USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 943 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 Single : A 1 MET CE :methyl -159:sc= -1.43 (180deg=-1.9!) USER MOD Single : A 3 ASN : amide:sc= -0.776 K(o=-0.78,f=-4.5) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ -123:sc= 0.0197 (180deg=-1.04) USER MOD Single : A 12 THR OG1 : rot 156:sc= 0.943 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.196 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 25 ASN : amide:sc= -0.591 K(o=-0.59,f=-0.062) USER MOD Single : A 30 THR OG1 : rot 74:sc= 1.36 USER MOD Single : A 32 THR OG1 : rot 71:sc= 1.21 USER MOD Single : A 34 MET CE :methyl 157:sc= -3.7! (180deg=-6.03!) USER MOD Single : A 38 LYS NZ :NH3+ 164:sc= 0.00146 (180deg=0) USER MOD Single : A 40 SER OG : rot -160:sc= -0.262 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot 60:sc= -2.95! USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= -0.017 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.757 K(o=-0.76,f=-3.6!) USER MOD Single : A 66 ASN : amide:sc= -0.809 X(o=-0.81,f=-0.87) USER MOD Single : A 69 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.5) USER MOD Single : A 70 ASN : amide:sc= 0.766 K(o=0.77,f=-0.05) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -41:sc= -0.468! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= -3.11 K(o=-3.1,f=-2.1) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.291 X(o=-0.29,f=-0.076) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.402 X(o=-0.4,f=-0.32) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 25.315 -8.029 2.853 1.00 0.00 N ATOM 2 CA GLY A -3 25.695 -9.429 2.848 1.00 0.00 C ATOM 3 C GLY A -3 24.506 -10.353 3.024 1.00 0.00 C ATOM 4 O GLY A -3 23.387 -10.017 2.634 1.00 0.00 O ATOM 0 H1 GLY A -3 25.633 -7.580 1.971 1.00 0.00 H new ATOM 0 H2 GLY A -3 24.281 -7.950 2.928 1.00 0.00 H new ATOM 0 H3 GLY A -3 25.758 -7.552 3.664 1.00 0.00 H new ATOM 0 HA2 GLY A -3 26.197 -9.663 1.909 1.00 0.00 H new ATOM 0 HA3 GLY A -3 26.414 -9.610 3.647 1.00 0.00 H new ATOM 8 N SER A -2 24.747 -11.520 3.612 1.00 0.00 N ATOM 9 CA SER A -2 23.688 -12.498 3.834 1.00 0.00 C ATOM 10 C SER A -2 24.235 -13.744 4.524 1.00 0.00 C ATOM 11 O SER A -2 23.554 -14.364 5.341 1.00 0.00 O ATOM 12 CB SER A -2 23.034 -12.883 2.506 1.00 0.00 C ATOM 13 OG SER A -2 22.246 -14.052 2.645 1.00 0.00 O ATOM 0 H SER A -2 25.666 -11.812 3.943 1.00 0.00 H new ATOM 0 HA SER A -2 22.938 -12.044 4.482 1.00 0.00 H new ATOM 0 HB2 SER A -2 22.412 -12.061 2.152 1.00 0.00 H new ATOM 0 HB3 SER A -2 23.804 -13.047 1.752 1.00 0.00 H new ATOM 0 HG SER A -2 21.838 -14.276 1.783 1.00 0.00 H new ATOM 19 N HIS A -1 25.470 -14.104 4.189 1.00 0.00 N ATOM 20 CA HIS A -1 26.110 -15.276 4.777 1.00 0.00 C ATOM 21 C HIS A -1 26.649 -14.960 6.169 1.00 0.00 C ATOM 22 O HIS A -1 27.210 -15.827 6.838 1.00 0.00 O ATOM 23 CB HIS A -1 27.244 -15.768 3.877 1.00 0.00 C ATOM 24 CG HIS A -1 26.929 -17.045 3.160 1.00 0.00 C ATOM 25 ND1 HIS A -1 26.760 -18.250 3.809 1.00 0.00 N ATOM 26 CD2 HIS A -1 26.751 -17.300 1.843 1.00 0.00 C ATOM 27 CE1 HIS A -1 26.493 -19.191 2.921 1.00 0.00 C ATOM 28 NE2 HIS A -1 26.481 -18.641 1.721 1.00 0.00 N ATOM 0 H HIS A -1 26.047 -13.602 3.514 1.00 0.00 H new ATOM 0 HA HIS A -1 25.361 -16.062 4.868 1.00 0.00 H new ATOM 0 HB2 HIS A -1 27.475 -14.996 3.143 1.00 0.00 H new ATOM 0 HB3 HIS A -1 28.140 -15.912 4.481 1.00 0.00 H new ATOM 0 HD2 HIS A -1 26.810 -16.583 1.038 1.00 0.00 H new ATOM 0 HE1 HIS A -1 26.315 -20.233 3.140 1.00 0.00 H new ATOM 0 HE2 HIS A -1 26.301 -19.132 0.845 1.00 0.00 H new ATOM 36 N MET A 1 26.475 -13.714 6.596 1.00 0.00 N ATOM 37 CA MET A 1 26.944 -13.285 7.909 1.00 0.00 C ATOM 38 C MET A 1 25.989 -12.265 8.521 1.00 0.00 C ATOM 39 O MET A 1 26.337 -11.570 9.475 1.00 0.00 O ATOM 40 CB MET A 1 28.348 -12.685 7.802 1.00 0.00 C ATOM 41 CG MET A 1 28.551 -11.834 6.559 1.00 0.00 C ATOM 42 SD MET A 1 29.523 -12.673 5.293 1.00 0.00 S ATOM 43 CE MET A 1 28.492 -12.417 3.851 1.00 0.00 C ATOM 0 H MET A 1 26.013 -12.984 6.053 1.00 0.00 H new ATOM 0 HA MET A 1 26.979 -14.160 8.558 1.00 0.00 H new ATOM 0 HB2 MET A 1 28.543 -12.076 8.685 1.00 0.00 H new ATOM 0 HB3 MET A 1 29.080 -13.492 7.804 1.00 0.00 H new ATOM 0 HG2 MET A 1 27.579 -11.564 6.146 1.00 0.00 H new ATOM 0 HG3 MET A 1 29.048 -10.905 6.837 1.00 0.00 H new ATOM 0 HE1 MET A 1 28.737 -13.160 3.092 1.00 0.00 H new ATOM 0 HE2 MET A 1 27.443 -12.516 4.131 1.00 0.00 H new ATOM 0 HE3 MET A 1 28.667 -11.418 3.451 1.00 0.00 H new ATOM 53 N ILE A 2 24.784 -12.182 7.965 1.00 0.00 N ATOM 54 CA ILE A 2 23.780 -11.248 8.458 1.00 0.00 C ATOM 55 C ILE A 2 22.381 -11.847 8.368 1.00 0.00 C ATOM 56 O ILE A 2 22.221 -13.060 8.238 1.00 0.00 O ATOM 57 CB ILE A 2 23.810 -9.923 7.673 1.00 0.00 C ATOM 58 CG1 ILE A 2 25.114 -9.803 6.882 1.00 0.00 C ATOM 59 CG2 ILE A 2 23.647 -8.743 8.619 1.00 0.00 C ATOM 60 CD1 ILE A 2 25.246 -8.498 6.128 1.00 0.00 C ATOM 0 H ILE A 2 24.480 -12.750 7.174 1.00 0.00 H new ATOM 0 HA ILE A 2 24.021 -11.048 9.502 1.00 0.00 H new ATOM 0 HB ILE A 2 22.978 -9.916 6.969 1.00 0.00 H new ATOM 0 HG12 ILE A 2 25.956 -9.904 7.567 1.00 0.00 H new ATOM 0 HG13 ILE A 2 25.178 -10.630 6.175 1.00 0.00 H new ATOM 0 HG21 ILE A 2 23.670 -7.814 8.049 1.00 0.00 H new ATOM 0 HG22 ILE A 2 22.694 -8.824 9.141 1.00 0.00 H new ATOM 0 HG23 ILE A 2 24.460 -8.744 9.345 1.00 0.00 H new ATOM 0 HD11 ILE A 2 26.194 -8.483 5.590 1.00 0.00 H new ATOM 0 HD12 ILE A 2 24.425 -8.403 5.418 1.00 0.00 H new ATOM 0 HD13 ILE A 2 25.215 -7.666 6.832 1.00 0.00 H new ATOM 72 N ASN A 3 21.369 -10.988 8.436 1.00 0.00 N ATOM 73 CA ASN A 3 19.982 -11.433 8.361 1.00 0.00 C ATOM 74 C ASN A 3 19.028 -10.242 8.358 1.00 0.00 C ATOM 75 O ASN A 3 19.176 -9.312 9.151 1.00 0.00 O ATOM 76 CB ASN A 3 19.657 -12.358 9.535 1.00 0.00 C ATOM 77 CG ASN A 3 18.222 -12.847 9.506 1.00 0.00 C ATOM 78 OD1 ASN A 3 17.560 -12.803 8.469 1.00 0.00 O ATOM 79 ND2 ASN A 3 17.734 -13.317 10.648 1.00 0.00 N ATOM 0 H ASN A 3 21.483 -9.980 8.543 1.00 0.00 H new ATOM 0 HA ASN A 3 19.853 -11.982 7.428 1.00 0.00 H new ATOM 0 HB2 ASN A 3 20.330 -13.215 9.516 1.00 0.00 H new ATOM 0 HB3 ASN A 3 19.839 -11.830 10.471 1.00 0.00 H new ATOM 0 HD21 ASN A 3 16.774 -13.660 10.690 1.00 0.00 H new ATOM 0 HD22 ASN A 3 18.319 -13.335 11.484 1.00 0.00 H new ATOM 86 N LEU A 4 18.049 -10.278 7.461 1.00 0.00 N ATOM 87 CA LEU A 4 17.069 -9.202 7.354 1.00 0.00 C ATOM 88 C LEU A 4 16.323 -9.013 8.671 1.00 0.00 C ATOM 89 O LEU A 4 15.823 -7.926 8.960 1.00 0.00 O ATOM 90 CB LEU A 4 16.076 -9.500 6.230 1.00 0.00 C ATOM 91 CG LEU A 4 16.504 -9.075 4.825 1.00 0.00 C ATOM 92 CD1 LEU A 4 16.019 -7.666 4.522 1.00 0.00 C ATOM 93 CD2 LEU A 4 18.016 -9.164 4.679 1.00 0.00 C ATOM 0 H LEU A 4 17.912 -11.040 6.797 1.00 0.00 H new ATOM 0 HA LEU A 4 17.602 -8.279 7.124 1.00 0.00 H new ATOM 0 HB2 LEU A 4 15.881 -10.572 6.220 1.00 0.00 H new ATOM 0 HB3 LEU A 4 15.133 -9.007 6.465 1.00 0.00 H new ATOM 0 HG LEU A 4 16.049 -9.756 4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 4 16.333 -7.381 3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 4 14.931 -7.634 4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 4 16.444 -6.971 5.246 1.00 0.00 H new ATOM 0 HD21 LEU A 4 18.303 -8.858 3.673 1.00 0.00 H new ATOM 0 HD22 LEU A 4 18.491 -8.507 5.408 1.00 0.00 H new ATOM 0 HD23 LEU A 4 18.338 -10.191 4.852 1.00 0.00 H new ATOM 105 N GLU A 5 16.255 -10.077 9.465 1.00 0.00 N ATOM 106 CA GLU A 5 15.571 -10.026 10.752 1.00 0.00 C ATOM 107 C GLU A 5 16.556 -9.735 11.880 1.00 0.00 C ATOM 108 O GLU A 5 16.227 -9.877 13.058 1.00 0.00 O ATOM 109 CB GLU A 5 14.845 -11.346 11.021 1.00 0.00 C ATOM 110 CG GLU A 5 13.332 -11.236 10.938 1.00 0.00 C ATOM 111 CD GLU A 5 12.818 -11.312 9.513 1.00 0.00 C ATOM 112 OE1 GLU A 5 12.852 -10.277 8.815 1.00 0.00 O ATOM 113 OE2 GLU A 5 12.382 -12.405 9.096 1.00 0.00 O ATOM 0 H GLU A 5 16.665 -10.984 9.240 1.00 0.00 H new ATOM 0 HA GLU A 5 14.840 -9.219 10.715 1.00 0.00 H new ATOM 0 HB2 GLU A 5 15.187 -12.092 10.303 1.00 0.00 H new ATOM 0 HB3 GLU A 5 15.121 -11.707 12.012 1.00 0.00 H new ATOM 0 HG2 GLU A 5 12.881 -12.035 11.526 1.00 0.00 H new ATOM 0 HG3 GLU A 5 13.015 -10.294 11.385 1.00 0.00 H new ATOM 120 N ASP A 6 17.766 -9.329 11.512 1.00 0.00 N ATOM 121 CA ASP A 6 18.799 -9.017 12.492 1.00 0.00 C ATOM 122 C ASP A 6 19.582 -7.775 12.080 1.00 0.00 C ATOM 123 O ASP A 6 20.737 -7.598 12.470 1.00 0.00 O ATOM 124 CB ASP A 6 19.751 -10.204 12.655 1.00 0.00 C ATOM 125 CG ASP A 6 20.456 -10.200 13.998 1.00 0.00 C ATOM 126 OD1 ASP A 6 19.761 -10.280 15.033 1.00 0.00 O ATOM 127 OD2 ASP A 6 21.701 -10.117 14.013 1.00 0.00 O ATOM 0 H ASP A 6 18.056 -9.208 10.541 1.00 0.00 H new ATOM 0 HA ASP A 6 18.312 -8.817 13.446 1.00 0.00 H new ATOM 0 HB2 ASP A 6 19.191 -11.133 12.544 1.00 0.00 H new ATOM 0 HB3 ASP A 6 20.494 -10.182 11.858 1.00 0.00 H new ATOM 132 N TYR A 7 18.947 -6.917 11.289 1.00 0.00 N ATOM 133 CA TYR A 7 19.585 -5.692 10.821 1.00 0.00 C ATOM 134 C TYR A 7 18.578 -4.788 10.118 1.00 0.00 C ATOM 135 O TYR A 7 18.929 -4.044 9.202 1.00 0.00 O ATOM 136 CB TYR A 7 20.739 -6.023 9.874 1.00 0.00 C ATOM 137 CG TYR A 7 21.989 -5.214 10.136 1.00 0.00 C ATOM 138 CD1 TYR A 7 21.971 -3.827 10.063 1.00 0.00 C ATOM 139 CD2 TYR A 7 23.189 -5.837 10.456 1.00 0.00 C ATOM 140 CE1 TYR A 7 23.110 -3.083 10.301 1.00 0.00 C ATOM 141 CE2 TYR A 7 24.334 -5.102 10.697 1.00 0.00 C ATOM 142 CZ TYR A 7 24.289 -3.725 10.619 1.00 0.00 C ATOM 143 OH TYR A 7 25.427 -2.989 10.857 1.00 0.00 O ATOM 0 H TYR A 7 17.991 -7.047 10.958 1.00 0.00 H new ATOM 0 HA TYR A 7 19.977 -5.162 11.689 1.00 0.00 H new ATOM 0 HB2 TYR A 7 20.977 -7.083 9.962 1.00 0.00 H new ATOM 0 HB3 TYR A 7 20.415 -5.853 8.847 1.00 0.00 H new ATOM 0 HD1 TYR A 7 21.049 -3.321 9.816 1.00 0.00 H new ATOM 0 HD2 TYR A 7 23.227 -6.915 10.517 1.00 0.00 H new ATOM 0 HE1 TYR A 7 23.078 -2.005 10.239 1.00 0.00 H new ATOM 0 HE2 TYR A 7 25.259 -5.602 10.945 1.00 0.00 H new ATOM 0 HH TYR A 7 26.169 -3.593 11.068 1.00 0.00 H new ATOM 153 N TRP A 8 17.325 -4.857 10.553 1.00 0.00 N ATOM 154 CA TRP A 8 16.266 -4.045 9.966 1.00 0.00 C ATOM 155 C TRP A 8 15.953 -2.840 10.846 1.00 0.00 C ATOM 156 O TRP A 8 15.339 -1.874 10.395 1.00 0.00 O ATOM 157 CB TRP A 8 15.004 -4.885 9.763 1.00 0.00 C ATOM 158 CG TRP A 8 14.452 -4.802 8.372 1.00 0.00 C ATOM 159 CD1 TRP A 8 14.847 -5.533 7.288 1.00 0.00 C ATOM 160 CD2 TRP A 8 13.408 -3.936 7.914 1.00 0.00 C ATOM 161 NE1 TRP A 8 14.110 -5.175 6.185 1.00 0.00 N ATOM 162 CE2 TRP A 8 13.220 -4.198 6.543 1.00 0.00 C ATOM 163 CE3 TRP A 8 12.611 -2.967 8.530 1.00 0.00 C ATOM 164 CZ2 TRP A 8 12.270 -3.524 5.780 1.00 0.00 C ATOM 165 CZ3 TRP A 8 11.668 -2.299 7.772 1.00 0.00 C ATOM 166 CH2 TRP A 8 11.504 -2.580 6.409 1.00 0.00 C ATOM 0 H TRP A 8 17.018 -5.467 11.310 1.00 0.00 H new ATOM 0 HA TRP A 8 16.613 -3.684 8.998 1.00 0.00 H new ATOM 0 HB2 TRP A 8 15.228 -5.926 9.996 1.00 0.00 H new ATOM 0 HB3 TRP A 8 14.241 -4.558 10.469 1.00 0.00 H new ATOM 0 HD1 TRP A 8 15.625 -6.282 7.297 1.00 0.00 H new ATOM 0 HE1 TRP A 8 14.210 -5.573 5.251 1.00 0.00 H new ATOM 0 HE3 TRP A 8 12.730 -2.744 9.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.142 -3.738 4.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 11.047 -1.548 8.238 1.00 0.00 H new ATOM 0 HH2 TRP A 8 10.758 -2.041 5.844 1.00 0.00 H new ATOM 177 N GLU A 9 16.380 -2.904 12.104 1.00 0.00 N ATOM 178 CA GLU A 9 16.143 -1.817 13.046 1.00 0.00 C ATOM 179 C GLU A 9 16.741 -2.141 14.412 1.00 0.00 C ATOM 180 O GLU A 9 16.617 -3.263 14.905 1.00 0.00 O ATOM 181 CB GLU A 9 14.643 -1.549 13.184 1.00 0.00 C ATOM 182 CG GLU A 9 13.804 -2.813 13.263 1.00 0.00 C ATOM 183 CD GLU A 9 12.319 -2.522 13.359 1.00 0.00 C ATOM 184 OE1 GLU A 9 11.733 -2.090 12.343 1.00 0.00 O ATOM 185 OE2 GLU A 9 11.742 -2.725 14.447 1.00 0.00 O ATOM 0 H GLU A 9 16.891 -3.696 12.493 1.00 0.00 H new ATOM 0 HA GLU A 9 16.630 -0.922 12.658 1.00 0.00 H new ATOM 0 HB2 GLU A 9 14.470 -0.952 14.079 1.00 0.00 H new ATOM 0 HB3 GLU A 9 14.309 -0.954 12.334 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.994 -3.426 12.382 1.00 0.00 H new ATOM 0 HG3 GLU A 9 14.113 -3.396 14.130 1.00 0.00 H new ATOM 192 N ASP A 10 17.389 -1.152 15.018 1.00 0.00 N ATOM 193 CA ASP A 10 18.006 -1.331 16.327 1.00 0.00 C ATOM 194 C ASP A 10 17.666 -0.166 17.251 1.00 0.00 C ATOM 195 O ASP A 10 18.309 0.028 18.282 1.00 0.00 O ATOM 196 CB ASP A 10 19.523 -1.461 16.186 1.00 0.00 C ATOM 197 CG ASP A 10 20.007 -2.879 16.416 1.00 0.00 C ATOM 198 OD1 ASP A 10 19.873 -3.709 15.492 1.00 0.00 O ATOM 199 OD2 ASP A 10 20.517 -3.161 17.521 1.00 0.00 O ATOM 0 H ASP A 10 17.501 -0.218 14.623 1.00 0.00 H new ATOM 0 HA ASP A 10 17.611 -2.247 16.766 1.00 0.00 H new ATOM 0 HB2 ASP A 10 19.821 -1.136 15.189 1.00 0.00 H new ATOM 0 HB3 ASP A 10 20.009 -0.794 16.898 1.00 0.00 H new ATOM 204 N GLU A 11 16.653 0.607 16.874 1.00 0.00 N ATOM 205 CA GLU A 11 16.230 1.754 17.668 1.00 0.00 C ATOM 206 C GLU A 11 14.774 2.108 17.381 1.00 0.00 C ATOM 207 O GLU A 11 14.401 3.282 17.354 1.00 0.00 O ATOM 208 CB GLU A 11 17.126 2.960 17.381 1.00 0.00 C ATOM 209 CG GLU A 11 18.458 2.917 18.112 1.00 0.00 C ATOM 210 CD GLU A 11 19.203 4.236 18.046 1.00 0.00 C ATOM 211 OE1 GLU A 11 18.806 5.178 18.762 1.00 0.00 O ATOM 212 OE2 GLU A 11 20.183 4.325 17.277 1.00 0.00 O ATOM 0 H GLU A 11 16.110 0.460 16.023 1.00 0.00 H new ATOM 0 HA GLU A 11 16.320 1.487 18.721 1.00 0.00 H new ATOM 0 HB2 GLU A 11 17.312 3.017 16.308 1.00 0.00 H new ATOM 0 HB3 GLU A 11 16.596 3.870 17.662 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.287 2.653 19.156 1.00 0.00 H new ATOM 0 HG3 GLU A 11 19.079 2.131 17.682 1.00 0.00 H new ATOM 219 N THR A 12 13.953 1.085 17.164 1.00 0.00 N ATOM 220 CA THR A 12 12.539 1.286 16.877 1.00 0.00 C ATOM 221 C THR A 12 11.730 1.421 18.162 1.00 0.00 C ATOM 222 O THR A 12 12.060 0.839 19.195 1.00 0.00 O ATOM 223 CB THR A 12 11.964 0.127 16.041 1.00 0.00 C ATOM 224 OG1 THR A 12 12.945 -0.906 15.898 1.00 0.00 O ATOM 225 CG2 THR A 12 11.530 0.615 14.667 1.00 0.00 C ATOM 0 H THR A 12 14.244 0.108 17.182 1.00 0.00 H new ATOM 0 HA THR A 12 12.462 2.210 16.304 1.00 0.00 H new ATOM 0 HB THR A 12 11.092 -0.270 16.560 1.00 0.00 H new ATOM 0 HG1 THR A 12 12.498 -1.759 15.719 1.00 0.00 H new ATOM 0 HG21 THR A 12 11.127 -0.221 14.095 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.763 1.381 14.779 1.00 0.00 H new ATOM 0 HG23 THR A 12 12.388 1.034 14.142 1.00 0.00 H new ATOM 233 N PRO A 13 10.643 2.204 18.099 1.00 0.00 N ATOM 234 CA PRO A 13 9.763 2.432 19.249 1.00 0.00 C ATOM 235 C PRO A 13 8.965 1.188 19.623 1.00 0.00 C ATOM 236 O PRO A 13 9.086 0.144 18.983 1.00 0.00 O ATOM 237 CB PRO A 13 8.828 3.542 18.766 1.00 0.00 C ATOM 238 CG PRO A 13 8.817 3.410 17.282 1.00 0.00 C ATOM 239 CD PRO A 13 10.189 2.928 16.900 1.00 0.00 C ATOM 0 HA PRO A 13 10.324 2.690 20.147 1.00 0.00 H new ATOM 0 HB2 PRO A 13 7.827 3.425 19.181 1.00 0.00 H new ATOM 0 HB3 PRO A 13 9.188 4.524 19.073 1.00 0.00 H new ATOM 0 HG2 PRO A 13 8.051 2.705 16.958 1.00 0.00 H new ATOM 0 HG3 PRO A 13 8.592 4.365 16.807 1.00 0.00 H new ATOM 0 HD2 PRO A 13 10.157 2.278 16.026 1.00 0.00 H new ATOM 0 HD3 PRO A 13 10.853 3.757 16.656 1.00 0.00 H new ATOM 247 N GLY A 14 8.147 1.306 20.665 1.00 0.00 N ATOM 248 CA GLY A 14 7.341 0.183 21.106 1.00 0.00 C ATOM 249 C GLY A 14 6.251 0.597 22.075 1.00 0.00 C ATOM 250 O GLY A 14 6.349 0.378 23.283 1.00 0.00 O ATOM 0 H GLY A 14 8.028 2.159 21.211 1.00 0.00 H new ATOM 0 HA2 GLY A 14 6.889 -0.298 20.239 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.984 -0.557 21.582 1.00 0.00 H new ATOM 254 N PRO A 15 5.184 1.212 21.545 1.00 0.00 N ATOM 255 CA PRO A 15 4.051 1.671 22.354 1.00 0.00 C ATOM 256 C PRO A 15 3.230 0.514 22.911 1.00 0.00 C ATOM 257 O PRO A 15 3.100 -0.531 22.274 1.00 0.00 O ATOM 258 CB PRO A 15 3.218 2.491 21.365 1.00 0.00 C ATOM 259 CG PRO A 15 3.561 1.933 20.027 1.00 0.00 C ATOM 260 CD PRO A 15 5.000 1.505 20.113 1.00 0.00 C ATOM 0 HA PRO A 15 4.376 2.235 23.228 1.00 0.00 H new ATOM 0 HB2 PRO A 15 2.152 2.397 21.572 1.00 0.00 H new ATOM 0 HB3 PRO A 15 3.462 3.552 21.426 1.00 0.00 H new ATOM 0 HG2 PRO A 15 2.917 1.089 19.779 1.00 0.00 H new ATOM 0 HG3 PRO A 15 3.422 2.680 19.245 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.196 0.629 19.495 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.674 2.292 19.774 1.00 0.00 H new ATOM 268 N ASP A 16 2.677 0.708 24.104 1.00 0.00 N ATOM 269 CA ASP A 16 1.866 -0.320 24.746 1.00 0.00 C ATOM 270 C ASP A 16 0.381 0.013 24.639 1.00 0.00 C ATOM 271 O ASP A 16 -0.441 -0.522 25.383 1.00 0.00 O ATOM 272 CB ASP A 16 2.263 -0.468 26.216 1.00 0.00 C ATOM 273 CG ASP A 16 3.149 -1.674 26.458 1.00 0.00 C ATOM 274 OD1 ASP A 16 4.341 -1.617 26.091 1.00 0.00 O ATOM 275 OD2 ASP A 16 2.650 -2.675 27.013 1.00 0.00 O ATOM 0 H ASP A 16 2.776 1.567 24.645 1.00 0.00 H new ATOM 0 HA ASP A 16 2.046 -1.264 24.231 1.00 0.00 H new ATOM 0 HB2 ASP A 16 2.784 0.433 26.541 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.363 -0.554 26.825 1.00 0.00 H new ATOM 280 N ARG A 17 0.045 0.901 23.709 1.00 0.00 N ATOM 281 CA ARG A 17 -1.340 1.307 23.506 1.00 0.00 C ATOM 282 C ARG A 17 -1.683 1.347 22.019 1.00 0.00 C ATOM 283 O ARG A 17 -2.372 0.465 21.508 1.00 0.00 O ATOM 284 CB ARG A 17 -1.589 2.680 24.134 1.00 0.00 C ATOM 285 CG ARG A 17 -0.334 3.528 24.262 1.00 0.00 C ATOM 286 CD ARG A 17 -0.661 5.013 24.242 1.00 0.00 C ATOM 287 NE ARG A 17 -1.055 5.504 25.560 1.00 0.00 N ATOM 288 CZ ARG A 17 -1.543 6.720 25.776 1.00 0.00 C ATOM 289 NH1 ARG A 17 -1.697 7.565 24.765 1.00 0.00 N ATOM 290 NH2 ARG A 17 -1.879 7.093 27.004 1.00 0.00 N ATOM 0 H ARG A 17 0.713 1.353 23.084 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.982 0.571 23.990 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.321 3.218 23.532 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -2.028 2.544 25.123 1.00 0.00 H new ATOM 0 HG2 ARG A 17 0.181 3.280 25.190 1.00 0.00 H new ATOM 0 HG3 ARG A 17 0.350 3.294 23.446 1.00 0.00 H new ATOM 0 HD2 ARG A 17 0.208 5.571 23.892 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.466 5.197 23.531 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.949 4.878 26.359 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -1.440 7.281 23.819 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -2.072 8.499 24.933 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.763 6.446 27.783 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.254 8.027 27.169 1.00 0.00 H new ATOM 304 N GLU A 18 -1.197 2.376 21.332 1.00 0.00 N ATOM 305 CA GLU A 18 -1.453 2.531 19.905 1.00 0.00 C ATOM 306 C GLU A 18 -0.960 1.313 19.129 1.00 0.00 C ATOM 307 O GLU A 18 0.211 0.938 19.191 1.00 0.00 O ATOM 308 CB GLU A 18 -0.774 3.796 19.376 1.00 0.00 C ATOM 309 CG GLU A 18 0.711 3.865 19.689 1.00 0.00 C ATOM 310 CD GLU A 18 1.339 5.175 19.254 1.00 0.00 C ATOM 311 OE1 GLU A 18 0.812 5.801 18.310 1.00 0.00 O ATOM 312 OE2 GLU A 18 2.357 5.574 19.857 1.00 0.00 O ATOM 0 H GLU A 18 -0.624 3.114 21.740 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.530 2.620 19.763 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.912 3.848 18.296 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.268 4.669 19.803 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.859 3.734 20.761 1.00 0.00 H new ATOM 0 HG3 GLU A 18 1.222 3.039 19.193 1.00 0.00 H new ATOM 319 N PRO A 19 -1.875 0.679 18.380 1.00 0.00 N ATOM 320 CA PRO A 19 -1.557 -0.506 17.577 1.00 0.00 C ATOM 321 C PRO A 19 -0.666 -0.176 16.385 1.00 0.00 C ATOM 322 O PRO A 19 -0.154 0.938 16.267 1.00 0.00 O ATOM 323 CB PRO A 19 -2.929 -0.990 17.101 1.00 0.00 C ATOM 324 CG PRO A 19 -3.787 0.228 17.117 1.00 0.00 C ATOM 325 CD PRO A 19 -3.289 1.071 18.259 1.00 0.00 C ATOM 0 HA PRO A 19 -1.002 -1.249 18.149 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.872 -1.421 16.101 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.326 -1.763 17.759 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.715 0.768 16.173 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -4.836 -0.035 17.255 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -3.394 2.135 18.049 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -3.842 0.871 19.177 1.00 0.00 H new ATOM 333 N THR A 20 -0.484 -1.152 15.500 1.00 0.00 N ATOM 334 CA THR A 20 0.346 -0.965 14.316 1.00 0.00 C ATOM 335 C THR A 20 -0.073 -1.910 13.197 1.00 0.00 C ATOM 336 O THR A 20 -0.380 -3.077 13.439 1.00 0.00 O ATOM 337 CB THR A 20 1.836 -1.192 14.634 1.00 0.00 C ATOM 338 OG1 THR A 20 2.058 -1.089 16.045 1.00 0.00 O ATOM 339 CG2 THR A 20 2.706 -0.180 13.904 1.00 0.00 C ATOM 0 H THR A 20 -0.900 -2.080 15.581 1.00 0.00 H new ATOM 0 HA THR A 20 0.205 0.065 13.989 1.00 0.00 H new ATOM 0 HB THR A 20 2.108 -2.192 14.296 1.00 0.00 H new ATOM 0 HG1 THR A 20 3.007 -1.236 16.238 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.754 -0.360 14.144 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.558 -0.281 12.829 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.431 0.828 14.215 1.00 0.00 H new ATOM 347 N ASN A 21 -0.082 -1.400 11.970 1.00 0.00 N ATOM 348 CA ASN A 21 -0.463 -2.200 10.811 1.00 0.00 C ATOM 349 C ASN A 21 0.298 -3.522 10.789 1.00 0.00 C ATOM 350 O ASN A 21 -0.276 -4.574 10.514 1.00 0.00 O ATOM 351 CB ASN A 21 -0.198 -1.424 9.520 1.00 0.00 C ATOM 352 CG ASN A 21 -1.478 -1.014 8.818 1.00 0.00 C ATOM 353 OD1 ASN A 21 -2.321 -1.854 8.500 1.00 0.00 O ATOM 354 ND2 ASN A 21 -1.630 0.282 8.572 1.00 0.00 N ATOM 0 H ASN A 21 0.170 -0.436 11.752 1.00 0.00 H new ATOM 0 HA ASN A 21 -1.529 -2.416 10.884 1.00 0.00 H new ATOM 0 HB2 ASN A 21 0.389 -0.534 9.748 1.00 0.00 H new ATOM 0 HB3 ASN A 21 0.402 -2.037 8.847 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -2.471 0.617 8.102 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -0.906 0.943 8.853 1.00 0.00 H new ATOM 361 N GLU A 22 1.593 -3.458 11.081 1.00 0.00 N ATOM 362 CA GLU A 22 2.432 -4.650 11.094 1.00 0.00 C ATOM 363 C GLU A 22 2.072 -5.556 12.268 1.00 0.00 C ATOM 364 O GLU A 22 2.161 -6.781 12.172 1.00 0.00 O ATOM 365 CB GLU A 22 3.910 -4.260 11.171 1.00 0.00 C ATOM 366 CG GLU A 22 4.857 -5.384 10.784 1.00 0.00 C ATOM 367 CD GLU A 22 5.905 -4.944 9.781 1.00 0.00 C ATOM 368 OE1 GLU A 22 6.864 -4.254 10.187 1.00 0.00 O ATOM 369 OE2 GLU A 22 5.766 -5.289 8.589 1.00 0.00 O ATOM 0 H GLU A 22 2.084 -2.594 11.312 1.00 0.00 H new ATOM 0 HA GLU A 22 2.256 -5.197 10.168 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.086 -3.406 10.517 1.00 0.00 H new ATOM 0 HB3 GLU A 22 4.139 -3.936 12.186 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.352 -5.762 11.679 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.282 -6.210 10.365 1.00 0.00 H new ATOM 376 N LEU A 23 1.667 -4.945 13.376 1.00 0.00 N ATOM 377 CA LEU A 23 1.294 -5.695 14.570 1.00 0.00 C ATOM 378 C LEU A 23 0.100 -6.603 14.292 1.00 0.00 C ATOM 379 O LEU A 23 0.158 -7.811 14.524 1.00 0.00 O ATOM 380 CB LEU A 23 0.964 -4.737 15.716 1.00 0.00 C ATOM 381 CG LEU A 23 1.067 -5.318 17.127 1.00 0.00 C ATOM 382 CD1 LEU A 23 2.459 -5.092 17.697 1.00 0.00 C ATOM 383 CD2 LEU A 23 0.011 -4.704 18.035 1.00 0.00 C ATOM 0 H LEU A 23 1.589 -3.933 13.472 1.00 0.00 H new ATOM 0 HA LEU A 23 2.142 -6.317 14.857 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.632 -3.878 15.649 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.050 -4.365 15.571 1.00 0.00 H new ATOM 0 HG LEU A 23 0.890 -6.392 17.071 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.513 -5.512 18.701 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.197 -5.579 17.059 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.666 -4.023 17.739 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.099 -5.129 19.035 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.157 -3.625 18.085 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.981 -4.918 17.636 1.00 0.00 H new ATOM 395 N ARG A 24 -0.981 -6.014 13.792 1.00 0.00 N ATOM 396 CA ARG A 24 -2.189 -6.769 13.481 1.00 0.00 C ATOM 397 C ARG A 24 -1.972 -7.665 12.265 1.00 0.00 C ATOM 398 O ARG A 24 -2.558 -8.741 12.162 1.00 0.00 O ATOM 399 CB ARG A 24 -3.359 -5.818 13.225 1.00 0.00 C ATOM 400 CG ARG A 24 -3.059 -4.748 12.188 1.00 0.00 C ATOM 401 CD ARG A 24 -3.505 -3.373 12.661 1.00 0.00 C ATOM 402 NE ARG A 24 -3.871 -2.503 11.547 1.00 0.00 N ATOM 403 CZ ARG A 24 -4.940 -2.699 10.783 1.00 0.00 C ATOM 404 NH1 ARG A 24 -5.743 -3.729 11.012 1.00 0.00 N ATOM 405 NH2 ARG A 24 -5.208 -1.863 9.788 1.00 0.00 N ATOM 0 H ARG A 24 -1.045 -5.016 13.593 1.00 0.00 H new ATOM 0 HA ARG A 24 -2.424 -7.400 14.338 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -4.222 -6.397 12.897 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.636 -5.336 14.162 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -1.989 -4.733 11.978 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -3.563 -4.994 11.254 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -4.357 -3.479 13.333 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.703 -2.909 13.235 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.274 -1.701 11.344 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -5.541 -4.373 11.776 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.563 -3.877 10.424 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -4.593 -1.069 9.609 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.029 -2.014 9.202 1.00 0.00 H new ATOM 419 N ASN A 25 -1.125 -7.212 11.346 1.00 0.00 N ATOM 420 CA ASN A 25 -0.831 -7.971 10.136 1.00 0.00 C ATOM 421 C ASN A 25 -0.046 -9.237 10.466 1.00 0.00 C ATOM 422 O ASN A 25 -0.364 -10.321 9.977 1.00 0.00 O ATOM 423 CB ASN A 25 -0.041 -7.111 9.148 1.00 0.00 C ATOM 424 CG ASN A 25 0.766 -7.945 8.172 1.00 0.00 C ATOM 425 OD1 ASN A 25 0.303 -8.260 7.076 1.00 0.00 O ATOM 426 ND2 ASN A 25 1.982 -8.306 8.567 1.00 0.00 N ATOM 0 H ASN A 25 -0.630 -6.323 11.416 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.778 -8.260 9.679 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.730 -6.474 8.594 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.630 -6.452 9.700 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.572 -8.867 7.953 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.325 -8.022 9.485 1.00 0.00 H new ATOM 433 N GLU A 26 0.980 -9.091 11.299 1.00 0.00 N ATOM 434 CA GLU A 26 1.810 -10.223 11.693 1.00 0.00 C ATOM 435 C GLU A 26 1.032 -11.183 12.588 1.00 0.00 C ATOM 436 O GLU A 26 1.170 -12.401 12.479 1.00 0.00 O ATOM 437 CB GLU A 26 3.065 -9.734 12.421 1.00 0.00 C ATOM 438 CG GLU A 26 4.234 -9.450 11.493 1.00 0.00 C ATOM 439 CD GLU A 26 5.574 -9.550 12.196 1.00 0.00 C ATOM 440 OE1 GLU A 26 5.757 -8.867 13.225 1.00 0.00 O ATOM 441 OE2 GLU A 26 6.439 -10.312 11.716 1.00 0.00 O ATOM 0 H GLU A 26 1.256 -8.201 11.713 1.00 0.00 H new ATOM 0 HA GLU A 26 2.106 -10.756 10.789 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.823 -8.827 12.975 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.366 -10.484 13.152 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.211 -10.153 10.660 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.123 -8.451 11.070 1.00 0.00 H new ATOM 448 N VAL A 27 0.212 -10.624 13.474 1.00 0.00 N ATOM 449 CA VAL A 27 -0.589 -11.429 14.387 1.00 0.00 C ATOM 450 C VAL A 27 -1.692 -12.172 13.642 1.00 0.00 C ATOM 451 O VAL A 27 -2.037 -13.302 13.989 1.00 0.00 O ATOM 452 CB VAL A 27 -1.225 -10.562 15.490 1.00 0.00 C ATOM 453 CG1 VAL A 27 -2.232 -11.371 16.292 1.00 0.00 C ATOM 454 CG2 VAL A 27 -0.150 -9.984 16.398 1.00 0.00 C ATOM 0 H VAL A 27 0.086 -9.617 13.578 1.00 0.00 H new ATOM 0 HA VAL A 27 0.086 -12.151 14.846 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.754 -9.735 15.017 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.670 -10.741 17.066 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.019 -11.732 15.630 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.730 -12.220 16.756 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.616 -9.374 17.172 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.408 -10.796 16.864 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.530 -9.367 15.810 1.00 0.00 H new ATOM 464 N GLU A 28 -2.242 -11.530 12.616 1.00 0.00 N ATOM 465 CA GLU A 28 -3.307 -12.131 11.821 1.00 0.00 C ATOM 466 C GLU A 28 -2.771 -13.283 10.976 1.00 0.00 C ATOM 467 O GLU A 28 -3.333 -14.378 10.974 1.00 0.00 O ATOM 468 CB GLU A 28 -3.955 -11.080 10.918 1.00 0.00 C ATOM 469 CG GLU A 28 -4.987 -10.220 11.628 1.00 0.00 C ATOM 470 CD GLU A 28 -6.405 -10.709 11.407 1.00 0.00 C ATOM 471 OE1 GLU A 28 -6.901 -10.593 10.267 1.00 0.00 O ATOM 472 OE2 GLU A 28 -7.019 -11.207 12.374 1.00 0.00 O ATOM 0 H GLU A 28 -1.968 -10.594 12.316 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.059 -12.524 12.505 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.177 -10.436 10.509 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -4.430 -11.581 10.075 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.773 -10.210 12.697 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -4.902 -9.192 11.276 1.00 0.00 H new ATOM 479 N GLU A 29 -1.681 -13.027 10.259 1.00 0.00 N ATOM 480 CA GLU A 29 -1.071 -14.042 9.408 1.00 0.00 C ATOM 481 C GLU A 29 -0.507 -15.186 10.246 1.00 0.00 C ATOM 482 O GLU A 29 -0.594 -16.353 9.863 1.00 0.00 O ATOM 483 CB GLU A 29 0.039 -13.424 8.555 1.00 0.00 C ATOM 484 CG GLU A 29 1.124 -12.740 9.371 1.00 0.00 C ATOM 485 CD GLU A 29 2.240 -13.687 9.767 1.00 0.00 C ATOM 486 OE1 GLU A 29 2.158 -14.882 9.412 1.00 0.00 O ATOM 487 OE2 GLU A 29 3.195 -13.234 10.432 1.00 0.00 O ATOM 0 H GLU A 29 -1.203 -12.126 10.251 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.844 -14.442 8.751 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.493 -14.204 7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -0.401 -12.699 7.871 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.541 -11.914 8.795 1.00 0.00 H new ATOM 0 HG3 GLU A 29 0.681 -12.310 10.270 1.00 0.00 H new ATOM 494 N THR A 30 0.072 -14.843 11.392 1.00 0.00 N ATOM 495 CA THR A 30 0.652 -15.839 12.283 1.00 0.00 C ATOM 496 C THR A 30 -0.428 -16.718 12.903 1.00 0.00 C ATOM 497 O THR A 30 -0.275 -17.937 12.991 1.00 0.00 O ATOM 498 CB THR A 30 1.469 -15.178 13.410 1.00 0.00 C ATOM 499 OG1 THR A 30 2.608 -14.507 12.861 1.00 0.00 O ATOM 500 CG2 THR A 30 1.925 -16.213 14.427 1.00 0.00 C ATOM 0 H THR A 30 0.152 -13.882 11.725 1.00 0.00 H new ATOM 0 HA THR A 30 1.316 -16.456 11.677 1.00 0.00 H new ATOM 0 HB THR A 30 0.830 -14.454 13.915 1.00 0.00 H new ATOM 0 HG1 THR A 30 2.318 -13.687 12.410 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.500 -15.723 15.213 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.054 -16.701 14.865 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.548 -16.958 13.933 1.00 0.00 H new ATOM 508 N ILE A 31 -1.520 -16.093 13.330 1.00 0.00 N ATOM 509 CA ILE A 31 -2.627 -16.820 13.940 1.00 0.00 C ATOM 510 C ILE A 31 -3.331 -17.706 12.919 1.00 0.00 C ATOM 511 O ILE A 31 -3.764 -18.815 13.235 1.00 0.00 O ATOM 512 CB ILE A 31 -3.655 -15.858 14.565 1.00 0.00 C ATOM 513 CG1 ILE A 31 -3.102 -15.256 15.858 1.00 0.00 C ATOM 514 CG2 ILE A 31 -4.965 -16.584 14.830 1.00 0.00 C ATOM 515 CD1 ILE A 31 -2.959 -16.260 16.980 1.00 0.00 C ATOM 0 H ILE A 31 -1.662 -15.085 13.265 1.00 0.00 H new ATOM 0 HA ILE A 31 -2.201 -17.444 14.726 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.847 -15.047 13.862 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.128 -14.810 15.654 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.760 -14.450 16.184 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -5.682 -15.892 15.272 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.364 -16.969 13.892 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -4.790 -17.412 15.517 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.562 -15.763 17.865 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.934 -16.688 17.212 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -2.278 -17.054 16.673 1.00 0.00 H new ATOM 527 N THR A 32 -3.442 -17.211 11.690 1.00 0.00 N ATOM 528 CA THR A 32 -4.093 -17.957 10.621 1.00 0.00 C ATOM 529 C THR A 32 -3.242 -19.143 10.180 1.00 0.00 C ATOM 530 O THR A 32 -3.761 -20.224 9.900 1.00 0.00 O ATOM 531 CB THR A 32 -4.375 -17.061 9.400 1.00 0.00 C ATOM 532 OG1 THR A 32 -5.095 -15.892 9.807 1.00 0.00 O ATOM 533 CG2 THR A 32 -5.175 -17.814 8.349 1.00 0.00 C ATOM 0 H THR A 32 -3.089 -16.296 11.411 1.00 0.00 H new ATOM 0 HA THR A 32 -5.039 -18.321 11.022 1.00 0.00 H new ATOM 0 HB THR A 32 -3.420 -16.767 8.965 1.00 0.00 H new ATOM 0 HG1 THR A 32 -4.500 -15.302 10.315 1.00 0.00 H new ATOM 0 HG21 THR A 32 -5.362 -17.161 7.497 1.00 0.00 H new ATOM 0 HG22 THR A 32 -4.612 -18.688 8.020 1.00 0.00 H new ATOM 0 HG23 THR A 32 -6.126 -18.134 8.776 1.00 0.00 H new ATOM 541 N LEU A 33 -1.931 -18.934 10.122 1.00 0.00 N ATOM 542 CA LEU A 33 -1.006 -19.987 9.716 1.00 0.00 C ATOM 543 C LEU A 33 -0.778 -20.979 10.852 1.00 0.00 C ATOM 544 O LEU A 33 -0.625 -22.178 10.620 1.00 0.00 O ATOM 545 CB LEU A 33 0.328 -19.380 9.279 1.00 0.00 C ATOM 546 CG LEU A 33 0.329 -18.662 7.929 1.00 0.00 C ATOM 547 CD1 LEU A 33 1.715 -18.121 7.613 1.00 0.00 C ATOM 548 CD2 LEU A 33 -0.144 -19.598 6.827 1.00 0.00 C ATOM 0 H LEU A 33 -1.485 -18.046 10.351 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.448 -20.521 8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.651 -18.674 10.044 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.073 -20.175 9.245 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.362 -17.821 7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.696 -17.613 6.649 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.016 -17.416 8.388 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.427 -18.945 7.575 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.137 -19.070 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.522 -20.459 6.770 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -1.157 -19.936 7.047 1.00 0.00 H new ATOM 560 N MET A 34 -0.760 -20.472 12.080 1.00 0.00 N ATOM 561 CA MET A 34 -0.554 -21.315 13.252 1.00 0.00 C ATOM 562 C MET A 34 -1.839 -22.046 13.627 1.00 0.00 C ATOM 563 O MET A 34 -1.801 -23.100 14.260 1.00 0.00 O ATOM 564 CB MET A 34 -0.069 -20.473 14.433 1.00 0.00 C ATOM 565 CG MET A 34 -1.186 -19.733 15.151 1.00 0.00 C ATOM 566 SD MET A 34 -1.780 -20.615 16.607 1.00 0.00 S ATOM 567 CE MET A 34 -3.397 -19.874 16.816 1.00 0.00 C ATOM 0 H MET A 34 -0.886 -19.482 12.290 1.00 0.00 H new ATOM 0 HA MET A 34 0.207 -22.056 13.007 1.00 0.00 H new ATOM 0 HB2 MET A 34 0.443 -21.121 15.145 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.664 -19.750 14.076 1.00 0.00 H new ATOM 0 HG2 MET A 34 -0.830 -18.747 15.449 1.00 0.00 H new ATOM 0 HG3 MET A 34 -2.016 -19.578 14.461 1.00 0.00 H new ATOM 0 HE1 MET A 34 -4.038 -20.552 17.379 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.299 -18.934 17.359 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.839 -19.684 15.838 1.00 0.00 H new ATOM 577 N GLU A 35 -2.975 -21.479 13.231 1.00 0.00 N ATOM 578 CA GLU A 35 -4.271 -22.079 13.528 1.00 0.00 C ATOM 579 C GLU A 35 -4.331 -23.519 13.028 1.00 0.00 C ATOM 580 O GLU A 35 -5.127 -24.324 13.514 1.00 0.00 O ATOM 581 CB GLU A 35 -5.394 -21.259 12.891 1.00 0.00 C ATOM 582 CG GLU A 35 -6.747 -21.951 12.924 1.00 0.00 C ATOM 583 CD GLU A 35 -7.158 -22.362 14.325 1.00 0.00 C ATOM 584 OE1 GLU A 35 -6.825 -21.628 15.279 1.00 0.00 O ATOM 585 OE2 GLU A 35 -7.811 -23.416 14.467 1.00 0.00 O ATOM 0 H GLU A 35 -3.024 -20.607 12.705 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.402 -22.083 14.610 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.472 -20.302 13.408 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.132 -21.042 11.856 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -7.502 -21.284 12.509 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.715 -22.834 12.285 1.00 0.00 H new ATOM 592 N LEU A 36 -3.486 -23.837 12.054 1.00 0.00 N ATOM 593 CA LEU A 36 -3.442 -25.180 11.486 1.00 0.00 C ATOM 594 C LEU A 36 -2.355 -26.017 12.151 1.00 0.00 C ATOM 595 O LEU A 36 -1.803 -26.935 11.543 1.00 0.00 O ATOM 596 CB LEU A 36 -3.198 -25.110 9.978 1.00 0.00 C ATOM 597 CG LEU A 36 -4.395 -24.695 9.122 1.00 0.00 C ATOM 598 CD1 LEU A 36 -4.012 -24.657 7.651 1.00 0.00 C ATOM 599 CD2 LEU A 36 -5.564 -25.643 9.346 1.00 0.00 C ATOM 0 H LEU A 36 -2.821 -23.183 11.641 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.405 -25.657 11.670 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -2.385 -24.408 9.794 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.857 -26.088 9.640 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.702 -23.693 9.422 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.877 -24.360 7.057 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.206 -23.938 7.503 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.679 -25.646 7.336 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.407 -25.333 8.729 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.268 -26.656 9.074 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.855 -25.620 10.396 1.00 0.00 H new ATOM 611 N LEU A 37 -2.051 -25.696 13.404 1.00 0.00 N ATOM 612 CA LEU A 37 -1.031 -26.420 14.154 1.00 0.00 C ATOM 613 C LEU A 37 -1.434 -27.877 14.356 1.00 0.00 C ATOM 614 O LEU A 37 -2.613 -28.188 14.527 1.00 0.00 O ATOM 615 CB LEU A 37 -0.795 -25.752 15.510 1.00 0.00 C ATOM 616 CG LEU A 37 0.254 -24.640 15.536 1.00 0.00 C ATOM 617 CD1 LEU A 37 -0.120 -23.577 16.557 1.00 0.00 C ATOM 618 CD2 LEU A 37 1.631 -25.213 15.840 1.00 0.00 C ATOM 0 H LEU A 37 -2.497 -24.939 13.922 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.106 -26.395 13.578 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.742 -25.340 15.859 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.499 -26.520 16.225 1.00 0.00 H new ATOM 0 HG LEU A 37 0.286 -24.173 14.551 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.638 -22.794 16.561 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.086 -23.145 16.296 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.181 -24.029 17.547 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.365 -24.407 15.855 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.614 -25.706 16.812 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.902 -25.937 15.071 1.00 0.00 H new ATOM 630 N LYS A 38 -0.448 -28.767 14.338 1.00 0.00 N ATOM 631 CA LYS A 38 -0.698 -30.192 14.522 1.00 0.00 C ATOM 632 C LYS A 38 -0.183 -30.663 15.878 1.00 0.00 C ATOM 633 O LYS A 38 0.473 -29.912 16.600 1.00 0.00 O ATOM 634 CB LYS A 38 -0.032 -30.997 13.404 1.00 0.00 C ATOM 635 CG LYS A 38 1.384 -30.546 13.090 1.00 0.00 C ATOM 636 CD LYS A 38 2.014 -31.402 12.004 1.00 0.00 C ATOM 637 CE LYS A 38 2.257 -30.601 10.734 1.00 0.00 C ATOM 638 NZ LYS A 38 3.629 -30.025 10.697 1.00 0.00 N ATOM 0 H LYS A 38 0.533 -28.526 14.198 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.775 -30.354 14.485 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.015 -32.050 13.686 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.638 -30.919 12.501 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.373 -29.503 12.772 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.992 -30.597 13.993 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.958 -31.811 12.364 1.00 0.00 H new ATOM 0 HD3 LYS A 38 1.363 -32.248 11.783 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.109 -31.243 9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.524 -29.798 10.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.854 -29.725 9.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.678 -29.204 11.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.315 -30.743 11.005 1.00 0.00 H new ATOM 652 N VAL A 39 -0.484 -31.913 16.219 1.00 0.00 N ATOM 653 CA VAL A 39 -0.049 -32.485 17.487 1.00 0.00 C ATOM 654 C VAL A 39 1.470 -32.444 17.617 1.00 0.00 C ATOM 655 O VAL A 39 2.005 -32.280 18.713 1.00 0.00 O ATOM 656 CB VAL A 39 -0.527 -33.941 17.639 1.00 0.00 C ATOM 657 CG1 VAL A 39 -2.017 -33.985 17.943 1.00 0.00 C ATOM 658 CG2 VAL A 39 -0.207 -34.740 16.385 1.00 0.00 C ATOM 0 H VAL A 39 -1.027 -32.548 15.634 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.494 -31.880 18.276 1.00 0.00 H new ATOM 0 HB VAL A 39 0.004 -34.394 18.476 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.337 -35.022 18.047 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.215 -33.449 18.871 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.569 -33.515 17.129 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.552 -35.767 16.510 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.710 -34.290 15.529 1.00 0.00 H new ATOM 0 HG23 VAL A 39 0.870 -34.737 16.216 1.00 0.00 H new ATOM 668 N SER A 40 2.158 -32.594 16.490 1.00 0.00 N ATOM 669 CA SER A 40 3.616 -32.578 16.477 1.00 0.00 C ATOM 670 C SER A 40 4.148 -31.221 16.930 1.00 0.00 C ATOM 671 O SER A 40 5.005 -31.142 17.810 1.00 0.00 O ATOM 672 CB SER A 40 4.139 -32.901 15.076 1.00 0.00 C ATOM 673 OG SER A 40 3.080 -33.271 14.210 1.00 0.00 O ATOM 0 H SER A 40 1.729 -32.728 15.574 1.00 0.00 H new ATOM 0 HA SER A 40 3.969 -33.339 17.173 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.659 -32.034 14.670 1.00 0.00 H new ATOM 0 HB3 SER A 40 4.866 -33.711 15.133 1.00 0.00 H new ATOM 0 HG SER A 40 3.441 -33.766 13.445 1.00 0.00 H new ATOM 679 N GLU A 41 3.633 -30.157 16.322 1.00 0.00 N ATOM 680 CA GLU A 41 4.057 -28.804 16.662 1.00 0.00 C ATOM 681 C GLU A 41 3.653 -28.450 18.090 1.00 0.00 C ATOM 682 O GLU A 41 4.477 -28.003 18.888 1.00 0.00 O ATOM 683 CB GLU A 41 3.451 -27.795 15.684 1.00 0.00 C ATOM 684 CG GLU A 41 3.589 -28.202 14.226 1.00 0.00 C ATOM 685 CD GLU A 41 4.280 -27.144 13.388 1.00 0.00 C ATOM 686 OE1 GLU A 41 4.136 -25.946 13.711 1.00 0.00 O ATOM 687 OE2 GLU A 41 4.963 -27.513 12.410 1.00 0.00 O ATOM 0 H GLU A 41 2.922 -30.206 15.592 1.00 0.00 H new ATOM 0 HA GLU A 41 5.144 -28.762 16.589 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.394 -27.665 15.918 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.931 -26.827 15.829 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.152 -29.134 14.164 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.600 -28.399 13.812 1.00 0.00 H new ATOM 694 N LEU A 42 2.378 -28.653 18.405 1.00 0.00 N ATOM 695 CA LEU A 42 1.862 -28.355 19.737 1.00 0.00 C ATOM 696 C LEU A 42 2.718 -29.017 20.813 1.00 0.00 C ATOM 697 O LEU A 42 3.057 -28.396 21.820 1.00 0.00 O ATOM 698 CB LEU A 42 0.412 -28.826 19.861 1.00 0.00 C ATOM 699 CG LEU A 42 -0.574 -28.235 18.852 1.00 0.00 C ATOM 700 CD1 LEU A 42 -1.718 -29.204 18.595 1.00 0.00 C ATOM 701 CD2 LEU A 42 -1.105 -26.898 19.346 1.00 0.00 C ATOM 0 H LEU A 42 1.683 -29.023 17.756 1.00 0.00 H new ATOM 0 HA LEU A 42 1.900 -27.275 19.882 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.394 -29.911 19.764 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.059 -28.590 20.865 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.048 -28.069 17.912 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.410 -28.767 17.875 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.321 -30.138 18.197 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.244 -29.402 19.529 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.805 -26.492 18.616 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.616 -27.039 20.299 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.275 -26.203 19.478 1.00 0.00 H new ATOM 713 N LYS A 43 3.065 -30.280 20.591 1.00 0.00 N ATOM 714 CA LYS A 43 3.884 -31.026 21.538 1.00 0.00 C ATOM 715 C LYS A 43 5.275 -30.412 21.657 1.00 0.00 C ATOM 716 O LYS A 43 5.768 -30.176 22.761 1.00 0.00 O ATOM 717 CB LYS A 43 3.997 -32.490 21.104 1.00 0.00 C ATOM 718 CG LYS A 43 4.382 -33.431 22.232 1.00 0.00 C ATOM 719 CD LYS A 43 3.787 -34.814 22.032 1.00 0.00 C ATOM 720 CE LYS A 43 2.408 -34.924 22.664 1.00 0.00 C ATOM 721 NZ LYS A 43 2.402 -35.859 23.824 1.00 0.00 N ATOM 0 H LYS A 43 2.791 -30.809 19.763 1.00 0.00 H new ATOM 0 HA LYS A 43 3.400 -30.978 22.514 1.00 0.00 H new ATOM 0 HB2 LYS A 43 3.043 -32.810 20.684 1.00 0.00 H new ATOM 0 HB3 LYS A 43 4.738 -32.568 20.308 1.00 0.00 H new ATOM 0 HG2 LYS A 43 5.468 -33.506 22.290 1.00 0.00 H new ATOM 0 HG3 LYS A 43 4.040 -33.021 23.182 1.00 0.00 H new ATOM 0 HD2 LYS A 43 3.718 -35.031 20.966 1.00 0.00 H new ATOM 0 HD3 LYS A 43 4.449 -35.563 22.468 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.079 -33.938 22.991 1.00 0.00 H new ATOM 0 HE3 LYS A 43 1.693 -35.268 21.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.444 -35.906 24.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 2.692 -36.806 23.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.066 -35.518 24.548 1.00 0.00 H new ATOM 735 N ASP A 44 5.902 -30.154 20.515 1.00 0.00 N ATOM 736 CA ASP A 44 7.236 -29.564 20.492 1.00 0.00 C ATOM 737 C ASP A 44 7.272 -28.269 21.297 1.00 0.00 C ATOM 738 O ASP A 44 8.160 -28.067 22.126 1.00 0.00 O ATOM 739 CB ASP A 44 7.673 -29.295 19.051 1.00 0.00 C ATOM 740 CG ASP A 44 8.786 -30.220 18.601 1.00 0.00 C ATOM 741 OD1 ASP A 44 9.924 -30.058 19.088 1.00 0.00 O ATOM 742 OD2 ASP A 44 8.520 -31.104 17.760 1.00 0.00 O ATOM 0 H ASP A 44 5.509 -30.344 19.593 1.00 0.00 H new ATOM 0 HA ASP A 44 7.927 -30.273 20.947 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.817 -29.412 18.387 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.006 -28.261 18.963 1.00 0.00 H new ATOM 747 N ILE A 45 6.302 -27.396 21.048 1.00 0.00 N ATOM 748 CA ILE A 45 6.223 -26.121 21.750 1.00 0.00 C ATOM 749 C ILE A 45 6.049 -26.330 23.251 1.00 0.00 C ATOM 750 O ILE A 45 6.803 -25.782 24.056 1.00 0.00 O ATOM 751 CB ILE A 45 5.059 -25.260 21.225 1.00 0.00 C ATOM 752 CG1 ILE A 45 5.292 -24.889 19.759 1.00 0.00 C ATOM 753 CG2 ILE A 45 4.901 -24.008 22.075 1.00 0.00 C ATOM 754 CD1 ILE A 45 4.089 -25.134 18.875 1.00 0.00 C ATOM 0 H ILE A 45 5.560 -27.548 20.365 1.00 0.00 H new ATOM 0 HA ILE A 45 7.162 -25.600 21.564 1.00 0.00 H new ATOM 0 HB ILE A 45 4.138 -25.840 21.292 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.569 -23.836 19.699 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.136 -25.463 19.377 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.074 -23.410 21.691 1.00 0.00 H new ATOM 0 HG22 ILE A 45 4.695 -24.292 23.107 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.820 -23.424 22.036 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.326 -24.849 17.850 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.824 -26.191 18.905 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.248 -24.539 19.232 1.00 0.00 H new ATOM 766 N CYS A 46 5.052 -27.126 23.619 1.00 0.00 N ATOM 767 CA CYS A 46 4.779 -27.409 25.024 1.00 0.00 C ATOM 768 C CYS A 46 6.031 -27.920 25.729 1.00 0.00 C ATOM 769 O CYS A 46 6.259 -27.625 26.903 1.00 0.00 O ATOM 770 CB CYS A 46 3.653 -28.437 25.150 1.00 0.00 C ATOM 771 SG CYS A 46 2.332 -27.950 26.285 1.00 0.00 S ATOM 0 H CYS A 46 4.419 -27.587 22.965 1.00 0.00 H new ATOM 0 HA CYS A 46 4.468 -26.480 25.502 1.00 0.00 H new ATOM 0 HB2 CYS A 46 3.224 -28.612 24.164 1.00 0.00 H new ATOM 0 HB3 CYS A 46 4.076 -29.384 25.486 1.00 0.00 H new ATOM 0 HG CYS A 46 1.794 -26.840 25.874 1.00 0.00 H new ATOM 777 N ARG A 47 6.839 -28.689 25.006 1.00 0.00 N ATOM 778 CA ARG A 47 8.067 -29.244 25.563 1.00 0.00 C ATOM 779 C ARG A 47 9.142 -28.168 25.686 1.00 0.00 C ATOM 780 O ARG A 47 9.716 -27.970 26.757 1.00 0.00 O ATOM 781 CB ARG A 47 8.575 -30.391 24.689 1.00 0.00 C ATOM 782 CG ARG A 47 10.091 -30.474 24.615 1.00 0.00 C ATOM 783 CD ARG A 47 10.546 -31.746 23.916 1.00 0.00 C ATOM 784 NE ARG A 47 9.955 -31.882 22.587 1.00 0.00 N ATOM 785 CZ ARG A 47 10.234 -32.880 21.757 1.00 0.00 C ATOM 786 NH1 ARG A 47 11.091 -33.826 22.116 1.00 0.00 N ATOM 787 NH2 ARG A 47 9.656 -32.934 20.564 1.00 0.00 N ATOM 0 H ARG A 47 6.665 -28.942 24.033 1.00 0.00 H new ATOM 0 HA ARG A 47 7.845 -29.627 26.559 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.186 -31.332 25.077 1.00 0.00 H new ATOM 0 HB3 ARG A 47 8.176 -30.273 23.681 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.478 -29.606 24.082 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.508 -30.442 25.622 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.633 -31.744 23.831 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.275 -32.610 24.523 1.00 0.00 H new ATOM 0 HE ARG A 47 9.291 -31.171 22.280 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.538 -33.788 23.032 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.303 -34.591 21.476 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.996 -32.208 20.284 1.00 0.00 H new ATOM 0 HH22 ARG A 47 9.871 -33.701 19.927 1.00 0.00 H new ATOM 801 N SER A 48 9.410 -27.478 24.583 1.00 0.00 N ATOM 802 CA SER A 48 10.420 -26.426 24.565 1.00 0.00 C ATOM 803 C SER A 48 10.121 -25.369 25.624 1.00 0.00 C ATOM 804 O SER A 48 10.990 -25.003 26.416 1.00 0.00 O ATOM 805 CB SER A 48 10.485 -25.775 23.182 1.00 0.00 C ATOM 806 OG SER A 48 11.376 -24.673 23.179 1.00 0.00 O ATOM 0 H SER A 48 8.942 -27.628 23.689 1.00 0.00 H new ATOM 0 HA SER A 48 11.385 -26.879 24.790 1.00 0.00 H new ATOM 0 HB2 SER A 48 10.808 -26.510 22.445 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.490 -25.443 22.886 1.00 0.00 H new ATOM 0 HG SER A 48 11.401 -24.275 22.284 1.00 0.00 H new ATOM 812 N VAL A 49 8.884 -24.881 25.632 1.00 0.00 N ATOM 813 CA VAL A 49 8.469 -23.867 26.593 1.00 0.00 C ATOM 814 C VAL A 49 8.283 -24.468 27.982 1.00 0.00 C ATOM 815 O VAL A 49 8.057 -23.751 28.955 1.00 0.00 O ATOM 816 CB VAL A 49 7.156 -23.188 26.160 1.00 0.00 C ATOM 817 CG1 VAL A 49 6.887 -21.954 27.009 1.00 0.00 C ATOM 818 CG2 VAL A 49 7.204 -22.829 24.683 1.00 0.00 C ATOM 0 H VAL A 49 8.152 -25.172 24.984 1.00 0.00 H new ATOM 0 HA VAL A 49 9.262 -23.120 26.627 1.00 0.00 H new ATOM 0 HB VAL A 49 6.337 -23.890 26.313 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.955 -21.488 26.688 1.00 0.00 H new ATOM 0 HG12 VAL A 49 6.806 -22.244 28.057 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.707 -21.245 26.891 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.268 -22.350 24.394 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.033 -22.145 24.502 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.345 -23.734 24.093 1.00 0.00 H new ATOM 828 N SER A 50 8.381 -25.792 28.065 1.00 0.00 N ATOM 829 CA SER A 50 8.221 -26.491 29.334 1.00 0.00 C ATOM 830 C SER A 50 6.800 -26.334 29.866 1.00 0.00 C ATOM 831 O SER A 50 6.530 -26.595 31.039 1.00 0.00 O ATOM 832 CB SER A 50 9.223 -25.963 30.362 1.00 0.00 C ATOM 833 OG SER A 50 10.458 -25.635 29.749 1.00 0.00 O ATOM 0 H SER A 50 8.570 -26.401 27.269 1.00 0.00 H new ATOM 0 HA SER A 50 8.411 -27.550 29.162 1.00 0.00 H new ATOM 0 HB2 SER A 50 8.813 -25.082 30.855 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.385 -26.714 31.135 1.00 0.00 H new ATOM 0 HG SER A 50 11.080 -25.298 30.427 1.00 0.00 H new ATOM 839 N PHE A 51 5.893 -25.905 28.994 1.00 0.00 N ATOM 840 CA PHE A 51 4.498 -25.711 29.374 1.00 0.00 C ATOM 841 C PHE A 51 3.820 -27.049 29.654 1.00 0.00 C ATOM 842 O PHE A 51 4.278 -28.108 29.224 1.00 0.00 O ATOM 843 CB PHE A 51 3.746 -24.965 28.271 1.00 0.00 C ATOM 844 CG PHE A 51 3.424 -23.541 28.622 1.00 0.00 C ATOM 845 CD1 PHE A 51 4.368 -22.735 29.236 1.00 0.00 C ATOM 846 CD2 PHE A 51 2.177 -23.008 28.336 1.00 0.00 C ATOM 847 CE1 PHE A 51 4.074 -21.424 29.561 1.00 0.00 C ATOM 848 CE2 PHE A 51 1.877 -21.697 28.658 1.00 0.00 C ATOM 849 CZ PHE A 51 2.828 -20.904 29.271 1.00 0.00 C ATOM 0 H PHE A 51 6.099 -25.685 28.020 1.00 0.00 H new ATOM 0 HA PHE A 51 4.475 -25.115 30.286 1.00 0.00 H new ATOM 0 HB2 PHE A 51 4.345 -24.980 27.360 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.819 -25.495 28.052 1.00 0.00 H new ATOM 0 HD1 PHE A 51 5.345 -23.135 29.463 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.431 -23.624 27.856 1.00 0.00 H new ATOM 0 HE1 PHE A 51 4.819 -20.807 30.042 1.00 0.00 H new ATOM 0 HE2 PHE A 51 0.901 -21.294 28.431 1.00 0.00 H new ATOM 0 HZ PHE A 51 2.597 -19.879 29.523 1.00 0.00 H new ATOM 859 N PRO A 52 2.701 -27.001 30.392 1.00 0.00 N ATOM 860 CA PRO A 52 1.935 -28.200 30.746 1.00 0.00 C ATOM 861 C PRO A 52 1.231 -28.815 29.541 1.00 0.00 C ATOM 862 O PRO A 52 0.256 -28.262 29.030 1.00 0.00 O ATOM 863 CB PRO A 52 0.909 -27.680 31.757 1.00 0.00 C ATOM 864 CG PRO A 52 0.753 -26.235 31.428 1.00 0.00 C ATOM 865 CD PRO A 52 2.097 -25.774 30.937 1.00 0.00 C ATOM 0 HA PRO A 52 2.575 -28.992 31.136 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.039 -28.211 31.668 1.00 0.00 H new ATOM 0 HB3 PRO A 52 1.257 -27.818 32.781 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.012 -26.089 30.665 1.00 0.00 H new ATOM 0 HG3 PRO A 52 0.442 -25.667 32.305 1.00 0.00 H new ATOM 0 HD2 PRO A 52 2.003 -25.000 30.175 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.698 -25.355 31.744 1.00 0.00 H new ATOM 873 N VAL A 53 1.730 -29.962 29.092 1.00 0.00 N ATOM 874 CA VAL A 53 1.147 -30.653 27.948 1.00 0.00 C ATOM 875 C VAL A 53 0.155 -31.720 28.397 1.00 0.00 C ATOM 876 O VAL A 53 -0.107 -32.682 27.675 1.00 0.00 O ATOM 877 CB VAL A 53 2.234 -31.312 27.077 1.00 0.00 C ATOM 878 CG1 VAL A 53 2.785 -32.554 27.760 1.00 0.00 C ATOM 879 CG2 VAL A 53 1.681 -31.650 25.701 1.00 0.00 C ATOM 0 H VAL A 53 2.536 -30.432 29.503 1.00 0.00 H new ATOM 0 HA VAL A 53 0.624 -29.901 27.357 1.00 0.00 H new ATOM 0 HB VAL A 53 3.053 -30.604 26.950 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.551 -33.006 27.130 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.221 -32.278 28.720 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.978 -33.269 27.920 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.462 -32.115 25.099 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.844 -32.340 25.805 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.340 -30.738 25.212 1.00 0.00 H new ATOM 889 N SER A 54 -0.394 -31.543 29.594 1.00 0.00 N ATOM 890 CA SER A 54 -1.355 -32.492 30.142 1.00 0.00 C ATOM 891 C SER A 54 -2.724 -32.316 29.491 1.00 0.00 C ATOM 892 O SER A 54 -3.619 -33.141 29.669 1.00 0.00 O ATOM 893 CB SER A 54 -1.472 -32.316 31.657 1.00 0.00 C ATOM 894 OG SER A 54 -0.556 -33.154 32.340 1.00 0.00 O ATOM 0 H SER A 54 -0.190 -30.751 30.203 1.00 0.00 H new ATOM 0 HA SER A 54 -0.996 -33.499 29.927 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.284 -31.275 31.921 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.488 -32.547 31.976 1.00 0.00 H new ATOM 0 HG SER A 54 -0.649 -33.022 33.306 1.00 0.00 H new ATOM 900 N GLY A 55 -2.878 -31.233 28.736 1.00 0.00 N ATOM 901 CA GLY A 55 -4.140 -30.966 28.070 1.00 0.00 C ATOM 902 C GLY A 55 -4.243 -31.659 26.725 1.00 0.00 C ATOM 903 O GLY A 55 -3.918 -32.840 26.601 1.00 0.00 O ATOM 0 H GLY A 55 -2.152 -30.536 28.573 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.961 -31.294 28.708 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.254 -29.891 27.931 1.00 0.00 H new ATOM 907 N ARG A 56 -4.698 -30.923 25.716 1.00 0.00 N ATOM 908 CA ARG A 56 -4.846 -31.475 24.375 1.00 0.00 C ATOM 909 C ARG A 56 -4.472 -30.440 23.317 1.00 0.00 C ATOM 910 O ARG A 56 -4.195 -29.284 23.635 1.00 0.00 O ATOM 911 CB ARG A 56 -6.282 -31.952 24.152 1.00 0.00 C ATOM 912 CG ARG A 56 -7.302 -30.825 24.133 1.00 0.00 C ATOM 913 CD ARG A 56 -8.640 -31.293 23.582 1.00 0.00 C ATOM 914 NE ARG A 56 -9.295 -32.246 24.474 1.00 0.00 N ATOM 915 CZ ARG A 56 -9.963 -31.891 25.566 1.00 0.00 C ATOM 916 NH1 ARG A 56 -10.063 -30.611 25.899 1.00 0.00 N ATOM 917 NH2 ARG A 56 -10.532 -32.816 26.327 1.00 0.00 N ATOM 0 H ARG A 56 -4.970 -29.944 25.802 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.170 -32.325 24.282 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -6.334 -32.493 23.207 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.548 -32.658 24.939 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.438 -30.439 25.143 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.925 -30.002 23.526 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.291 -30.432 23.430 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.489 -31.754 22.606 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.236 -33.238 24.246 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.626 -29.897 25.316 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.576 -30.341 26.738 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.457 -33.801 26.074 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.045 -32.542 27.165 1.00 0.00 H new ATOM 931 N LYS A 57 -4.466 -30.865 22.058 1.00 0.00 N ATOM 932 CA LYS A 57 -4.128 -29.977 20.952 1.00 0.00 C ATOM 933 C LYS A 57 -4.950 -28.693 21.014 1.00 0.00 C ATOM 934 O LYS A 57 -4.451 -27.610 20.712 1.00 0.00 O ATOM 935 CB LYS A 57 -4.362 -30.682 19.614 1.00 0.00 C ATOM 936 CG LYS A 57 -5.766 -31.240 19.459 1.00 0.00 C ATOM 937 CD LYS A 57 -5.830 -32.293 18.365 1.00 0.00 C ATOM 938 CE LYS A 57 -5.547 -33.683 18.913 1.00 0.00 C ATOM 939 NZ LYS A 57 -5.484 -34.704 17.830 1.00 0.00 N ATOM 0 H LYS A 57 -4.692 -31.820 21.778 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.073 -29.716 21.038 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.168 -29.979 18.804 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.643 -31.495 19.510 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.092 -31.675 20.404 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.457 -30.430 19.226 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.816 -32.277 17.901 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.107 -32.054 17.585 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -4.603 -33.673 19.458 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -6.324 -33.957 19.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -5.289 -35.638 18.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -6.393 -34.732 17.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -4.725 -34.456 17.163 1.00 0.00 H new ATOM 953 N ALA A 58 -6.213 -28.824 21.408 1.00 0.00 N ATOM 954 CA ALA A 58 -7.103 -27.674 21.512 1.00 0.00 C ATOM 955 C ALA A 58 -6.635 -26.714 22.601 1.00 0.00 C ATOM 956 O ALA A 58 -6.662 -25.496 22.423 1.00 0.00 O ATOM 957 CB ALA A 58 -8.527 -28.132 21.787 1.00 0.00 C ATOM 0 H ALA A 58 -6.642 -29.714 21.660 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.081 -27.142 20.561 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.181 -27.263 21.862 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -8.867 -28.772 20.973 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.555 -28.690 22.723 1.00 0.00 H new ATOM 963 N VAL A 59 -6.206 -27.271 23.729 1.00 0.00 N ATOM 964 CA VAL A 59 -5.731 -26.464 24.847 1.00 0.00 C ATOM 965 C VAL A 59 -4.472 -25.690 24.471 1.00 0.00 C ATOM 966 O VAL A 59 -4.371 -24.488 24.720 1.00 0.00 O ATOM 967 CB VAL A 59 -5.435 -27.335 26.082 1.00 0.00 C ATOM 968 CG1 VAL A 59 -4.888 -26.484 27.218 1.00 0.00 C ATOM 969 CG2 VAL A 59 -6.687 -28.081 26.520 1.00 0.00 C ATOM 0 H VAL A 59 -6.178 -28.277 23.893 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.527 -25.761 25.090 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.676 -28.070 25.813 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -4.685 -27.117 28.082 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.965 -26.000 26.898 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.621 -25.724 27.489 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.460 -28.692 27.394 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -7.468 -27.364 26.772 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -7.031 -28.723 25.709 1.00 0.00 H new ATOM 979 N LEU A 60 -3.514 -26.387 23.870 1.00 0.00 N ATOM 980 CA LEU A 60 -2.260 -25.766 23.459 1.00 0.00 C ATOM 981 C LEU A 60 -2.510 -24.657 22.441 1.00 0.00 C ATOM 982 O LEU A 60 -2.091 -23.516 22.638 1.00 0.00 O ATOM 983 CB LEU A 60 -1.319 -26.816 22.865 1.00 0.00 C ATOM 984 CG LEU A 60 -0.081 -27.154 23.697 1.00 0.00 C ATOM 985 CD1 LEU A 60 0.052 -28.660 23.867 1.00 0.00 C ATOM 986 CD2 LEU A 60 1.170 -26.577 23.052 1.00 0.00 C ATOM 0 H LEU A 60 -3.582 -27.382 23.657 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.794 -25.327 24.341 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -1.886 -27.733 22.704 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.990 -26.468 21.886 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.197 -26.705 24.684 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.938 -28.882 24.461 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.832 -29.048 24.374 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.145 -29.130 22.888 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.041 -26.828 23.658 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.291 -26.996 22.053 1.00 0.00 H new ATOM 0 HD23 LEU A 60 1.077 -25.493 22.982 1.00 0.00 H new ATOM 998 N GLN A 61 -3.195 -25.000 21.356 1.00 0.00 N ATOM 999 CA GLN A 61 -3.502 -24.033 20.309 1.00 0.00 C ATOM 1000 C GLN A 61 -4.310 -22.866 20.866 1.00 0.00 C ATOM 1001 O GLN A 61 -4.172 -21.730 20.412 1.00 0.00 O ATOM 1002 CB GLN A 61 -4.274 -24.707 19.173 1.00 0.00 C ATOM 1003 CG GLN A 61 -5.728 -24.994 19.511 1.00 0.00 C ATOM 1004 CD GLN A 61 -6.507 -25.532 18.328 1.00 0.00 C ATOM 1005 OE1 GLN A 61 -6.947 -26.682 18.331 1.00 0.00 O ATOM 1006 NE2 GLN A 61 -6.682 -24.702 17.307 1.00 0.00 N ATOM 0 H GLN A 61 -3.548 -25.940 21.179 1.00 0.00 H new ATOM 0 HA GLN A 61 -2.560 -23.646 19.919 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -4.234 -24.070 18.290 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -3.779 -25.643 18.913 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -5.772 -25.714 20.328 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -6.202 -24.079 19.867 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -6.300 -23.757 17.347 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -7.198 -25.009 16.483 1.00 0.00 H new ATOM 1015 N ASP A 62 -5.154 -23.153 21.851 1.00 0.00 N ATOM 1016 CA ASP A 62 -5.984 -22.127 22.471 1.00 0.00 C ATOM 1017 C ASP A 62 -5.133 -21.158 23.285 1.00 0.00 C ATOM 1018 O ASP A 62 -5.375 -19.951 23.285 1.00 0.00 O ATOM 1019 CB ASP A 62 -7.044 -22.771 23.366 1.00 0.00 C ATOM 1020 CG ASP A 62 -8.294 -23.155 22.599 1.00 0.00 C ATOM 1021 OD1 ASP A 62 -8.627 -22.455 21.620 1.00 0.00 O ATOM 1022 OD2 ASP A 62 -8.940 -24.154 22.978 1.00 0.00 O ATOM 0 H ASP A 62 -5.281 -24.088 22.237 1.00 0.00 H new ATOM 0 HA ASP A 62 -6.480 -21.568 21.678 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.625 -23.659 23.840 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.310 -22.079 24.165 1.00 0.00 H new ATOM 1027 N LEU A 63 -4.136 -21.695 23.980 1.00 0.00 N ATOM 1028 CA LEU A 63 -3.248 -20.878 24.801 1.00 0.00 C ATOM 1029 C LEU A 63 -2.406 -19.948 23.933 1.00 0.00 C ATOM 1030 O LEU A 63 -2.333 -18.745 24.185 1.00 0.00 O ATOM 1031 CB LEU A 63 -2.337 -21.771 25.645 1.00 0.00 C ATOM 1032 CG LEU A 63 -2.949 -22.333 26.928 1.00 0.00 C ATOM 1033 CD1 LEU A 63 -1.956 -23.237 27.642 1.00 0.00 C ATOM 1034 CD2 LEU A 63 -3.399 -21.204 27.843 1.00 0.00 C ATOM 0 H LEU A 63 -3.922 -22.692 23.992 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.863 -20.268 25.463 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.007 -22.606 25.027 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.447 -21.200 25.910 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.823 -22.927 26.661 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.409 -23.628 28.553 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.683 -24.065 26.988 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.063 -22.667 27.897 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.832 -21.623 28.751 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.542 -20.583 28.103 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.146 -20.597 27.331 1.00 0.00 H new ATOM 1046 N ILE A 64 -1.775 -20.513 22.909 1.00 0.00 N ATOM 1047 CA ILE A 64 -0.941 -19.734 22.002 1.00 0.00 C ATOM 1048 C ILE A 64 -1.769 -18.700 21.247 1.00 0.00 C ATOM 1049 O ILE A 64 -1.387 -17.533 21.151 1.00 0.00 O ATOM 1050 CB ILE A 64 -0.218 -20.638 20.986 1.00 0.00 C ATOM 1051 CG1 ILE A 64 0.653 -21.664 21.713 1.00 0.00 C ATOM 1052 CG2 ILE A 64 0.623 -19.798 20.036 1.00 0.00 C ATOM 1053 CD1 ILE A 64 1.663 -21.042 22.652 1.00 0.00 C ATOM 0 H ILE A 64 -1.825 -21.507 22.687 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.198 -19.224 22.615 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.965 -21.174 20.401 1.00 0.00 H new ATOM 0 HG12 ILE A 64 0.010 -22.338 22.279 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.180 -22.269 20.975 1.00 0.00 H new ATOM 0 HG21 ILE A 64 1.128 -20.450 19.324 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.021 -19.103 19.498 1.00 0.00 H new ATOM 0 HG23 ILE A 64 1.365 -19.238 20.605 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.245 -21.828 23.133 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.330 -20.389 22.089 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.143 -20.460 23.412 1.00 0.00 H new ATOM 1065 N ARG A 65 -2.906 -19.135 20.713 1.00 0.00 N ATOM 1066 CA ARG A 65 -3.788 -18.246 19.967 1.00 0.00 C ATOM 1067 C ARG A 65 -4.226 -17.065 20.828 1.00 0.00 C ATOM 1068 O ARG A 65 -4.152 -15.913 20.402 1.00 0.00 O ATOM 1069 CB ARG A 65 -5.017 -19.011 19.471 1.00 0.00 C ATOM 1070 CG ARG A 65 -5.808 -18.269 18.407 1.00 0.00 C ATOM 1071 CD ARG A 65 -7.297 -18.267 18.720 1.00 0.00 C ATOM 1072 NE ARG A 65 -7.958 -19.479 18.243 1.00 0.00 N ATOM 1073 CZ ARG A 65 -9.277 -19.630 18.205 1.00 0.00 C ATOM 1074 NH1 ARG A 65 -10.072 -18.650 18.614 1.00 0.00 N ATOM 1075 NH2 ARG A 65 -9.804 -20.763 17.758 1.00 0.00 N ATOM 0 H ARG A 65 -3.238 -20.097 20.783 1.00 0.00 H new ATOM 0 HA ARG A 65 -3.235 -17.863 19.109 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.698 -19.973 19.070 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.671 -19.220 20.318 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -5.449 -17.242 18.335 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -5.640 -18.735 17.436 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.441 -18.175 19.797 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -7.763 -17.395 18.261 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.375 -20.252 17.922 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -9.671 -17.778 18.959 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -11.085 -18.769 18.584 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.196 -21.519 17.443 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.817 -20.878 17.729 1.00 0.00 H new ATOM 1089 N ASN A 66 -4.682 -17.360 22.041 1.00 0.00 N ATOM 1090 CA ASN A 66 -5.132 -16.322 22.961 1.00 0.00 C ATOM 1091 C ASN A 66 -3.978 -15.403 23.351 1.00 0.00 C ATOM 1092 O ASN A 66 -4.163 -14.198 23.528 1.00 0.00 O ATOM 1093 CB ASN A 66 -5.741 -16.953 24.215 1.00 0.00 C ATOM 1094 CG ASN A 66 -7.123 -17.523 23.962 1.00 0.00 C ATOM 1095 OD1 ASN A 66 -7.400 -18.677 24.290 1.00 0.00 O ATOM 1096 ND2 ASN A 66 -7.999 -16.714 23.377 1.00 0.00 N ATOM 0 H ASN A 66 -4.750 -18.309 22.409 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.892 -15.727 22.455 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.085 -17.745 24.575 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.799 -16.203 25.004 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -8.945 -17.042 23.182 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -7.726 -15.765 23.122 1.00 0.00 H new ATOM 1103 N PHE A 67 -2.788 -15.978 23.481 1.00 0.00 N ATOM 1104 CA PHE A 67 -1.604 -15.211 23.850 1.00 0.00 C ATOM 1105 C PHE A 67 -1.295 -14.150 22.798 1.00 0.00 C ATOM 1106 O PHE A 67 -1.088 -12.979 23.122 1.00 0.00 O ATOM 1107 CB PHE A 67 -0.400 -16.141 24.021 1.00 0.00 C ATOM 1108 CG PHE A 67 -0.188 -16.590 25.438 1.00 0.00 C ATOM 1109 CD1 PHE A 67 -1.259 -16.986 26.222 1.00 0.00 C ATOM 1110 CD2 PHE A 67 1.085 -16.617 25.987 1.00 0.00 C ATOM 1111 CE1 PHE A 67 -1.067 -17.401 27.526 1.00 0.00 C ATOM 1112 CE2 PHE A 67 1.283 -17.031 27.290 1.00 0.00 C ATOM 1113 CZ PHE A 67 0.206 -17.422 28.062 1.00 0.00 C ATOM 0 H PHE A 67 -2.617 -16.973 23.336 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.806 -14.711 24.798 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -0.534 -17.017 23.387 1.00 0.00 H new ATOM 0 HB3 PHE A 67 0.497 -15.629 23.672 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -2.257 -16.970 25.809 1.00 0.00 H new ATOM 0 HD2 PHE A 67 1.931 -16.311 25.389 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -1.911 -17.709 28.125 1.00 0.00 H new ATOM 0 HE2 PHE A 67 2.280 -17.049 27.705 1.00 0.00 H new ATOM 0 HZ PHE A 67 0.359 -17.743 29.082 1.00 0.00 H new ATOM 1123 N LEU A 68 -1.265 -14.566 21.537 1.00 0.00 N ATOM 1124 CA LEU A 68 -0.980 -13.652 20.436 1.00 0.00 C ATOM 1125 C LEU A 68 -2.132 -12.674 20.229 1.00 0.00 C ATOM 1126 O LEU A 68 -1.915 -11.505 19.911 1.00 0.00 O ATOM 1127 CB LEU A 68 -0.727 -14.438 19.148 1.00 0.00 C ATOM 1128 CG LEU A 68 0.617 -14.186 18.463 1.00 0.00 C ATOM 1129 CD1 LEU A 68 0.737 -15.024 17.199 1.00 0.00 C ATOM 1130 CD2 LEU A 68 0.785 -12.708 18.142 1.00 0.00 C ATOM 0 H LEU A 68 -1.435 -15.530 21.251 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.085 -13.084 20.690 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.804 -15.502 19.374 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.523 -14.204 18.441 1.00 0.00 H new ATOM 0 HG LEU A 68 1.412 -14.481 19.148 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.699 -14.832 16.725 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.663 -16.081 17.455 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.066 -14.761 16.510 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.747 -12.548 17.655 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.016 -12.387 17.476 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.745 -12.128 19.064 1.00 0.00 H new ATOM 1142 N GLN A 69 -3.355 -13.159 20.415 1.00 0.00 N ATOM 1143 CA GLN A 69 -4.541 -12.326 20.251 1.00 0.00 C ATOM 1144 C GLN A 69 -4.625 -11.276 21.354 1.00 0.00 C ATOM 1145 O GLN A 69 -5.046 -10.145 21.116 1.00 0.00 O ATOM 1146 CB GLN A 69 -5.802 -13.191 20.256 1.00 0.00 C ATOM 1147 CG GLN A 69 -6.265 -13.599 18.866 1.00 0.00 C ATOM 1148 CD GLN A 69 -6.597 -12.409 17.988 1.00 0.00 C ATOM 1149 OE1 GLN A 69 -7.266 -11.470 18.421 1.00 0.00 O ATOM 1150 NE2 GLN A 69 -6.128 -12.440 16.746 1.00 0.00 N ATOM 0 H GLN A 69 -3.551 -14.124 20.679 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.465 -11.813 19.292 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.615 -14.088 20.846 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.605 -12.646 20.752 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -5.486 -14.192 18.387 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -7.144 -14.238 18.953 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -5.578 -13.238 16.428 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -6.318 -11.666 16.110 1.00 0.00 H new ATOM 1159 N ASN A 70 -4.223 -11.660 22.561 1.00 0.00 N ATOM 1160 CA ASN A 70 -4.254 -10.751 23.702 1.00 0.00 C ATOM 1161 C ASN A 70 -2.979 -9.917 23.768 1.00 0.00 C ATOM 1162 O ASN A 70 -2.936 -8.882 24.432 1.00 0.00 O ATOM 1163 CB ASN A 70 -4.432 -11.537 25.002 1.00 0.00 C ATOM 1164 CG ASN A 70 -5.873 -11.945 25.240 1.00 0.00 C ATOM 1165 OD1 ASN A 70 -6.731 -11.104 25.506 1.00 0.00 O ATOM 1166 ND2 ASN A 70 -6.144 -13.241 25.144 1.00 0.00 N ATOM 0 H ASN A 70 -3.872 -12.594 22.775 1.00 0.00 H new ATOM 0 HA ASN A 70 -5.101 -10.077 23.575 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -3.805 -12.428 24.973 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.086 -10.931 25.840 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -7.096 -13.575 25.293 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -5.400 -13.902 24.921 1.00 0.00 H new ATOM 1173 N ALA A 71 -1.942 -10.376 23.075 1.00 0.00 N ATOM 1174 CA ALA A 71 -0.666 -9.671 23.053 1.00 0.00 C ATOM 1175 C ALA A 71 -0.835 -8.244 22.542 1.00 0.00 C ATOM 1176 O ALA A 71 0.013 -7.384 22.780 1.00 0.00 O ATOM 1177 CB ALA A 71 0.339 -10.425 22.194 1.00 0.00 C ATOM 0 H ALA A 71 -1.960 -11.233 22.522 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.290 -9.621 24.075 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.287 -9.887 22.187 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.491 -11.423 22.604 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.041 -10.505 21.175 1.00 0.00 H new ATOM 1183 N LEU A 72 -1.935 -8.000 21.838 1.00 0.00 N ATOM 1184 CA LEU A 72 -2.215 -6.676 21.292 1.00 0.00 C ATOM 1185 C LEU A 72 -3.304 -5.974 22.099 1.00 0.00 C ATOM 1186 O LEU A 72 -4.215 -5.369 21.535 1.00 0.00 O ATOM 1187 CB LEU A 72 -2.641 -6.787 19.827 1.00 0.00 C ATOM 1188 CG LEU A 72 -2.207 -8.057 19.096 1.00 0.00 C ATOM 1189 CD1 LEU A 72 -2.854 -8.130 17.722 1.00 0.00 C ATOM 1190 CD2 LEU A 72 -0.691 -8.113 18.978 1.00 0.00 C ATOM 0 H LEU A 72 -2.647 -8.701 21.632 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.303 -6.083 21.355 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -3.728 -6.718 19.779 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.243 -5.927 19.288 1.00 0.00 H new ATOM 0 HG LEU A 72 -2.538 -8.918 19.676 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.533 -9.041 17.217 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.939 -8.138 17.831 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.555 -7.263 17.132 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.400 -9.024 18.455 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.337 -7.246 18.421 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.248 -8.109 19.974 1.00 0.00 H new ATOM 1202 N VAL A 73 -3.200 -6.058 23.421 1.00 0.00 N ATOM 1203 CA VAL A 73 -4.173 -5.428 24.306 1.00 0.00 C ATOM 1204 C VAL A 73 -3.732 -4.022 24.695 1.00 0.00 C ATOM 1205 O VAL A 73 -2.607 -3.816 25.151 1.00 0.00 O ATOM 1206 CB VAL A 73 -4.390 -6.259 25.585 1.00 0.00 C ATOM 1207 CG1 VAL A 73 -4.992 -5.399 26.685 1.00 0.00 C ATOM 1208 CG2 VAL A 73 -5.272 -7.463 25.294 1.00 0.00 C ATOM 0 H VAL A 73 -2.452 -6.556 23.903 1.00 0.00 H new ATOM 0 HA VAL A 73 -5.112 -5.372 23.755 1.00 0.00 H new ATOM 0 HB VAL A 73 -3.422 -6.622 25.931 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -5.138 -6.003 27.580 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -4.318 -4.573 26.911 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.952 -5.004 26.353 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.415 -8.039 26.208 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.240 -7.124 24.924 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.795 -8.090 24.541 1.00 0.00 H new ATOM 1218 N VAL A 74 -4.627 -3.055 24.512 1.00 0.00 N ATOM 1219 CA VAL A 74 -4.331 -1.667 24.846 1.00 0.00 C ATOM 1220 C VAL A 74 -3.887 -1.534 26.298 1.00 0.00 C ATOM 1221 O VAL A 74 -4.398 -2.223 27.180 1.00 0.00 O ATOM 1222 CB VAL A 74 -5.553 -0.761 24.609 1.00 0.00 C ATOM 1223 CG1 VAL A 74 -5.189 0.698 24.842 1.00 0.00 C ATOM 1224 CG2 VAL A 74 -6.102 -0.964 23.205 1.00 0.00 C ATOM 0 H VAL A 74 -5.562 -3.208 24.135 1.00 0.00 H new ATOM 0 HA VAL A 74 -3.520 -1.349 24.191 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.331 -1.035 25.322 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -6.065 1.323 24.670 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.846 0.828 25.869 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -4.395 0.989 24.155 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.965 -0.316 23.055 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.332 -0.718 22.474 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.403 -2.004 23.079 1.00 0.00 H new ATOM 1234 N GLY A 75 -2.932 -0.641 26.540 1.00 0.00 N ATOM 1235 CA GLY A 75 -2.435 -0.432 27.887 1.00 0.00 C ATOM 1236 C GLY A 75 -2.013 -1.725 28.556 1.00 0.00 C ATOM 1237 O GLY A 75 -2.073 -1.849 29.780 1.00 0.00 O ATOM 0 H GLY A 75 -2.494 -0.058 25.827 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.586 0.251 27.856 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.209 0.048 28.486 1.00 0.00 H new ATOM 1241 N LYS A 76 -1.585 -2.693 27.752 1.00 0.00 N ATOM 1242 CA LYS A 76 -1.151 -3.984 28.272 1.00 0.00 C ATOM 1243 C LYS A 76 -0.562 -4.848 27.162 1.00 0.00 C ATOM 1244 O LYS A 76 -0.679 -6.073 27.187 1.00 0.00 O ATOM 1245 CB LYS A 76 -2.325 -4.713 28.931 1.00 0.00 C ATOM 1246 CG LYS A 76 -2.014 -5.232 30.324 1.00 0.00 C ATOM 1247 CD LYS A 76 -3.283 -5.533 31.103 1.00 0.00 C ATOM 1248 CE LYS A 76 -3.122 -6.766 31.978 1.00 0.00 C ATOM 1249 NZ LYS A 76 -3.891 -6.651 33.247 1.00 0.00 N ATOM 0 H LYS A 76 -1.530 -2.607 26.737 1.00 0.00 H new ATOM 0 HA LYS A 76 -0.377 -3.805 29.018 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -3.177 -4.036 28.987 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.623 -5.549 28.299 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.409 -6.135 30.250 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -1.421 -4.494 30.864 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.541 -4.676 31.725 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -4.110 -5.684 30.409 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -3.457 -7.646 31.429 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.066 -6.914 32.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -3.755 -7.512 33.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.555 -5.826 33.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -4.902 -6.535 33.031 1.00 0.00 H new ATOM 1263 N SER A 77 0.071 -4.202 26.188 1.00 0.00 N ATOM 1264 CA SER A 77 0.677 -4.911 25.067 1.00 0.00 C ATOM 1265 C SER A 77 1.576 -6.041 25.561 1.00 0.00 C ATOM 1266 O SER A 77 1.897 -6.120 26.747 1.00 0.00 O ATOM 1267 CB SER A 77 1.484 -3.943 24.200 1.00 0.00 C ATOM 1268 OG SER A 77 2.810 -3.812 24.682 1.00 0.00 O ATOM 0 H SER A 77 0.178 -3.188 26.153 1.00 0.00 H new ATOM 0 HA SER A 77 -0.124 -5.343 24.467 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.501 -4.300 23.170 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.999 -2.967 24.191 1.00 0.00 H new ATOM 0 HG SER A 77 2.800 -3.772 25.661 1.00 0.00 H new ATOM 1274 N ASP A 78 1.977 -6.913 24.643 1.00 0.00 N ATOM 1275 CA ASP A 78 2.840 -8.038 24.982 1.00 0.00 C ATOM 1276 C ASP A 78 3.411 -8.685 23.724 1.00 0.00 C ATOM 1277 O ASP A 78 2.968 -9.748 23.288 1.00 0.00 O ATOM 1278 CB ASP A 78 2.065 -9.075 25.797 1.00 0.00 C ATOM 1279 CG ASP A 78 2.324 -8.953 27.286 1.00 0.00 C ATOM 1280 OD1 ASP A 78 3.503 -8.815 27.674 1.00 0.00 O ATOM 1281 OD2 ASP A 78 1.347 -8.994 28.063 1.00 0.00 O ATOM 0 H ASP A 78 1.718 -6.862 23.658 1.00 0.00 H new ATOM 0 HA ASP A 78 3.668 -7.660 25.582 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.998 -8.959 25.606 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.342 -10.075 25.464 1.00 0.00 H new ATOM 1286 N PRO A 79 4.416 -8.029 23.125 1.00 0.00 N ATOM 1287 CA PRO A 79 5.068 -8.522 21.908 1.00 0.00 C ATOM 1288 C PRO A 79 5.905 -9.771 22.164 1.00 0.00 C ATOM 1289 O PRO A 79 6.168 -10.552 21.249 1.00 0.00 O ATOM 1290 CB PRO A 79 5.965 -7.354 21.489 1.00 0.00 C ATOM 1291 CG PRO A 79 6.233 -6.610 22.752 1.00 0.00 C ATOM 1292 CD PRO A 79 4.994 -6.757 23.590 1.00 0.00 C ATOM 0 HA PRO A 79 4.344 -8.816 21.148 1.00 0.00 H new ATOM 0 HB2 PRO A 79 6.890 -7.709 21.035 1.00 0.00 H new ATOM 0 HB3 PRO A 79 5.471 -6.720 20.753 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.103 -7.017 23.267 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.445 -5.560 22.549 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.230 -6.788 24.654 1.00 0.00 H new ATOM 0 HD3 PRO A 79 4.306 -5.925 23.440 1.00 0.00 H new ATOM 1300 N TYR A 80 6.320 -9.954 23.412 1.00 0.00 N ATOM 1301 CA TYR A 80 7.129 -11.108 23.787 1.00 0.00 C ATOM 1302 C TYR A 80 6.478 -12.405 23.316 1.00 0.00 C ATOM 1303 O TYR A 80 7.140 -13.271 22.744 1.00 0.00 O ATOM 1304 CB TYR A 80 7.328 -11.146 25.303 1.00 0.00 C ATOM 1305 CG TYR A 80 7.815 -9.837 25.883 1.00 0.00 C ATOM 1306 CD1 TYR A 80 8.813 -9.104 25.253 1.00 0.00 C ATOM 1307 CD2 TYR A 80 7.276 -9.333 27.060 1.00 0.00 C ATOM 1308 CE1 TYR A 80 9.262 -7.908 25.779 1.00 0.00 C ATOM 1309 CE2 TYR A 80 7.718 -8.137 27.593 1.00 0.00 C ATOM 1310 CZ TYR A 80 8.711 -7.428 26.950 1.00 0.00 C ATOM 1311 OH TYR A 80 9.153 -6.237 27.477 1.00 0.00 O ATOM 0 H TYR A 80 6.110 -9.318 24.181 1.00 0.00 H new ATOM 0 HA TYR A 80 8.100 -11.013 23.302 1.00 0.00 H new ATOM 0 HB2 TYR A 80 6.385 -11.416 25.778 1.00 0.00 H new ATOM 0 HB3 TYR A 80 8.044 -11.931 25.547 1.00 0.00 H new ATOM 0 HD1 TYR A 80 9.245 -9.476 24.336 1.00 0.00 H new ATOM 0 HD2 TYR A 80 6.498 -9.885 27.567 1.00 0.00 H new ATOM 0 HE1 TYR A 80 10.040 -7.352 25.277 1.00 0.00 H new ATOM 0 HE2 TYR A 80 7.288 -7.759 28.509 1.00 0.00 H new ATOM 0 HH TYR A 80 8.662 -6.042 28.302 1.00 0.00 H new ATOM 1321 N ARG A 81 5.178 -12.530 23.561 1.00 0.00 N ATOM 1322 CA ARG A 81 4.437 -13.721 23.163 1.00 0.00 C ATOM 1323 C ARG A 81 4.420 -13.869 21.644 1.00 0.00 C ATOM 1324 O ARG A 81 4.461 -14.980 21.117 1.00 0.00 O ATOM 1325 CB ARG A 81 3.005 -13.658 23.696 1.00 0.00 C ATOM 1326 CG ARG A 81 2.899 -13.912 25.190 1.00 0.00 C ATOM 1327 CD ARG A 81 3.340 -12.699 25.994 1.00 0.00 C ATOM 1328 NE ARG A 81 2.496 -12.482 27.166 1.00 0.00 N ATOM 1329 CZ ARG A 81 1.225 -12.100 27.095 1.00 0.00 C ATOM 1330 NH1 ARG A 81 0.656 -11.895 25.916 1.00 0.00 N ATOM 1331 NH2 ARG A 81 0.522 -11.923 28.207 1.00 0.00 N ATOM 0 H ARG A 81 4.616 -11.822 24.033 1.00 0.00 H new ATOM 0 HA ARG A 81 4.938 -14.590 23.590 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.586 -12.677 23.472 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.397 -14.392 23.167 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.870 -14.164 25.445 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.514 -14.771 25.459 1.00 0.00 H new ATOM 0 HD2 ARG A 81 4.374 -12.831 26.312 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.313 -11.814 25.359 1.00 0.00 H new ATOM 0 HE ARG A 81 2.904 -12.632 28.089 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.194 -12.030 25.060 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.320 -11.602 25.865 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.957 -12.080 29.116 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -0.453 -11.630 28.152 1.00 0.00 H new ATOM 1345 N VAL A 82 4.359 -12.739 20.946 1.00 0.00 N ATOM 1346 CA VAL A 82 4.338 -12.742 19.488 1.00 0.00 C ATOM 1347 C VAL A 82 5.630 -13.318 18.920 1.00 0.00 C ATOM 1348 O VAL A 82 5.606 -14.261 18.130 1.00 0.00 O ATOM 1349 CB VAL A 82 4.131 -11.323 18.927 1.00 0.00 C ATOM 1350 CG1 VAL A 82 4.074 -11.352 17.407 1.00 0.00 C ATOM 1351 CG2 VAL A 82 2.868 -10.701 19.504 1.00 0.00 C ATOM 0 H VAL A 82 4.323 -11.810 21.367 1.00 0.00 H new ATOM 0 HA VAL A 82 3.500 -13.370 19.185 1.00 0.00 H new ATOM 0 HB VAL A 82 4.980 -10.707 19.223 1.00 0.00 H new ATOM 0 HG11 VAL A 82 3.927 -10.340 17.029 1.00 0.00 H new ATOM 0 HG12 VAL A 82 5.009 -11.754 17.015 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.245 -11.983 17.086 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.737 -9.698 19.097 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.007 -11.315 19.240 1.00 0.00 H new ATOM 0 HG23 VAL A 82 2.954 -10.643 20.589 1.00 0.00 H new ATOM 1361 N GLN A 83 6.757 -12.744 19.329 1.00 0.00 N ATOM 1362 CA GLN A 83 8.060 -13.200 18.861 1.00 0.00 C ATOM 1363 C GLN A 83 8.301 -14.654 19.252 1.00 0.00 C ATOM 1364 O GLN A 83 8.833 -15.439 18.468 1.00 0.00 O ATOM 1365 CB GLN A 83 9.170 -12.316 19.432 1.00 0.00 C ATOM 1366 CG GLN A 83 9.100 -12.152 20.942 1.00 0.00 C ATOM 1367 CD GLN A 83 10.242 -11.319 21.492 1.00 0.00 C ATOM 1368 OE1 GLN A 83 10.811 -10.484 20.789 1.00 0.00 O ATOM 1369 NE2 GLN A 83 10.583 -11.543 22.755 1.00 0.00 N ATOM 0 H GLN A 83 6.794 -11.962 19.983 1.00 0.00 H new ATOM 0 HA GLN A 83 8.072 -13.128 17.773 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.137 -12.743 19.166 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.116 -11.333 18.965 1.00 0.00 H new ATOM 0 HG2 GLN A 83 8.152 -11.684 21.209 1.00 0.00 H new ATOM 0 HG3 GLN A 83 9.114 -13.136 21.412 1.00 0.00 H new ATOM 0 HE21 GLN A 83 10.084 -12.245 23.301 1.00 0.00 H new ATOM 0 HE22 GLN A 83 11.344 -11.013 23.179 1.00 0.00 H new ATOM 1378 N ALA A 84 7.905 -15.007 20.471 1.00 0.00 N ATOM 1379 CA ALA A 84 8.076 -16.367 20.966 1.00 0.00 C ATOM 1380 C ALA A 84 7.292 -17.363 20.118 1.00 0.00 C ATOM 1381 O ALA A 84 7.832 -18.375 19.672 1.00 0.00 O ATOM 1382 CB ALA A 84 7.645 -16.457 22.423 1.00 0.00 C ATOM 0 H ALA A 84 7.464 -14.369 21.134 1.00 0.00 H new ATOM 0 HA ALA A 84 9.133 -16.622 20.895 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.778 -17.478 22.779 1.00 0.00 H new ATOM 0 HB2 ALA A 84 8.252 -15.781 23.025 1.00 0.00 H new ATOM 0 HB3 ALA A 84 6.595 -16.176 22.510 1.00 0.00 H new ATOM 1388 N VAL A 85 6.014 -17.069 19.899 1.00 0.00 N ATOM 1389 CA VAL A 85 5.155 -17.939 19.104 1.00 0.00 C ATOM 1390 C VAL A 85 5.655 -18.040 17.668 1.00 0.00 C ATOM 1391 O VAL A 85 5.778 -19.134 17.117 1.00 0.00 O ATOM 1392 CB VAL A 85 3.700 -17.434 19.096 1.00 0.00 C ATOM 1393 CG1 VAL A 85 2.853 -18.261 18.140 1.00 0.00 C ATOM 1394 CG2 VAL A 85 3.117 -17.466 20.500 1.00 0.00 C ATOM 0 H VAL A 85 5.551 -16.235 20.261 1.00 0.00 H new ATOM 0 HA VAL A 85 5.187 -18.925 19.567 1.00 0.00 H new ATOM 0 HB VAL A 85 3.695 -16.401 18.748 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.828 -17.890 18.148 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.260 -18.182 17.132 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.863 -19.305 18.455 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.089 -17.106 20.475 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.134 -18.488 20.878 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.710 -16.827 21.155 1.00 0.00 H new ATOM 1404 N LYS A 86 5.941 -16.891 17.064 1.00 0.00 N ATOM 1405 CA LYS A 86 6.430 -16.849 15.691 1.00 0.00 C ATOM 1406 C LYS A 86 7.661 -17.733 15.524 1.00 0.00 C ATOM 1407 O LYS A 86 7.743 -18.531 14.590 1.00 0.00 O ATOM 1408 CB LYS A 86 6.764 -15.410 15.291 1.00 0.00 C ATOM 1409 CG LYS A 86 7.494 -15.302 13.964 1.00 0.00 C ATOM 1410 CD LYS A 86 9.001 -15.308 14.154 1.00 0.00 C ATOM 1411 CE LYS A 86 9.680 -14.281 13.261 1.00 0.00 C ATOM 1412 NZ LYS A 86 10.839 -14.861 12.529 1.00 0.00 N ATOM 0 H LYS A 86 5.842 -15.976 17.504 1.00 0.00 H new ATOM 0 HA LYS A 86 5.642 -17.228 15.040 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.841 -14.833 15.236 1.00 0.00 H new ATOM 0 HB3 LYS A 86 7.376 -14.958 16.071 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.204 -16.132 13.320 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.194 -14.385 13.456 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.238 -15.098 15.197 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.393 -16.301 13.932 1.00 0.00 H new ATOM 0 HE2 LYS A 86 8.958 -13.889 12.545 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.017 -13.440 13.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.274 -14.129 11.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.540 -15.212 13.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.514 -15.647 11.931 1.00 0.00 H new ATOM 1426 N PHE A 87 8.616 -17.588 16.437 1.00 0.00 N ATOM 1427 CA PHE A 87 9.844 -18.374 16.390 1.00 0.00 C ATOM 1428 C PHE A 87 9.539 -19.865 16.506 1.00 0.00 C ATOM 1429 O PHE A 87 10.062 -20.678 15.742 1.00 0.00 O ATOM 1430 CB PHE A 87 10.791 -17.947 17.514 1.00 0.00 C ATOM 1431 CG PHE A 87 12.238 -17.954 17.113 1.00 0.00 C ATOM 1432 CD1 PHE A 87 12.682 -17.172 16.059 1.00 0.00 C ATOM 1433 CD2 PHE A 87 13.155 -18.743 17.789 1.00 0.00 C ATOM 1434 CE1 PHE A 87 14.014 -17.175 15.687 1.00 0.00 C ATOM 1435 CE2 PHE A 87 14.487 -18.750 17.422 1.00 0.00 C ATOM 1436 CZ PHE A 87 14.917 -17.966 16.369 1.00 0.00 C ATOM 0 H PHE A 87 8.563 -16.934 17.218 1.00 0.00 H new ATOM 0 HA PHE A 87 10.326 -18.193 15.429 1.00 0.00 H new ATOM 0 HB2 PHE A 87 10.519 -16.945 17.846 1.00 0.00 H new ATOM 0 HB3 PHE A 87 10.655 -18.613 18.366 1.00 0.00 H new ATOM 0 HD1 PHE A 87 11.979 -16.553 15.521 1.00 0.00 H new ATOM 0 HD2 PHE A 87 12.825 -19.359 18.612 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.347 -16.560 14.864 1.00 0.00 H new ATOM 0 HE2 PHE A 87 15.192 -19.368 17.958 1.00 0.00 H new ATOM 0 HZ PHE A 87 15.958 -17.972 16.080 1.00 0.00 H new ATOM 1446 N LEU A 88 8.692 -20.217 17.466 1.00 0.00 N ATOM 1447 CA LEU A 88 8.317 -21.610 17.683 1.00 0.00 C ATOM 1448 C LEU A 88 7.710 -22.214 16.421 1.00 0.00 C ATOM 1449 O LEU A 88 8.122 -23.285 15.974 1.00 0.00 O ATOM 1450 CB LEU A 88 7.323 -21.717 18.842 1.00 0.00 C ATOM 1451 CG LEU A 88 7.839 -21.275 20.211 1.00 0.00 C ATOM 1452 CD1 LEU A 88 6.710 -20.686 21.043 1.00 0.00 C ATOM 1453 CD2 LEU A 88 8.487 -22.444 20.940 1.00 0.00 C ATOM 0 H LEU A 88 8.251 -19.557 18.107 1.00 0.00 H new ATOM 0 HA LEU A 88 9.219 -22.168 17.933 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.444 -21.120 18.597 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.994 -22.753 18.917 1.00 0.00 H new ATOM 0 HG LEU A 88 8.593 -20.503 20.061 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.097 -20.377 22.014 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.291 -19.822 20.528 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.932 -21.437 21.184 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.849 -22.111 21.913 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.753 -23.238 21.078 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.324 -22.821 20.352 1.00 0.00 H new ATOM 1465 N ILE A 89 6.733 -21.519 15.849 1.00 0.00 N ATOM 1466 CA ILE A 89 6.073 -21.985 14.636 1.00 0.00 C ATOM 1467 C ILE A 89 7.081 -22.218 13.516 1.00 0.00 C ATOM 1468 O ILE A 89 7.105 -23.283 12.902 1.00 0.00 O ATOM 1469 CB ILE A 89 5.008 -20.982 14.154 1.00 0.00 C ATOM 1470 CG1 ILE A 89 3.888 -20.856 15.189 1.00 0.00 C ATOM 1471 CG2 ILE A 89 4.446 -21.414 12.807 1.00 0.00 C ATOM 1472 CD1 ILE A 89 3.077 -22.121 15.359 1.00 0.00 C ATOM 0 H ILE A 89 6.381 -20.631 16.206 1.00 0.00 H new ATOM 0 HA ILE A 89 5.586 -22.928 14.884 1.00 0.00 H new ATOM 0 HB ILE A 89 5.477 -20.005 14.034 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.322 -20.580 16.150 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.223 -20.044 14.895 1.00 0.00 H new ATOM 0 HG21 ILE A 89 3.695 -20.696 12.479 1.00 0.00 H new ATOM 0 HG22 ILE A 89 5.251 -21.457 12.074 1.00 0.00 H new ATOM 0 HG23 ILE A 89 3.989 -22.399 12.902 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.302 -21.958 16.108 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.614 -22.387 14.409 1.00 0.00 H new ATOM 0 HD13 ILE A 89 3.730 -22.931 15.683 1.00 0.00 H new ATOM 1484 N GLU A 90 7.913 -21.213 13.258 1.00 0.00 N ATOM 1485 CA GLU A 90 8.924 -21.309 12.213 1.00 0.00 C ATOM 1486 C GLU A 90 9.885 -22.463 12.489 1.00 0.00 C ATOM 1487 O GLU A 90 10.166 -23.275 11.608 1.00 0.00 O ATOM 1488 CB GLU A 90 9.704 -19.997 12.104 1.00 0.00 C ATOM 1489 CG GLU A 90 10.867 -20.059 11.129 1.00 0.00 C ATOM 1490 CD GLU A 90 11.384 -18.685 10.749 1.00 0.00 C ATOM 1491 OE1 GLU A 90 10.612 -17.902 10.160 1.00 0.00 O ATOM 1492 OE2 GLU A 90 12.563 -18.394 11.042 1.00 0.00 O ATOM 0 H GLU A 90 7.906 -20.324 13.758 1.00 0.00 H new ATOM 0 HA GLU A 90 8.415 -21.500 11.268 1.00 0.00 H new ATOM 0 HB2 GLU A 90 9.023 -19.204 11.794 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.082 -19.726 13.090 1.00 0.00 H new ATOM 0 HG2 GLU A 90 11.677 -20.638 11.572 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.553 -20.587 10.228 1.00 0.00 H new ATOM 1499 N ARG A 91 10.385 -22.526 13.719 1.00 0.00 N ATOM 1500 CA ARG A 91 11.315 -23.578 14.111 1.00 0.00 C ATOM 1501 C ARG A 91 10.771 -24.953 13.737 1.00 0.00 C ATOM 1502 O ARG A 91 11.448 -25.741 13.076 1.00 0.00 O ATOM 1503 CB ARG A 91 11.583 -23.516 15.616 1.00 0.00 C ATOM 1504 CG ARG A 91 12.945 -22.944 15.970 1.00 0.00 C ATOM 1505 CD ARG A 91 13.134 -21.553 15.385 1.00 0.00 C ATOM 1506 NE ARG A 91 14.236 -21.506 14.428 1.00 0.00 N ATOM 1507 CZ ARG A 91 14.398 -20.530 13.541 1.00 0.00 C ATOM 1508 NH1 ARG A 91 13.535 -19.525 13.491 1.00 0.00 N ATOM 1509 NH2 ARG A 91 15.426 -20.559 12.702 1.00 0.00 N ATOM 0 H ARG A 91 10.162 -21.862 14.460 1.00 0.00 H new ATOM 0 HA ARG A 91 12.251 -23.419 13.575 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.810 -22.910 16.089 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.501 -24.520 16.033 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.053 -22.902 17.054 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.727 -23.606 15.598 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.213 -21.239 14.893 1.00 0.00 H new ATOM 0 HD3 ARG A 91 13.323 -20.844 16.191 1.00 0.00 H new ATOM 0 HE ARG A 91 14.919 -22.264 14.441 1.00 0.00 H new ATOM 0 HH11 ARG A 91 12.744 -19.499 14.135 1.00 0.00 H new ATOM 0 HH12 ARG A 91 13.662 -18.777 12.809 1.00 0.00 H new ATOM 0 HH21 ARG A 91 16.092 -21.331 12.738 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.550 -19.810 12.021 1.00 0.00 H new ATOM 1523 N ILE A 92 9.544 -25.234 14.163 1.00 0.00 N ATOM 1524 CA ILE A 92 8.909 -26.513 13.872 1.00 0.00 C ATOM 1525 C ILE A 92 8.578 -26.638 12.388 1.00 0.00 C ATOM 1526 O ILE A 92 8.531 -27.740 11.843 1.00 0.00 O ATOM 1527 CB ILE A 92 7.618 -26.701 14.691 1.00 0.00 C ATOM 1528 CG1 ILE A 92 7.898 -26.486 16.180 1.00 0.00 C ATOM 1529 CG2 ILE A 92 7.034 -28.085 14.451 1.00 0.00 C ATOM 1530 CD1 ILE A 92 6.649 -26.466 17.033 1.00 0.00 C ATOM 0 H ILE A 92 8.970 -24.593 14.711 1.00 0.00 H new ATOM 0 HA ILE A 92 9.622 -27.289 14.150 1.00 0.00 H new ATOM 0 HB ILE A 92 6.888 -25.960 14.366 1.00 0.00 H new ATOM 0 HG12 ILE A 92 8.558 -27.277 16.535 1.00 0.00 H new ATOM 0 HG13 ILE A 92 8.431 -25.544 16.309 1.00 0.00 H new ATOM 0 HG21 ILE A 92 6.122 -28.202 15.037 1.00 0.00 H new ATOM 0 HG22 ILE A 92 6.803 -28.204 13.392 1.00 0.00 H new ATOM 0 HG23 ILE A 92 7.758 -28.842 14.751 1.00 0.00 H new ATOM 0 HD11 ILE A 92 6.923 -26.310 18.076 1.00 0.00 H new ATOM 0 HD12 ILE A 92 5.997 -25.657 16.704 1.00 0.00 H new ATOM 0 HD13 ILE A 92 6.126 -27.417 16.934 1.00 0.00 H new ATOM 1542 N ARG A 93 8.351 -25.500 11.741 1.00 0.00 N ATOM 1543 CA ARG A 93 8.026 -25.481 10.320 1.00 0.00 C ATOM 1544 C ARG A 93 9.260 -25.785 9.475 1.00 0.00 C ATOM 1545 O ARG A 93 9.149 -26.204 8.322 1.00 0.00 O ATOM 1546 CB ARG A 93 7.447 -24.121 9.925 1.00 0.00 C ATOM 1547 CG ARG A 93 5.936 -24.124 9.767 1.00 0.00 C ATOM 1548 CD ARG A 93 5.529 -24.161 8.302 1.00 0.00 C ATOM 1549 NE ARG A 93 6.134 -25.285 7.594 1.00 0.00 N ATOM 1550 CZ ARG A 93 5.661 -25.777 6.455 1.00 0.00 C ATOM 1551 NH1 ARG A 93 4.582 -25.246 5.897 1.00 0.00 N ATOM 1552 NH2 ARG A 93 6.267 -26.802 5.870 1.00 0.00 N ATOM 0 H ARG A 93 8.386 -24.579 12.178 1.00 0.00 H new ATOM 0 HA ARG A 93 7.280 -26.254 10.134 1.00 0.00 H new ATOM 0 HB2 ARG A 93 7.723 -23.385 10.680 1.00 0.00 H new ATOM 0 HB3 ARG A 93 7.901 -23.801 8.987 1.00 0.00 H new ATOM 0 HG2 ARG A 93 5.517 -24.987 10.284 1.00 0.00 H new ATOM 0 HG3 ARG A 93 5.518 -23.235 10.240 1.00 0.00 H new ATOM 0 HD2 ARG A 93 4.444 -24.229 8.229 1.00 0.00 H new ATOM 0 HD3 ARG A 93 5.823 -23.229 7.820 1.00 0.00 H new ATOM 0 HE ARG A 93 6.966 -25.716 7.996 1.00 0.00 H new ATOM 0 HH11 ARG A 93 4.113 -24.457 6.343 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.221 -25.626 5.022 1.00 0.00 H new ATOM 0 HH21 ARG A 93 7.098 -27.214 6.295 1.00 0.00 H new ATOM 0 HH22 ARG A 93 5.902 -27.179 4.995 1.00 0.00 H new ATOM 1566 N LYS A 94 10.435 -25.572 10.056 1.00 0.00 N ATOM 1567 CA LYS A 94 11.691 -25.824 9.359 1.00 0.00 C ATOM 1568 C LYS A 94 12.408 -27.034 9.949 1.00 0.00 C ATOM 1569 O LYS A 94 13.382 -27.527 9.383 1.00 0.00 O ATOM 1570 CB LYS A 94 12.597 -24.593 9.436 1.00 0.00 C ATOM 1571 CG LYS A 94 11.923 -23.312 8.974 1.00 0.00 C ATOM 1572 CD LYS A 94 12.882 -22.428 8.195 1.00 0.00 C ATOM 1573 CE LYS A 94 12.671 -22.563 6.695 1.00 0.00 C ATOM 1574 NZ LYS A 94 11.968 -21.380 6.125 1.00 0.00 N ATOM 0 H LYS A 94 10.544 -25.225 11.009 1.00 0.00 H new ATOM 0 HA LYS A 94 11.462 -26.034 8.314 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.936 -24.465 10.464 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.484 -24.767 8.827 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.063 -23.557 8.350 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.544 -22.767 9.838 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.742 -21.388 8.491 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.909 -22.695 8.445 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.636 -22.685 6.202 1.00 0.00 H new ATOM 0 HE3 LYS A 94 12.092 -23.463 6.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 11.843 -21.511 5.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.037 -21.278 6.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.532 -20.524 6.299 1.00 0.00 H new ATOM 1588 N ASN A 95 11.918 -27.507 11.091 1.00 0.00 N ATOM 1589 CA ASN A 95 12.513 -28.660 11.757 1.00 0.00 C ATOM 1590 C ASN A 95 13.933 -28.349 12.219 1.00 0.00 C ATOM 1591 O ASN A 95 14.902 -28.651 11.524 1.00 0.00 O ATOM 1592 CB ASN A 95 12.523 -29.869 10.818 1.00 0.00 C ATOM 1593 CG ASN A 95 12.089 -31.145 11.514 1.00 0.00 C ATOM 1594 OD1 ASN A 95 12.776 -32.164 11.449 1.00 0.00 O ATOM 1595 ND2 ASN A 95 10.943 -31.093 12.183 1.00 0.00 N ATOM 0 H ASN A 95 11.112 -27.110 11.574 1.00 0.00 H new ATOM 0 HA ASN A 95 11.908 -28.894 12.633 1.00 0.00 H new ATOM 0 HB2 ASN A 95 11.861 -29.676 9.974 1.00 0.00 H new ATOM 0 HB3 ASN A 95 13.526 -30.003 10.413 1.00 0.00 H new ATOM 0 HD21 ASN A 95 10.599 -31.920 12.671 1.00 0.00 H new ATOM 0 HD22 ASN A 95 10.407 -30.226 12.209 1.00 0.00 H new ATOM 1602 N GLU A 96 14.047 -27.745 13.398 1.00 0.00 N ATOM 1603 CA GLU A 96 15.348 -27.393 13.953 1.00 0.00 C ATOM 1604 C GLU A 96 15.322 -27.445 15.478 1.00 0.00 C ATOM 1605 O GLU A 96 14.265 -27.397 16.108 1.00 0.00 O ATOM 1606 CB GLU A 96 15.766 -25.997 13.487 1.00 0.00 C ATOM 1607 CG GLU A 96 16.646 -26.006 12.248 1.00 0.00 C ATOM 1608 CD GLU A 96 17.382 -24.696 12.046 1.00 0.00 C ATOM 1609 OE1 GLU A 96 17.338 -23.844 12.958 1.00 0.00 O ATOM 1610 OE2 GLU A 96 18.002 -24.523 10.976 1.00 0.00 O ATOM 0 H GLU A 96 13.254 -27.490 13.987 1.00 0.00 H new ATOM 0 HA GLU A 96 16.075 -28.121 13.594 1.00 0.00 H new ATOM 0 HB2 GLU A 96 14.872 -25.409 13.283 1.00 0.00 H new ATOM 0 HB3 GLU A 96 16.298 -25.497 14.296 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.370 -26.817 12.327 1.00 0.00 H new ATOM 0 HG3 GLU A 96 16.031 -26.212 11.372 1.00 0.00 H new ATOM 1617 N PRO A 97 16.513 -27.547 16.086 1.00 0.00 N ATOM 1618 CA PRO A 97 16.654 -27.609 17.544 1.00 0.00 C ATOM 1619 C PRO A 97 16.315 -26.282 18.216 1.00 0.00 C ATOM 1620 O PRO A 97 17.081 -25.321 18.138 1.00 0.00 O ATOM 1621 CB PRO A 97 18.134 -27.945 17.743 1.00 0.00 C ATOM 1622 CG PRO A 97 18.807 -27.439 16.514 1.00 0.00 C ATOM 1623 CD PRO A 97 17.813 -27.610 15.398 1.00 0.00 C ATOM 0 HA PRO A 97 15.974 -28.335 17.989 1.00 0.00 H new ATOM 0 HB2 PRO A 97 18.532 -27.466 18.638 1.00 0.00 H new ATOM 0 HB3 PRO A 97 18.284 -29.018 17.863 1.00 0.00 H new ATOM 0 HG2 PRO A 97 19.091 -26.393 16.627 1.00 0.00 H new ATOM 0 HG3 PRO A 97 19.721 -27.997 16.312 1.00 0.00 H new ATOM 0 HD2 PRO A 97 17.910 -26.824 14.650 1.00 0.00 H new ATOM 0 HD3 PRO A 97 17.949 -28.560 14.881 1.00 0.00 H new ATOM 1631 N LEU A 98 15.163 -26.237 18.876 1.00 0.00 N ATOM 1632 CA LEU A 98 14.722 -25.028 19.562 1.00 0.00 C ATOM 1633 C LEU A 98 15.571 -24.765 20.802 1.00 0.00 C ATOM 1634 O LEU A 98 15.876 -25.670 21.579 1.00 0.00 O ATOM 1635 CB LEU A 98 13.248 -25.150 19.956 1.00 0.00 C ATOM 1636 CG LEU A 98 12.309 -25.694 18.879 1.00 0.00 C ATOM 1637 CD1 LEU A 98 12.069 -27.182 19.082 1.00 0.00 C ATOM 1638 CD2 LEU A 98 10.991 -24.933 18.887 1.00 0.00 C ATOM 0 H LEU A 98 14.518 -27.023 18.951 1.00 0.00 H new ATOM 0 HA LEU A 98 14.841 -24.188 18.878 1.00 0.00 H new ATOM 0 HB2 LEU A 98 13.179 -25.797 20.831 1.00 0.00 H new ATOM 0 HB3 LEU A 98 12.891 -24.166 20.258 1.00 0.00 H new ATOM 0 HG LEU A 98 12.781 -25.553 17.907 1.00 0.00 H new ATOM 0 HD11 LEU A 98 11.398 -27.552 18.306 1.00 0.00 H new ATOM 0 HD12 LEU A 98 13.018 -27.715 19.025 1.00 0.00 H new ATOM 0 HD13 LEU A 98 11.618 -27.348 20.060 1.00 0.00 H new ATOM 0 HD21 LEU A 98 10.335 -25.333 18.114 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.514 -25.042 19.861 1.00 0.00 H new ATOM 0 HD23 LEU A 98 11.179 -23.877 18.692 1.00 0.00 H new ATOM 1650 N PRO A 99 15.961 -23.496 20.994 1.00 0.00 N ATOM 1651 CA PRO A 99 16.777 -23.083 22.139 1.00 0.00 C ATOM 1652 C PRO A 99 16.008 -23.149 23.454 1.00 0.00 C ATOM 1653 O PRO A 99 14.896 -23.676 23.508 1.00 0.00 O ATOM 1654 CB PRO A 99 17.148 -21.636 21.808 1.00 0.00 C ATOM 1655 CG PRO A 99 16.061 -21.164 20.904 1.00 0.00 C ATOM 1656 CD PRO A 99 15.634 -22.366 20.108 1.00 0.00 C ATOM 0 HA PRO A 99 17.638 -23.736 22.281 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.206 -21.026 22.709 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.121 -21.578 21.321 1.00 0.00 H new ATOM 0 HG2 PRO A 99 15.227 -20.758 21.476 1.00 0.00 H new ATOM 0 HG3 PRO A 99 16.416 -20.368 20.249 1.00 0.00 H new ATOM 0 HD2 PRO A 99 14.570 -22.335 19.873 1.00 0.00 H new ATOM 0 HD3 PRO A 99 16.168 -22.431 19.160 1.00 0.00 H new ATOM 1664 N VAL A 100 16.606 -22.610 24.512 1.00 0.00 N ATOM 1665 CA VAL A 100 15.975 -22.606 25.826 1.00 0.00 C ATOM 1666 C VAL A 100 14.866 -21.563 25.901 1.00 0.00 C ATOM 1667 O VAL A 100 14.981 -20.477 25.332 1.00 0.00 O ATOM 1668 CB VAL A 100 17.002 -22.328 26.940 1.00 0.00 C ATOM 1669 CG1 VAL A 100 16.373 -22.535 28.310 1.00 0.00 C ATOM 1670 CG2 VAL A 100 18.227 -23.213 26.768 1.00 0.00 C ATOM 0 H VAL A 100 17.526 -22.171 24.484 1.00 0.00 H new ATOM 0 HA VAL A 100 15.547 -23.597 25.974 1.00 0.00 H new ATOM 0 HB VAL A 100 17.320 -21.288 26.866 1.00 0.00 H new ATOM 0 HG11 VAL A 100 17.113 -22.334 29.084 1.00 0.00 H new ATOM 0 HG12 VAL A 100 15.529 -21.855 28.429 1.00 0.00 H new ATOM 0 HG13 VAL A 100 16.025 -23.564 28.399 1.00 0.00 H new ATOM 0 HG21 VAL A 100 18.942 -23.003 27.564 1.00 0.00 H new ATOM 0 HG22 VAL A 100 17.929 -24.260 26.815 1.00 0.00 H new ATOM 0 HG23 VAL A 100 18.689 -23.011 25.802 1.00 0.00 H new ATOM 1680 N TYR A 101 13.791 -21.900 26.605 1.00 0.00 N ATOM 1681 CA TYR A 101 12.659 -20.993 26.753 1.00 0.00 C ATOM 1682 C TYR A 101 13.086 -19.695 27.433 1.00 0.00 C ATOM 1683 O TYR A 101 12.705 -18.604 27.009 1.00 0.00 O ATOM 1684 CB TYR A 101 11.545 -21.662 27.560 1.00 0.00 C ATOM 1685 CG TYR A 101 10.412 -20.727 27.918 1.00 0.00 C ATOM 1686 CD1 TYR A 101 9.905 -19.829 26.987 1.00 0.00 C ATOM 1687 CD2 TYR A 101 9.848 -20.742 29.188 1.00 0.00 C ATOM 1688 CE1 TYR A 101 8.871 -18.972 27.311 1.00 0.00 C ATOM 1689 CE2 TYR A 101 8.812 -19.891 29.520 1.00 0.00 C ATOM 1690 CZ TYR A 101 8.327 -19.007 28.578 1.00 0.00 C ATOM 1691 OH TYR A 101 7.296 -18.156 28.904 1.00 0.00 O ATOM 0 H TYR A 101 13.680 -22.795 27.082 1.00 0.00 H new ATOM 0 HA TYR A 101 12.285 -20.754 25.758 1.00 0.00 H new ATOM 0 HB2 TYR A 101 11.147 -22.500 26.988 1.00 0.00 H new ATOM 0 HB3 TYR A 101 11.968 -22.074 28.476 1.00 0.00 H new ATOM 0 HD1 TYR A 101 10.326 -19.800 25.993 1.00 0.00 H new ATOM 0 HD2 TYR A 101 10.226 -21.431 29.928 1.00 0.00 H new ATOM 0 HE1 TYR A 101 8.491 -18.278 26.576 1.00 0.00 H new ATOM 0 HE2 TYR A 101 8.384 -19.917 30.511 1.00 0.00 H new ATOM 0 HH TYR A 101 7.027 -18.309 29.834 1.00 0.00 H new ATOM 1701 N LYS A 102 13.880 -19.822 28.490 1.00 0.00 N ATOM 1702 CA LYS A 102 14.362 -18.662 29.229 1.00 0.00 C ATOM 1703 C LYS A 102 15.376 -17.874 28.405 1.00 0.00 C ATOM 1704 O LYS A 102 15.255 -16.659 28.250 1.00 0.00 O ATOM 1705 CB LYS A 102 14.994 -19.100 30.552 1.00 0.00 C ATOM 1706 CG LYS A 102 14.476 -18.335 31.757 1.00 0.00 C ATOM 1707 CD LYS A 102 13.000 -18.603 31.996 1.00 0.00 C ATOM 1708 CE LYS A 102 12.746 -20.065 32.330 1.00 0.00 C ATOM 1709 NZ LYS A 102 11.490 -20.246 33.109 1.00 0.00 N ATOM 0 H LYS A 102 14.204 -20.718 28.855 1.00 0.00 H new ATOM 0 HA LYS A 102 13.509 -18.016 29.437 1.00 0.00 H new ATOM 0 HB2 LYS A 102 14.807 -20.164 30.700 1.00 0.00 H new ATOM 0 HB3 LYS A 102 16.075 -18.972 30.488 1.00 0.00 H new ATOM 0 HG2 LYS A 102 15.046 -18.619 32.642 1.00 0.00 H new ATOM 0 HG3 LYS A 102 14.633 -17.267 31.606 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.643 -17.975 32.812 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.431 -18.327 31.108 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.688 -20.643 31.408 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.587 -20.459 32.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.353 -21.256 33.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.555 -19.715 34.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.684 -19.894 32.554 1.00 0.00 H new ATOM 1723 N ASP A 103 16.375 -18.574 27.879 1.00 0.00 N ATOM 1724 CA ASP A 103 17.408 -17.941 27.068 1.00 0.00 C ATOM 1725 C ASP A 103 16.796 -17.232 25.864 1.00 0.00 C ATOM 1726 O ASP A 103 17.048 -16.048 25.633 1.00 0.00 O ATOM 1727 CB ASP A 103 18.428 -18.981 26.600 1.00 0.00 C ATOM 1728 CG ASP A 103 19.750 -18.356 26.200 1.00 0.00 C ATOM 1729 OD1 ASP A 103 19.980 -17.179 26.549 1.00 0.00 O ATOM 1730 OD2 ASP A 103 20.555 -19.044 25.538 1.00 0.00 O ATOM 0 H ASP A 103 16.491 -19.580 28.000 1.00 0.00 H new ATOM 0 HA ASP A 103 17.915 -17.199 27.684 1.00 0.00 H new ATOM 0 HB2 ASP A 103 18.598 -19.704 27.398 1.00 0.00 H new ATOM 0 HB3 ASP A 103 18.019 -19.532 25.753 1.00 0.00 H new ATOM 1735 N LEU A 104 15.992 -17.962 25.099 1.00 0.00 N ATOM 1736 CA LEU A 104 15.345 -17.404 23.918 1.00 0.00 C ATOM 1737 C LEU A 104 14.467 -16.213 24.289 1.00 0.00 C ATOM 1738 O LEU A 104 14.602 -15.129 23.722 1.00 0.00 O ATOM 1739 CB LEU A 104 14.504 -18.474 23.219 1.00 0.00 C ATOM 1740 CG LEU A 104 13.677 -18.002 22.022 1.00 0.00 C ATOM 1741 CD1 LEU A 104 14.386 -18.335 20.719 1.00 0.00 C ATOM 1742 CD2 LEU A 104 12.290 -18.628 22.052 1.00 0.00 C ATOM 0 H LEU A 104 15.773 -18.942 25.276 1.00 0.00 H new ATOM 0 HA LEU A 104 16.123 -17.060 23.237 1.00 0.00 H new ATOM 0 HB2 LEU A 104 15.170 -19.269 22.884 1.00 0.00 H new ATOM 0 HB3 LEU A 104 13.827 -18.912 23.953 1.00 0.00 H new ATOM 0 HG LEU A 104 13.567 -16.919 22.085 1.00 0.00 H new ATOM 0 HD11 LEU A 104 13.783 -17.992 19.879 1.00 0.00 H new ATOM 0 HD12 LEU A 104 15.356 -17.839 20.696 1.00 0.00 H new ATOM 0 HD13 LEU A 104 14.528 -19.413 20.647 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.716 -18.281 21.193 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.380 -19.714 22.014 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.780 -18.338 22.971 1.00 0.00 H new ATOM 1754 N TRP A 105 13.570 -16.422 25.246 1.00 0.00 N ATOM 1755 CA TRP A 105 12.671 -15.365 25.695 1.00 0.00 C ATOM 1756 C TRP A 105 13.450 -14.103 26.050 1.00 0.00 C ATOM 1757 O TRP A 105 13.064 -12.998 25.671 1.00 0.00 O ATOM 1758 CB TRP A 105 11.861 -15.835 26.904 1.00 0.00 C ATOM 1759 CG TRP A 105 10.840 -14.837 27.360 1.00 0.00 C ATOM 1760 CD1 TRP A 105 9.647 -14.553 26.759 1.00 0.00 C ATOM 1761 CD2 TRP A 105 10.923 -13.991 28.512 1.00 0.00 C ATOM 1762 NE1 TRP A 105 8.984 -13.580 27.468 1.00 0.00 N ATOM 1763 CE2 TRP A 105 9.745 -13.220 28.548 1.00 0.00 C ATOM 1764 CE3 TRP A 105 11.877 -13.812 29.517 1.00 0.00 C ATOM 1765 CZ2 TRP A 105 9.498 -12.285 29.550 1.00 0.00 C ATOM 1766 CZ3 TRP A 105 11.631 -12.883 30.510 1.00 0.00 C ATOM 1767 CH2 TRP A 105 10.449 -12.129 30.521 1.00 0.00 C ATOM 0 H TRP A 105 13.446 -17.313 25.726 1.00 0.00 H new ATOM 0 HA TRP A 105 11.989 -15.131 24.878 1.00 0.00 H new ATOM 0 HB2 TRP A 105 11.359 -16.770 26.655 1.00 0.00 H new ATOM 0 HB3 TRP A 105 12.542 -16.049 27.728 1.00 0.00 H new ATOM 0 HD1 TRP A 105 9.279 -15.024 25.859 1.00 0.00 H new ATOM 0 HE1 TRP A 105 8.073 -13.189 27.229 1.00 0.00 H new ATOM 0 HE3 TRP A 105 12.790 -14.389 29.518 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 8.588 -11.704 29.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 12.362 -12.735 31.291 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.286 -11.411 31.311 1.00 0.00 H new ATOM 1778 N ASN A 106 14.548 -14.275 26.779 1.00 0.00 N ATOM 1779 CA ASN A 106 15.381 -13.148 27.184 1.00 0.00 C ATOM 1780 C ASN A 106 16.089 -12.535 25.981 1.00 0.00 C ATOM 1781 O ASN A 106 16.142 -11.314 25.835 1.00 0.00 O ATOM 1782 CB ASN A 106 16.411 -13.597 28.223 1.00 0.00 C ATOM 1783 CG ASN A 106 15.800 -13.789 29.597 1.00 0.00 C ATOM 1784 OD1 ASN A 106 15.082 -12.923 30.096 1.00 0.00 O ATOM 1785 ND2 ASN A 106 16.084 -14.929 30.216 1.00 0.00 N ATOM 0 H ASN A 106 14.882 -15.183 27.101 1.00 0.00 H new ATOM 0 HA ASN A 106 14.734 -12.390 27.627 1.00 0.00 H new ATOM 0 HB2 ASN A 106 16.868 -14.532 27.898 1.00 0.00 H new ATOM 0 HB3 ASN A 106 17.209 -12.857 28.283 1.00 0.00 H new ATOM 0 HD21 ASN A 106 15.702 -15.115 31.143 1.00 0.00 H new ATOM 0 HD22 ASN A 106 16.684 -15.619 29.764 1.00 0.00 H new ATOM 1792 N ALA A 107 16.632 -13.390 25.120 1.00 0.00 N ATOM 1793 CA ALA A 107 17.335 -12.933 23.928 1.00 0.00 C ATOM 1794 C ALA A 107 16.424 -12.087 23.045 1.00 0.00 C ATOM 1795 O ALA A 107 16.800 -10.997 22.611 1.00 0.00 O ATOM 1796 CB ALA A 107 17.877 -14.121 23.147 1.00 0.00 C ATOM 0 H ALA A 107 16.598 -14.404 25.226 1.00 0.00 H new ATOM 0 HA ALA A 107 18.171 -12.310 24.245 1.00 0.00 H new ATOM 0 HB1 ALA A 107 18.400 -13.765 22.259 1.00 0.00 H new ATOM 0 HB2 ALA A 107 18.569 -14.684 23.774 1.00 0.00 H new ATOM 0 HB3 ALA A 107 17.051 -14.767 22.847 1.00 0.00 H new ATOM 1802 N LEU A 108 15.225 -12.595 22.781 1.00 0.00 N ATOM 1803 CA LEU A 108 14.260 -11.886 21.948 1.00 0.00 C ATOM 1804 C LEU A 108 13.697 -10.673 22.679 1.00 0.00 C ATOM 1805 O LEU A 108 13.381 -9.655 22.063 1.00 0.00 O ATOM 1806 CB LEU A 108 13.123 -12.824 21.540 1.00 0.00 C ATOM 1807 CG LEU A 108 13.536 -14.109 20.822 1.00 0.00 C ATOM 1808 CD1 LEU A 108 12.310 -14.880 20.358 1.00 0.00 C ATOM 1809 CD2 LEU A 108 14.446 -13.792 19.644 1.00 0.00 C ATOM 0 H LEU A 108 14.898 -13.495 23.132 1.00 0.00 H new ATOM 0 HA LEU A 108 14.776 -11.539 21.052 1.00 0.00 H new ATOM 0 HB2 LEU A 108 12.564 -13.096 22.436 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.440 -12.274 20.893 1.00 0.00 H new ATOM 0 HG LEU A 108 14.088 -14.734 21.525 1.00 0.00 H new ATOM 0 HD11 LEU A 108 12.624 -15.791 19.849 1.00 0.00 H new ATOM 0 HD12 LEU A 108 11.695 -15.139 21.220 1.00 0.00 H new ATOM 0 HD13 LEU A 108 11.730 -14.263 19.672 1.00 0.00 H new ATOM 0 HD21 LEU A 108 14.730 -14.718 19.144 1.00 0.00 H new ATOM 0 HD22 LEU A 108 13.919 -13.147 18.941 1.00 0.00 H new ATOM 0 HD23 LEU A 108 15.341 -13.283 20.002 1.00 0.00 H new ATOM 1821 N ARG A 109 13.576 -10.787 23.998 1.00 0.00 N ATOM 1822 CA ARG A 109 13.052 -9.698 24.814 1.00 0.00 C ATOM 1823 C ARG A 109 13.924 -8.453 24.684 1.00 0.00 C ATOM 1824 O ARG A 109 13.432 -7.365 24.382 1.00 0.00 O ATOM 1825 CB ARG A 109 12.970 -10.126 26.281 1.00 0.00 C ATOM 1826 CG ARG A 109 11.588 -10.600 26.700 1.00 0.00 C ATOM 1827 CD ARG A 109 11.044 -9.776 27.857 1.00 0.00 C ATOM 1828 NE ARG A 109 11.901 -9.857 29.037 1.00 0.00 N ATOM 1829 CZ ARG A 109 11.682 -9.168 30.152 1.00 0.00 C ATOM 1830 NH1 ARG A 109 10.641 -8.353 30.238 1.00 0.00 N ATOM 1831 NH2 ARG A 109 12.507 -9.295 31.184 1.00 0.00 N ATOM 0 H ARG A 109 13.834 -11.622 24.524 1.00 0.00 H new ATOM 0 HA ARG A 109 12.051 -9.458 24.456 1.00 0.00 H new ATOM 0 HB2 ARG A 109 13.689 -10.926 26.458 1.00 0.00 H new ATOM 0 HB3 ARG A 109 13.264 -9.288 26.912 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.906 -10.533 25.852 1.00 0.00 H new ATOM 0 HG3 ARG A 109 11.634 -11.650 26.990 1.00 0.00 H new ATOM 0 HD2 ARG A 109 10.950 -8.735 27.548 1.00 0.00 H new ATOM 0 HD3 ARG A 109 10.043 -10.125 28.111 1.00 0.00 H new ATOM 0 HE ARG A 109 12.711 -10.476 29.003 1.00 0.00 H new ATOM 0 HH11 ARG A 109 10.005 -8.253 29.447 1.00 0.00 H new ATOM 0 HH12 ARG A 109 10.476 -7.826 31.095 1.00 0.00 H new ATOM 0 HH21 ARG A 109 13.309 -9.922 31.121 1.00 0.00 H new ATOM 0 HH22 ARG A 109 12.339 -8.766 32.040 1.00 0.00 H new ATOM 1845 N LYS A 110 15.222 -8.619 24.914 1.00 0.00 N ATOM 1846 CA LYS A 110 16.164 -7.510 24.823 1.00 0.00 C ATOM 1847 C LYS A 110 16.563 -7.253 23.373 1.00 0.00 C ATOM 1848 O LYS A 110 16.981 -6.151 23.020 1.00 0.00 O ATOM 1849 CB LYS A 110 17.410 -7.801 25.662 1.00 0.00 C ATOM 1850 CG LYS A 110 18.176 -6.554 26.068 1.00 0.00 C ATOM 1851 CD LYS A 110 19.677 -6.767 25.977 1.00 0.00 C ATOM 1852 CE LYS A 110 20.211 -7.506 27.194 1.00 0.00 C ATOM 1853 NZ LYS A 110 20.837 -6.579 28.176 1.00 0.00 N ATOM 0 H LYS A 110 15.646 -9.512 25.165 1.00 0.00 H new ATOM 0 HA LYS A 110 15.674 -6.617 25.211 1.00 0.00 H new ATOM 0 HB2 LYS A 110 17.114 -8.344 26.560 1.00 0.00 H new ATOM 0 HB3 LYS A 110 18.073 -8.456 25.097 1.00 0.00 H new ATOM 0 HG2 LYS A 110 17.886 -5.723 25.425 1.00 0.00 H new ATOM 0 HG3 LYS A 110 17.908 -6.277 27.088 1.00 0.00 H new ATOM 0 HD2 LYS A 110 19.911 -7.333 25.075 1.00 0.00 H new ATOM 0 HD3 LYS A 110 20.177 -5.803 25.887 1.00 0.00 H new ATOM 0 HE2 LYS A 110 19.397 -8.049 27.675 1.00 0.00 H new ATOM 0 HE3 LYS A 110 20.944 -8.247 26.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 21.188 -7.122 28.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 21.630 -6.079 27.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 20.131 -5.887 28.499 1.00 0.00 H new ATOM 1867 N GLY A 111 16.430 -8.278 22.537 1.00 0.00 N ATOM 1868 CA GLY A 111 16.780 -8.142 21.135 1.00 0.00 C ATOM 1869 C GLY A 111 15.639 -7.590 20.304 1.00 0.00 C ATOM 1870 O GLY A 111 15.669 -6.431 19.889 1.00 0.00 O ATOM 0 H GLY A 111 16.086 -9.200 22.805 1.00 0.00 H new ATOM 0 HA2 GLY A 111 17.645 -7.485 21.042 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.075 -9.115 20.741 1.00 0.00 H new TER 1874 GLY A 111