASN A 87 -1.488 17.278 -3.346 1.00 0.00 H new ATOM 0 HB2 ASN A 87 0.408 16.473 -1.897 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.408 17.764 -2.534 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.386 19.584 0.329 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.688 18.694 -0.467 1.00 0.00 H new ATOM 1302 N ARG A 88 -1.237 19.774 -3.804 1.00 0.00 N ATOM 1303 CA ARG A 88 -1.271 21.125 -4.350 1.00 0.00 C ATOM 1304 C ARG A 88 0.137 21.616 -4.673 1.00 0.00 C ATOM 1305 O ARG A 88 0.350 22.313 -5.665 1.00 0.00 O ATOM 1306 CB ARG A 88 -1.941 22.080 -3.361 1.00 0.00 C ATOM 1307 CG ARG A 88 -3.391 21.732 -3.065 1.00 0.00 C ATOM 1308 CD ARG A 88 -4.325 22.287 -4.128 1.00 0.00 C ATOM 1309 NE ARG A 88 -4.419 23.744 -4.069 1.00 0.00 N ATOM 1310 CZ ARG A 88 -4.813 24.497 -5.089 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -5.149 23.935 -6.242 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -4.872 25.816 -4.957 1.00 0.00 N ATOM 0 H ARG A 88 -1.922 19.599 -3.069 1.00 0.00 H new ATOM 0 HA ARG A 88 -1.850 21.103 -5.273 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -1.378 22.077 -2.428 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -1.893 23.094 -3.759 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -3.503 20.649 -3.011 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.670 22.131 -2.090 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -3.971 21.986 -5.114 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -5.317 21.854 -4.000 1.00 0.00 H new ATOM 0 HE ARG A 88 -4.168 24.208 -3.196 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -5.105 22.921 -6.347 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -5.451 24.516 -7.024 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -4.615 26.252 -4.072 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -5.175 26.394 -5.741 1.00 0.00 H new ATOM 1326 N ALA A 89 1.095 21.249 -3.828 1.00 0.00 N ATOM 1327 CA ALA A 89 2.483 21.650 -4.025 1.00 0.00 C ATOM 1328 C ALA A 89 3.079 20.980 -5.258 1.00 0.00 C ATOM 1329 O ALA A 89 3.464 21.650 -6.215 1.00 0.00 O ATOM 1330 CB ALA A 89 3.308 21.318 -2.790 1.00 0.00 C ATOM 0 H ALA A 89 0.935 20.675 -3.000 1.00 0.00 H new ATOM 0 HA ALA A 89 2.505 22.728 -4.184 1.00 0.00 H new ATOM 0 HB1 ALA A 89 4.342 21.623 -2.951 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.903 21.849 -1.928 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.271 20.244 -2.605 1.00 0.00 H new ATOM 1336 N GLY A 90 3.152 19.653 -5.228 1.00 0.00 N ATOM 1337 CA GLY A 90 3.703 18.915 -6.349 1.00 0.00 C ATOM 1338 C GLY A 90 3.151 17.507 -6.444 1.00 0.00 C ATOM 1339 O GLY A 90 1.963 17.283 -6.212 1.00 0.00 O ATOM 0 H GLY A 90 2.839 19.076 -4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.486 19.450 -7.274 1.00 0.00 H new ATOM 0 HA3 GLY A 90 4.788 18.871 -6.253 1.00 0.00 H new ATOM 1343 N GLN A 91 4.014 16.556 -6.788 1.00 0.00 N ATOM 1344 CA GLN A 91 3.603 15.163 -6.916 1.00 0.00 C ATOM 1345 C GLN A 91 4.806 14.230 -6.816 1.00 0.00 C ATOM 1346 O GLN A 91 5.904 14.569 -7.253 1.00 0.00 O ATOM 1347 CB GLN A 91 2.880 14.942 -8.245 1.00 0.00 C ATOM 1348 CG GLN A 91 2.676 13.475 -8.590 1.00 0.00 C ATOM 1349 CD GLN A 91 2.334 13.262 -10.052 1.00 0.00 C ATOM 1350 OE1 GLN A 91 1.234 12.821 -10.386 1.00 0.00 O ATOM 1351 NE2 GLN A 91 3.276 13.576 -10.933 1.00 0.00 N ATOM 0 H GLN A 91 5.001 16.725 -6.983 1.00 0.00 H new ATOM 0 HA GLN A 91 2.920 14.935 -6.098 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.909 15.436 -8.208 1.00 0.00 H new ATOM 0 HB3 GLN A 91 3.450 15.418 -9.043 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.582 12.919 -8.348 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.877 13.068 -7.971 1.00 0.00 H new ATOM 0 HE21 GLN A 91 4.174 13.939 -10.612 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.102 13.455 -11.931 1.00 0.00 H new ATOM 1360 N ASN A 92 4.589 13.053 -6.238 1.00 0.00 N ATOM 1361 CA ASN A 92 5.656 12.071 -6.080 1.00 0.00 C ATOM 1362 C ASN A 92 5.117 10.652 -6.236 1.00 0.00 C ATOM 1363 O ASN A 92 3.906 10.433 -6.230 1.00 0.00 O ATOM 1364 CB ASN A 92 6.324 12.227 -4.712 1.00 0.00 C ATOM 1365 CG ASN A 92 7.457 13.235 -4.734 1.00 0.00 C ATOM 1366 OD1 ASN A 92 7.247 14.415 -5.015 1.00 0.00 O ATOM 1367 ND2 ASN A 92 8.665 12.773 -4.436 1.00 0.00 N ATOM 0 H ASN A 92 3.685 12.756 -5.871 1.00 0.00 H new ATOM 0 HA ASN A 92 6.396 12.248 -6.860 1.00 0.00 H new ATOM 0 HB2 ASN A 92 5.579 12.538 -3.980 1.00 0.00 H new ATOM 0 HB3 ASN A 92 6.707 11.260 -4.385 1.00 0.00 H new ATOM 0 HD21 ASN A 92 9.466 13.404 -4.434 1.00 0.00 H new ATOM 0 HD22 ASN A 92 8.792 11.787 -4.209 1.00 0.00 H new ATOM 1374 N SER A 93 6.026 9.692 -6.376 1.00 0.00 N ATOM 1375 CA SER A 93 5.642 8.294 -6.537 1.00 0.00 C ATOM 1376 C SER A 93 6.749 7.367 -6.045 1.00 0.00 C ATOM 1377 O SER A 93 7.922 7.741 -6.019 1.00 0.00 O ATOM 1378 CB SER A 93 5.326 7.996 -8.004 1.00 0.00 C ATOM 1379 OG SER A 93 4.626 9.073 -8.604 1.00 0.00 O ATOM 0 H SER A 93 7.033 9.856 -6.381 1.00 0.00 H new ATOM 0 HA SER A 93 4.750 8.116 -5.937 1.00 0.00 H new ATOM 0 HB2 SER A 93 6.252 7.812 -8.549 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.729 7.087 -8.073 1.00 0.00 H new ATOM 0 HG SER A 93 4.437 8.859 -9.541 1.00 0.00 H new ATOM 1385 N PHE A 94 6.367 6.155 -5.654 1.00 0.00 N ATOM 1386 CA PHE A 94 7.326 5.174 -5.161 1.00 0.00 C ATOM 1387 C PHE A 94 6.974 3.774 -5.657 1.00 0.00 C ATOM 1388 O PHE A 94 5.834 3.506 -6.037 1.00 0.00 O ATOM 1389 CB PHE A 94 7.365 5.191 -3.632 1.00 0.00 C ATOM 1390 CG PHE A 94 6.232 4.438 -2.995 1.00 0.00 C ATOM 1391 CD1 PHE A 94 6.339 3.080 -2.743 1.00 0.00 C ATOM 1392 CD2 PHE A 94 5.060 5.090 -2.647 1.00 0.00 C ATOM 1393 CE1 PHE A 94 5.298 2.386 -2.158 1.00 0.00 C ATOM 1394 CE2 PHE A 94 4.015 4.400 -2.061 1.00 0.00 C ATOM 1395 CZ PHE A 94 4.135 3.047 -1.815 1.00 0.00 C ATOM 0 H PHE A 94 5.400 5.829 -5.669 1.00 0.00 H new ATOM 0 HA PHE A 94 8.311 5.440 -5.545 1.00 0.00 H new ATOM 0 HB2 PHE A 94 8.309 4.763 -3.296 1.00 0.00 H new ATOM 0 HB3 PHE A 94 7.343 6.225 -3.287 1.00 0.00 H new ATOM 0 HD1 PHE A 94 7.247 2.558 -3.007 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.962 6.149 -2.836 1.00 0.00 H new ATOM 0 HE1 PHE A 94 5.393 1.327 -1.969 1.00 0.00 H new ATOM 0 HE2 PHE A 94 3.106 4.919 -1.796 1.00 0.00 H new ATOM 0 HZ PHE A 94 3.321 2.506 -1.355 1.00 0.00 H new ATOM 1405 N SER A 95 7.962 2.885 -5.650 1.00 0.00 N ATOM 1406 CA SER A 95 7.759 1.513 -6.102 1.00 0.00 C ATOM 1407 C SER A 95 8.039 0.523 -4.976 1.00 0.00 C ATOM 1408 O SER A 95 8.841 0.792 -4.081 1.00 0.00 O ATOM 1409 CB SER A 95 8.662 1.210 -7.300 1.00 0.00 C ATOM 1410 OG SER A 95 10.023 1.149 -6.910 1.00 0.00 O ATOM 0 H SER A 95 8.911 3.090 -5.336 1.00 0.00 H new ATOM 0 HA SER A 95 6.717 1.406 -6.405 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.367 0.263 -7.751 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.533 1.980 -8.061 1.00 0.00 H new ATOM 0 HG SER A 95 10.579 0.953 -7.693 1.00 0.00 H new ATOM 1416 N LEU A 96 7.372 -0.625 -5.027 1.00 0.00 N ATOM 1417 CA LEU A 96 7.547 -1.658 -4.012 1.00 0.00 C ATOM 1418 C LEU A 96 7.292 -3.044 -4.595 1.00 0.00 C ATOM 1419 O LEU A 96 6.610 -3.184 -5.609 1.00 0.00 O ATOM 1420 CB LEU A 96 6.605 -1.407 -2.833 1.00 0.00 C ATOM 1421 CG LEU A 96 5.216 -2.038 -2.937 1.00 0.00 C ATOM 1422 CD1 LEU A 96 5.255 -3.490 -2.489 1.00 0.00 C ATOM 1423 CD2 LEU A 96 4.209 -1.249 -2.113 1.00 0.00 C ATOM 0 H LEU A 96 6.705 -0.864 -5.761 1.00 0.00 H new ATOM 0 HA LEU A 96 8.578 -1.616 -3.661 1.00 0.00 H new ATOM 0 HB2 LEU A 96 7.083 -1.778 -1.926 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.485 -0.330 -2.713 1.00 0.00 H new ATOM 0 HG LEU A 96 4.902 -2.010 -3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.258 -3.923 -2.570 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.945 -4.048 -3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.590 -3.542 -1.453 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.226 -1.712 -2.199 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.518 -1.244 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.161 -0.224 -2.482 1.00 0.00 H new ATOM 1435 N GLU A 97 7.844 -4.064 -3.946 1.00 0.00 N ATOM 1436 CA GLU A 97 7.674 -5.439 -4.400 1.00 0.00 C ATOM 1437 C GLU A 97 7.106 -6.314 -3.287 1.00 0.00 C ATOM 1438 O GLU A 97 7.421 -6.124 -2.111 1.00 0.00 O ATOM 1439 CB GLU A 97 9.010 -6.010 -4.881 1.00 0.00 C ATOM 1440 CG GLU A 97 8.929 -7.462 -5.322 1.00 0.00 C ATOM 1441 CD GLU A 97 10.032 -7.839 -6.292 1.00 0.00 C ATOM 1442 OE1 GLU A 97 10.471 -6.959 -7.061 1.00 0.00 O ATOM 1443 OE2 GLU A 97 10.455 -9.014 -6.282 1.00 0.00 O ATOM 0 H GLU A 97 8.412 -3.964 -3.105 1.00 0.00 H new ATOM 0 HA GLU A 97 6.968 -5.435 -5.231 1.00 0.00 H new ATOM 0 HB2 GLU A 97 9.375 -5.407 -5.712 1.00 0.00 H new ATOM 0 HB3 GLU A 97 9.742 -5.923 -4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 97 8.985 -8.108 -4.446 1.00 0.00 H new ATOM 0 HG3 GLU A 97 7.961 -7.642 -5.790 1.00 0.00 H new ATOM 1450 N LEU A 98 6.268 -7.273 -3.665 1.00 0.00 N ATOM 1451 CA LEU A 98 5.655 -8.179 -2.699 1.00 0.00 C ATOM 1452 C LEU A 98 5.745 -9.625 -3.175 1.00 0.00 C ATOM 1453 O LEU A 98 5.368 -9.943 -4.303 1.00 0.00 O ATOM 1454 CB LEU A 98 4.192 -7.796 -2.469 1.00 0.00 C ATOM 1455 CG LEU A 98 3.282 -8.908 -1.948 1.00 0.00 C ATOM 1456 CD1 LEU A 98 3.546 -9.167 -0.472 1.00 0.00 C ATOM 1457 CD2 LEU A 98 1.820 -8.550 -2.175 1.00 0.00 C ATOM 0 H LEU A 98 5.997 -7.444 -4.633 1.00 0.00 H new ATOM 0 HA LEU A 98 6.200 -8.091 -1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.161 -6.967 -1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.781 -7.428 -3.409 1.00 0.00 H new ATOM 0 HG LEU A 98 3.503 -9.821 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.889 -9.962 -0.119 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.585 -9.468 -0.335 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.354 -8.257 0.097 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.186 -9.353 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.586 -7.625 -1.648 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.640 -8.416 -3.242 1.00 0.00 H new ATOM 1469 N VAL A 99 6.247 -10.498 -2.307 1.00 0.00 N ATOM 1470 CA VAL A 99 6.383 -11.912 -2.637 1.00 0.00 C ATOM 1471 C VAL A 99 5.306 -12.743 -1.949 1.00 0.00 C ATOM 1472 O VAL A 99 4.898 -12.444 -0.827 1.00 0.00 O ATOM 1473 CB VAL A 99 7.768 -12.451 -2.233 1.00 0.00 C ATOM 1474 CG1 VAL A 99 7.862 -13.944 -2.509 1.00 0.00 C ATOM 1475 CG2 VAL A 99 8.868 -11.695 -2.965 1.00 0.00 C ATOM 0 H VAL A 99 6.566 -10.251 -1.370 1.00 0.00 H new ATOM 0 HA VAL A 99 6.269 -11.998 -3.718 1.00 0.00 H new ATOM 0 HB VAL A 99 7.901 -12.295 -1.162 1.00 0.00 H new ATOM 0 HG11 VAL A 99 8.848 -14.307 -2.217 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.098 -14.469 -1.936 1.00 0.00 H new ATOM 0 HG13 VAL A 99 7.708 -14.128 -3.572 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.840 -12.089 -2.668 1.00 0.00 H new ATOM 0 HG22 VAL A 99 8.740 -11.818 -4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 99 8.813 -10.636 -2.712 1.00 0.00 H new ATOM 1485 N VAL A 100 4.849 -13.789 -2.630 1.00 0.00 N ATOM 1486 CA VAL A 100 3.820 -14.666 -2.084 1.00 0.00 C ATOM 1487 C VAL A 100 4.211 -16.132 -2.235 1.00 0.00 C ATOM 1488 O VAL A 100 4.681 -16.554 -3.290 1.00 0.00 O ATOM 1489 CB VAL A 100 2.462 -14.435 -2.773 1.00 0.00 C ATOM 1490 CG1 VAL A 100 2.625 -14.430 -4.286 1.00 0.00 C ATOM 1491 CG2 VAL A 100 1.458 -15.492 -2.340 1.00 0.00 C ATOM 0 H VAL A 100 5.175 -14.050 -3.561 1.00 0.00 H new ATOM 0 HA VAL A 100 3.727 -14.424 -1.025 1.00 0.00 H new ATOM 0 HB VAL A 100 2.081 -13.460 -2.469 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.655 -14.266 -4.756 1.00 0.00 H new ATOM 0 HG12 VAL A 100 3.309 -13.632 -4.576 1.00 0.00 H new ATOM 0 HG13 VAL A 100 3.028 -15.389 -4.612 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.504 -15.313 -2.837 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.829 -16.480 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 100 1.320 -15.442 -1.260 1.00 0.00 H new ATOM 1501 N ALA A 101 4.012 -16.904 -1.171 1.00 0.00 N ATOM 1502 CA ALA A 101 4.341 -18.324 -1.186 1.00 0.00 C ATOM 1503 C ALA A 101 3.100 -19.178 -0.947 1.00 0.00 C ATOM 1504 O ALA A 101 2.459 -19.080 0.099 1.00 0.00 O ATOM 1505 CB ALA A 101 5.403 -18.630 -0.140 1.00 0.00 C ATOM 0 H ALA A 101 3.625 -16.570 -0.289 1.00 0.00 H new ATOM 0 HA ALA A 101 4.735 -18.570 -2.172 1.00 0.00 H new ATOM 0 HB1 ALA A 101 5.639 -19.694 -0.162 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.303 -18.054 -0.356 1.00 0.00 H new ATOM 0 HB3 ALA A 101 5.029 -18.362 0.848 1.00 0.00 H new ATOM 1511 N ALA A 102 2.766 -20.013 -1.925 1.00 0.00 N ATOM 1512 CA ALA A 102 1.602 -20.885 -1.821 1.00 0.00 C ATOM 1513 C ALA A 102 1.660 -21.728 -0.552 1.00 0.00 C ATOM 1514 O ALA A 102 2.726 -22.196 -0.152 1.00 0.00 O ATOM 1515 CB ALA A 102 1.501 -21.780 -3.047 1.00 0.00 C ATOM 0 H ALA A 102 3.285 -20.104 -2.798 1.00 0.00 H new ATOM 0 HA ALA A 102 0.712 -20.257 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.627 -22.425 -2.955 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.404 -21.163 -3.941 1.00 0.00 H new ATOM 0 HB3 ALA A 102 2.399 -22.393 -3.125 1.00 0.00 H new ATOM 1521 N LYS A 103 0.506 -21.918 0.079 1.00 0.00 N ATOM 1522 CA LYS A 103 0.424 -22.706 1.304 1.00 0.00 C ATOM 1523 C LYS A 103 1.413 -23.866 1.272 1.00 0.00 C ATOM 1524 O LYS A 103 2.185 -24.061 2.210 1.00 0.00 O ATOM 1525 CB LYS A 103 -0.998 -23.238 1.498 1.00 0.00 C ATOM 1526 CG LYS A 103 -1.534 -23.994 0.294 1.00 0.00 C ATOM 1527 CD LYS A 103 -3.052 -23.972 0.252 1.00 0.00 C ATOM 1528 CE LYS A 103 -3.592 -24.850 -0.867 1.00 0.00 C ATOM 1529 NZ LYS A 103 -3.084 -26.246 -0.771 1.00 0.00 N ATOM 0 H LYS A 103 -0.386 -21.537 -0.238 1.00 0.00 H new ATOM 0 HA LYS A 103 0.680 -22.057 2.142 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.015 -23.896 2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.663 -22.403 1.717 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -1.137 -23.552 -0.620 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.185 -25.026 0.327 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.448 -24.314 1.208 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.398 -22.948 0.112 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.681 -24.857 -0.830 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.309 -24.426 -1.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.834 -26.909 -1.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.265 -26.362 -1.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -2.797 -26.444 0.209 1.00 0.00 H new ATOM 1543 N GLU A 104 1.384 -24.633 0.186 1.00 0.00 N ATOM 1544 CA GLU A 104 2.280 -25.773 0.033 1.00 0.00 C ATOM 1545 C GLU A 104 2.231 -26.316 -1.393 1.00 0.00 C ATOM 1546 O GLU A 104 1.247 -26.125 -2.108 1.00 0.00 O ATOM 1547 CB GLU A 104 1.908 -26.878 1.024 1.00 0.00 C ATOM 1548 CG GLU A 104 0.569 -27.534 0.729 1.00 0.00 C ATOM 1549 CD GLU A 104 0.188 -28.573 1.766 1.00 0.00 C ATOM 1550 OE1 GLU A 104 1.103 -29.151 2.390 1.00 0.00 O ATOM 1551 OE2 GLU A 104 -1.024 -28.809 1.953 1.00 0.00 O ATOM 0 H GLU A 104 0.750 -24.486 -0.600 1.00 0.00 H new ATOM 0 HA GLU A 104 3.295 -25.435 0.240 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.687 -27.641 1.014 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.884 -26.459 2.030 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.205 -26.768 0.686 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.607 -28.004 -0.254 1.00 0.00 H new ATOM 1558 N SER A 105 3.301 -26.993 -1.799 1.00 0.00 N ATOM 1559 CA SER A 105 3.383 -27.559 -3.140 1.00 0.00 C ATOM 1560 C SER A 105 3.499 -29.080 -3.081 1.00 0.00 C ATOM 1561 O SER A 105 4.412 -29.667 -3.659 1.00 0.00 O ATOM 1562 CB SER A 105 4.580 -26.974 -3.891 1.00 0.00 C ATOM 1563 OG SER A 105 4.395 -25.593 -4.147 1.00 0.00 O ATOM 0 H SER A 105 4.122 -27.163 -1.218 1.00 0.00 H new ATOM 0 HA SER A 105 2.468 -27.302 -3.673 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.488 -27.120 -3.305 1.00 0.00 H new ATOM 0 HB3 SER A 105 4.719 -27.506 -4.832 1.00 0.00 H new ATOM 0 HG SER A 105 5.174 -25.242 -4.626 1.00 0.00 H new ATOM 1569 N GLY A 106 2.564 -29.711 -2.377 1.00 0.00 N ATOM 1570 CA GLY A 106 2.579 -31.157 -2.255 1.00 0.00 C ATOM 1571 C GLY A 106 1.293 -31.702 -1.664 1.00 0.00 C ATOM 1572 O GLY A 106 1.212 -32.007 -0.474 1.00 0.00 O ATOM 0 H GLY A 106 1.797 -29.247 -1.890 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.740 -31.600 -3.238 1.00 0.00 H new ATOM 0 HA3 GLY A 106 3.419 -31.457 -1.629 1.00 0.00 H new ATOM 1576 N PRO A 107 0.258 -31.830 -2.508 1.00 0.00 N ATOM 1577 CA PRO A 107 -1.049 -32.341 -2.084 1.00 0.00 C ATOM 1578 C PRO A 107 -1.010 -33.829 -1.751 1.00 0.00 C ATOM 1579 O PRO A 107 -0.834 -34.668 -2.635 1.00 0.00 O ATOM 1580 CB PRO A 107 -1.940 -32.089 -3.303 1.00 0.00 C ATOM 1581 CG PRO A 107 -1.002 -32.067 -4.460 1.00 0.00 C ATOM 1582 CD PRO A 107 0.284 -31.486 -3.939 1.00 0.00 C ATOM 0 HA PRO A 107 -1.401 -31.856 -1.174 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -2.689 -32.873 -3.415 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -2.478 -31.146 -3.212 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -0.845 -33.071 -4.854 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -1.401 -31.463 -5.275 1.00 0.00 H new ATOM 0 HD2 PRO A 107 1.151 -31.916 -4.440 1.00 0.00 H new ATOM 0 HD3 PRO A 107 0.329 -30.408 -4.092 1.00 0.00 H new ATOM 1590 N SER A 108 -1.176 -34.149 -0.472 1.00 0.00 N ATOM 1591 CA SER A 108 -1.156 -35.535 -0.022 1.00 0.00 C ATOM 1592 C SER A 108 0.011 -36.293 -0.649 1.00 0.00 C ATOM 1593 O SER A 108 -0.112 -37.468 -0.994 1.00 0.00 O ATOM 1594 CB SER A 108 -2.475 -36.227 -0.373 1.00 0.00 C ATOM 1595 OG SER A 108 -3.527 -35.771 0.460 1.00 0.00 O ATOM 0 H SER A 108 -1.326 -33.467 0.271 1.00 0.00 H new ATOM 0 HA SER A 108 -1.029 -35.538 1.061 1.00 0.00 H new ATOM 0 HB2 SER A 108 -2.724 -36.035 -1.417 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.363 -37.306 -0.265 1.00 0.00 H new ATOM 0 HG SER A 108 -4.359 -36.227 0.215 1.00 0.00 H new ATOM 1601 N SER A 109 1.142 -35.611 -0.792 1.00 0.00 N ATOM 1602 CA SER A 109 2.331 -36.217 -1.381 1.00 0.00 C ATOM 1603 C SER A 109 3.214 -36.839 -0.303 1.00 0.00 C ATOM 1604 O SER A 109 3.380 -36.278 0.779 1.00 0.00 O ATOM 1605 CB SER A 109 3.126 -35.173 -2.167 1.00 0.00 C ATOM 1606 OG SER A 109 3.468 -34.069 -1.347 1.00 0.00 O ATOM 0 H SER A 109 1.261 -34.638 -0.508 1.00 0.00 H new ATOM 0 HA SER A 109 2.008 -37.005 -2.061 1.00 0.00 H new ATOM 0 HB2 SER A 109 4.032 -35.627 -2.567 1.00 0.00 H new ATOM 0 HB3 SER A 109 2.539 -34.829 -3.019 1.00 0.00 H new ATOM 0 HG SER A 109 4.107 -33.496 -1.820 1.00 0.00 H new ATOM 1612 N GLY A 110 3.778 -38.003 -0.608 1.00 0.00 N ATOM 1613 CA GLY A 110 4.637 -38.684 0.343 1.00 0.00 C ATOM 1614 C GLY A 110 4.312 -40.159 0.467 1.00 0.00 C ATOM 1615 O GLY A 110 3.661 -40.733 -0.406 1.00 0.00 O ATOM 0 H GLY A 110 3.655 -38.487 -1.497 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.676 -38.569 0.036 1.00 0.00 H new ATOM 0 HA3 GLY A 110 4.539 -38.210 1.320 1.00 0.00 H new TER 1619 GLY A 110