USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 907 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 ASN : amide:sc= 1.47 K(o=2.7,f=-5.1!) USER MOD Set 1.2: A 71 THR OG1 : rot 68:sc= 1.2 USER MOD Set 2.1: A 37 CYS SG : rot 171:sc= 0.219 USER MOD Set 2.2: A 40 CYS SG : rot 84:sc= -0.293 USER MOD Set 3.1: A 35 THR OG1 : rot 180:sc= 0.716 USER MOD Set 3.2: A 41 LYS NZ :NH3+ 154:sc= 0.81 (180deg=0.0689) USER MOD Set 4.1: A 26 LYS NZ :NH3+ 159:sc= 1.43 (180deg=0.504) USER MOD Set 4.2: A 59 THR OG1 : rot 180:sc= 1.03 USER MOD Set 5.1: A 7 SER OG : rot -140:sc= 0.613 USER MOD Set 5.2: A 9 THR OG1 : rot 180:sc= 0.453 USER MOD Set 6.1: A 2 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 6 LYS NZ :NH3+ 160:sc= 1.84 (180deg=1.39) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -103:sc= 0.0102 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0.0259 USER MOD Single : A 11 LYS NZ :NH3+ 171:sc= 0.929 (180deg=0.699) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 66:sc= 0.923 USER MOD Single : A 24 SER OG : rot 88:sc= 1.04 USER MOD Single : A 25 ASN : amide:sc=-0.00069 K(o=-0.00069,f=-1.1) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 77:sc= 0.833 USER MOD Single : A 56 THR OG1 : rot 78:sc= 1.23 USER MOD Single : A 62 LYS NZ :NH3+ -162:sc= 1.29 (180deg=1.16) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 1.2 K(o=1.2,f=-0.48) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0.835 USER MOD Single : A 82 THR OG1 : rot 92:sc= 1.65 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.707 K(o=0.71,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.16) USER MOD Single : A 99 LYS NZ :NH3+ -143:sc= 1.27 (180deg=1.05) USER MOD Single : A 101 LYS NZ :NH3+ -155:sc= 2.43 (180deg=2.08) USER MOD Single : A 109 SER OG : rot 93:sc= 1.2 USER MOD Single : A 114 ASN : amide:sc= 1.09 K(o=1.1,f=-0.63) USER MOD Single : A 116 ASN : amide:sc= -0.0478 X(o=-0.048,f=-0.032) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.205 -13.061 19.471 1.00 0.00 N ATOM 2 CA MET A 1 13.290 -11.935 19.144 1.00 0.00 C ATOM 3 C MET A 1 12.301 -11.701 20.288 1.00 0.00 C ATOM 4 O MET A 1 11.794 -12.659 20.873 1.00 0.00 O ATOM 5 CB MET A 1 12.564 -12.178 17.802 1.00 0.00 C ATOM 6 CG MET A 1 11.678 -11.005 17.357 1.00 0.00 C ATOM 7 SD MET A 1 12.494 -9.383 17.262 1.00 0.00 S ATOM 8 CE MET A 1 13.557 -9.622 15.810 1.00 0.00 C ATOM 0 H1 MET A 1 15.131 -12.684 19.756 1.00 0.00 H new ATOM 0 H2 MET A 1 13.803 -13.619 20.251 1.00 0.00 H new ATOM 0 H3 MET A 1 14.321 -13.668 18.635 1.00 0.00 H new ATOM 0 HA MET A 1 13.886 -11.030 19.026 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.306 -12.375 17.028 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.949 -13.074 17.889 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.264 -11.240 16.376 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.838 -10.927 18.047 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.125 -8.711 15.621 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.245 -10.447 15.995 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.940 -9.852 14.941 1.00 0.00 H new ATOM 19 N THR A 2 12.015 -10.437 20.620 1.00 0.00 N ATOM 20 CA THR A 2 11.070 -10.050 21.689 1.00 0.00 C ATOM 21 C THR A 2 9.606 -10.166 21.250 1.00 0.00 C ATOM 22 O THR A 2 9.263 -9.864 20.102 1.00 0.00 O ATOM 23 CB THR A 2 11.346 -8.622 22.191 1.00 0.00 C ATOM 24 OG1 THR A 2 11.365 -7.711 21.109 1.00 0.00 O ATOM 25 CG2 THR A 2 12.696 -8.519 22.900 1.00 0.00 C ATOM 0 H THR A 2 12.437 -9.637 20.149 1.00 0.00 H new ATOM 0 HA THR A 2 11.233 -10.755 22.504 1.00 0.00 H new ATOM 0 HB THR A 2 10.546 -8.380 22.891 1.00 0.00 H new ATOM 0 HG1 THR A 2 11.540 -6.807 21.445 1.00 0.00 H new ATOM 0 HG21 THR A 2 12.852 -7.495 23.239 1.00 0.00 H new ATOM 0 HG22 THR A 2 12.708 -9.191 23.758 1.00 0.00 H new ATOM 0 HG23 THR A 2 13.492 -8.798 22.209 1.00 0.00 H new ATOM 33 N ASP A 3 8.724 -10.563 22.171 1.00 0.00 N ATOM 34 CA ASP A 3 7.276 -10.672 21.947 1.00 0.00 C ATOM 35 C ASP A 3 6.594 -9.292 22.044 1.00 0.00 C ATOM 36 O ASP A 3 6.140 -8.869 23.111 1.00 0.00 O ATOM 37 CB ASP A 3 6.692 -11.703 22.928 1.00 0.00 C ATOM 38 CG ASP A 3 5.172 -11.889 22.760 1.00 0.00 C ATOM 39 OD1 ASP A 3 4.681 -11.909 21.605 1.00 0.00 O ATOM 40 OD2 ASP A 3 4.463 -12.050 23.782 1.00 0.00 O ATOM 0 H ASP A 3 9.002 -10.824 23.117 1.00 0.00 H new ATOM 0 HA ASP A 3 7.082 -11.026 20.935 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.190 -12.661 22.780 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.905 -11.388 23.949 1.00 0.00 H new ATOM 45 N SER A 4 6.577 -8.565 20.922 1.00 0.00 N ATOM 46 CA SER A 4 6.029 -7.206 20.788 1.00 0.00 C ATOM 47 C SER A 4 5.558 -6.935 19.346 1.00 0.00 C ATOM 48 O SER A 4 5.656 -7.800 18.474 1.00 0.00 O ATOM 49 CB SER A 4 7.099 -6.192 21.228 1.00 0.00 C ATOM 50 OG SER A 4 6.529 -4.906 21.424 1.00 0.00 O ATOM 0 H SER A 4 6.960 -8.919 20.045 1.00 0.00 H new ATOM 0 HA SER A 4 5.154 -7.104 21.430 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.569 -6.531 22.152 1.00 0.00 H new ATOM 0 HB3 SER A 4 7.884 -6.135 20.474 1.00 0.00 H new ATOM 0 HG SER A 4 7.227 -4.278 21.705 1.00 0.00 H new ATOM 56 N GLU A 5 5.052 -5.734 19.072 1.00 0.00 N ATOM 57 CA GLU A 5 4.587 -5.286 17.756 1.00 0.00 C ATOM 58 C GLU A 5 5.782 -4.999 16.821 1.00 0.00 C ATOM 59 O GLU A 5 6.468 -3.980 16.938 1.00 0.00 O ATOM 60 CB GLU A 5 3.660 -4.074 17.953 1.00 0.00 C ATOM 61 CG GLU A 5 3.007 -3.599 16.664 1.00 0.00 C ATOM 62 CD GLU A 5 1.943 -2.517 16.939 1.00 0.00 C ATOM 63 OE1 GLU A 5 2.309 -1.346 17.212 1.00 0.00 O ATOM 64 OE2 GLU A 5 0.729 -2.831 16.892 1.00 0.00 O ATOM 0 H GLU A 5 4.950 -5.015 19.789 1.00 0.00 H new ATOM 0 HA GLU A 5 4.013 -6.070 17.262 1.00 0.00 H new ATOM 0 HB2 GLU A 5 2.883 -4.333 18.672 1.00 0.00 H new ATOM 0 HB3 GLU A 5 4.233 -3.254 18.385 1.00 0.00 H new ATOM 0 HG2 GLU A 5 3.769 -3.201 15.994 1.00 0.00 H new ATOM 0 HG3 GLU A 5 2.545 -4.445 16.155 1.00 0.00 H new ATOM 71 N LYS A 6 6.046 -5.935 15.901 1.00 0.00 N ATOM 72 CA LYS A 6 7.226 -5.946 15.004 1.00 0.00 C ATOM 73 C LYS A 6 7.142 -5.005 13.789 1.00 0.00 C ATOM 74 O LYS A 6 8.151 -4.805 13.111 1.00 0.00 O ATOM 75 CB LYS A 6 7.506 -7.387 14.519 1.00 0.00 C ATOM 76 CG LYS A 6 7.614 -8.503 15.577 1.00 0.00 C ATOM 77 CD LYS A 6 8.869 -8.500 16.465 1.00 0.00 C ATOM 78 CE LYS A 6 8.911 -7.366 17.498 1.00 0.00 C ATOM 79 NZ LYS A 6 9.986 -7.595 18.497 1.00 0.00 N ATOM 0 H LYS A 6 5.430 -6.734 15.749 1.00 0.00 H new ATOM 0 HA LYS A 6 8.045 -5.563 15.613 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.714 -7.664 13.823 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.438 -7.373 13.953 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.740 -8.442 16.225 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.564 -9.463 15.064 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.932 -9.454 16.988 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.750 -8.427 15.828 1.00 0.00 H new ATOM 0 HE2 LYS A 6 9.076 -6.415 16.992 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.948 -7.295 18.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.224 -6.696 18.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.658 -8.278 19.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.830 -7.971 18.019 1.00 0.00 H new ATOM 93 N SER A 7 5.964 -4.450 13.499 1.00 0.00 N ATOM 94 CA SER A 7 5.677 -3.629 12.308 1.00 0.00 C ATOM 95 C SER A 7 5.046 -2.271 12.648 1.00 0.00 C ATOM 96 O SER A 7 4.383 -2.117 13.676 1.00 0.00 O ATOM 97 CB SER A 7 4.762 -4.405 11.355 1.00 0.00 C ATOM 98 OG SER A 7 4.561 -3.658 10.171 1.00 0.00 O ATOM 0 H SER A 7 5.151 -4.560 14.105 1.00 0.00 H new ATOM 0 HA SER A 7 6.633 -3.419 11.829 1.00 0.00 H new ATOM 0 HB2 SER A 7 5.206 -5.371 11.116 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.805 -4.605 11.837 1.00 0.00 H new ATOM 0 HG SER A 7 3.629 -3.748 9.882 1.00 0.00 H new ATOM 104 N ALA A 8 5.213 -1.300 11.746 1.00 0.00 N ATOM 105 CA ALA A 8 4.569 0.015 11.776 1.00 0.00 C ATOM 106 C ALA A 8 3.432 0.167 10.731 1.00 0.00 C ATOM 107 O ALA A 8 2.985 1.287 10.465 1.00 0.00 O ATOM 108 CB ALA A 8 5.668 1.074 11.638 1.00 0.00 C ATOM 0 H ALA A 8 5.828 -1.414 10.940 1.00 0.00 H new ATOM 0 HA ALA A 8 4.054 0.147 12.728 1.00 0.00 H new ATOM 0 HB1 ALA A 8 5.220 2.068 11.657 1.00 0.00 H new ATOM 0 HB2 ALA A 8 6.372 0.978 12.465 1.00 0.00 H new ATOM 0 HB3 ALA A 8 6.195 0.931 10.694 1.00 0.00 H new ATOM 114 N THR A 9 2.950 -0.931 10.135 1.00 0.00 N ATOM 115 CA THR A 9 1.857 -0.920 9.140 1.00 0.00 C ATOM 116 C THR A 9 0.458 -0.897 9.772 1.00 0.00 C ATOM 117 O THR A 9 0.265 -1.318 10.918 1.00 0.00 O ATOM 118 CB THR A 9 1.940 -2.104 8.158 1.00 0.00 C ATOM 119 OG1 THR A 9 1.953 -3.339 8.844 1.00 0.00 O ATOM 120 CG2 THR A 9 3.189 -2.050 7.281 1.00 0.00 C ATOM 0 H THR A 9 3.309 -1.866 10.329 1.00 0.00 H new ATOM 0 HA THR A 9 2.001 0.011 8.593 1.00 0.00 H new ATOM 0 HB THR A 9 1.054 -2.024 7.529 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.005 -4.073 8.196 1.00 0.00 H new ATOM 0 HG21 THR A 9 3.198 -2.907 6.608 1.00 0.00 H new ATOM 0 HG22 THR A 9 3.184 -1.130 6.697 1.00 0.00 H new ATOM 0 HG23 THR A 9 4.078 -2.075 7.912 1.00 0.00 H new ATOM 128 N ILE A 10 -0.533 -0.425 9.007 1.00 0.00 N ATOM 129 CA ILE A 10 -1.972 -0.464 9.341 1.00 0.00 C ATOM 130 C ILE A 10 -2.758 -1.344 8.353 1.00 0.00 C ATOM 131 O ILE A 10 -2.341 -1.510 7.205 1.00 0.00 O ATOM 132 CB ILE A 10 -2.574 0.960 9.453 1.00 0.00 C ATOM 133 CG1 ILE A 10 -2.527 1.732 8.112 1.00 0.00 C ATOM 134 CG2 ILE A 10 -1.875 1.738 10.583 1.00 0.00 C ATOM 135 CD1 ILE A 10 -3.241 3.089 8.137 1.00 0.00 C ATOM 0 H ILE A 10 -0.354 0.012 8.103 1.00 0.00 H new ATOM 0 HA ILE A 10 -2.064 -0.925 10.324 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.630 0.857 9.701 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -1.485 1.889 7.833 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.976 1.113 7.335 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.303 2.738 10.656 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -2.017 1.213 11.528 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -0.809 1.815 10.367 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.159 3.561 7.158 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.293 2.942 8.382 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.779 3.729 8.888 1.00 0.00 H new ATOM 147 N LYS A 11 -3.908 -1.891 8.766 1.00 0.00 N ATOM 148 CA LYS A 11 -4.824 -2.668 7.903 1.00 0.00 C ATOM 149 C LYS A 11 -6.102 -1.870 7.622 1.00 0.00 C ATOM 150 O LYS A 11 -6.649 -1.255 8.539 1.00 0.00 O ATOM 151 CB LYS A 11 -5.132 -4.039 8.535 1.00 0.00 C ATOM 152 CG LYS A 11 -3.870 -4.908 8.702 1.00 0.00 C ATOM 153 CD LYS A 11 -4.152 -6.245 9.406 1.00 0.00 C ATOM 154 CE LYS A 11 -4.998 -7.238 8.593 1.00 0.00 C ATOM 155 NZ LYS A 11 -4.269 -7.751 7.405 1.00 0.00 N ATOM 0 H LYS A 11 -4.240 -1.808 9.727 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.335 -2.852 6.947 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.598 -3.890 9.509 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.854 -4.568 7.913 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.438 -5.104 7.721 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.126 -4.353 9.273 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.201 -6.717 9.652 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -4.661 -6.043 10.348 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.286 -8.074 9.230 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.918 -6.751 8.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -4.811 -8.526 6.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.150 -6.984 6.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -3.335 -8.103 7.696 1.00 0.00 H new ATOM 169 N VAL A 12 -6.571 -1.869 6.370 1.00 0.00 N ATOM 170 CA VAL A 12 -7.697 -1.036 5.894 1.00 0.00 C ATOM 171 C VAL A 12 -8.727 -1.833 5.085 1.00 0.00 C ATOM 172 O VAL A 12 -8.401 -2.859 4.487 1.00 0.00 O ATOM 173 CB VAL A 12 -7.206 0.201 5.105 1.00 0.00 C ATOM 174 CG1 VAL A 12 -6.222 1.032 5.938 1.00 0.00 C ATOM 175 CG2 VAL A 12 -6.532 -0.126 3.765 1.00 0.00 C ATOM 0 H VAL A 12 -6.174 -2.458 5.638 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.206 -0.681 6.790 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.116 0.762 4.890 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.893 1.895 5.359 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.714 1.373 6.849 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.359 0.420 6.199 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.219 0.799 3.280 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.660 -0.757 3.940 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.237 -0.653 3.122 1.00 0.00 H new ATOM 185 N THR A 13 -9.977 -1.357 5.067 1.00 0.00 N ATOM 186 CA THR A 13 -11.109 -1.901 4.288 1.00 0.00 C ATOM 187 C THR A 13 -11.994 -0.770 3.748 1.00 0.00 C ATOM 188 O THR A 13 -11.964 0.349 4.264 1.00 0.00 O ATOM 189 CB THR A 13 -11.980 -2.859 5.123 1.00 0.00 C ATOM 190 OG1 THR A 13 -12.512 -2.199 6.254 1.00 0.00 O ATOM 191 CG2 THR A 13 -11.220 -4.090 5.615 1.00 0.00 C ATOM 0 H THR A 13 -10.246 -0.543 5.620 1.00 0.00 H new ATOM 0 HA THR A 13 -10.674 -2.460 3.459 1.00 0.00 H new ATOM 0 HB THR A 13 -12.774 -3.187 4.452 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.063 -2.825 6.769 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.890 -4.723 6.196 1.00 0.00 H new ATOM 0 HG22 THR A 13 -10.842 -4.650 4.760 1.00 0.00 H new ATOM 0 HG23 THR A 13 -10.384 -3.776 6.241 1.00 0.00 H new ATOM 199 N ASP A 14 -12.817 -1.047 2.732 1.00 0.00 N ATOM 200 CA ASP A 14 -13.607 -0.042 1.998 1.00 0.00 C ATOM 201 C ASP A 14 -14.550 0.795 2.890 1.00 0.00 C ATOM 202 O ASP A 14 -14.813 1.963 2.598 1.00 0.00 O ATOM 203 CB ASP A 14 -14.420 -0.761 0.912 1.00 0.00 C ATOM 204 CG ASP A 14 -15.106 0.226 -0.044 1.00 0.00 C ATOM 205 OD1 ASP A 14 -14.395 0.903 -0.824 1.00 0.00 O ATOM 206 OD2 ASP A 14 -16.357 0.310 -0.031 1.00 0.00 O ATOM 0 H ASP A 14 -12.959 -1.996 2.386 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.901 0.669 1.568 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -13.763 -1.419 0.343 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -15.174 -1.393 1.382 1.00 0.00 H new ATOM 211 N ALA A 15 -15.014 0.225 4.007 1.00 0.00 N ATOM 212 CA ALA A 15 -15.905 0.882 4.967 1.00 0.00 C ATOM 213 C ALA A 15 -15.225 1.995 5.800 1.00 0.00 C ATOM 214 O ALA A 15 -15.921 2.834 6.382 1.00 0.00 O ATOM 215 CB ALA A 15 -16.498 -0.206 5.871 1.00 0.00 C ATOM 0 H ALA A 15 -14.774 -0.730 4.274 1.00 0.00 H new ATOM 0 HA ALA A 15 -16.685 1.400 4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.168 0.251 6.599 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.055 -0.920 5.264 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -15.693 -0.724 6.393 1.00 0.00 H new ATOM 221 N SER A 16 -13.886 2.024 5.848 1.00 0.00 N ATOM 222 CA SER A 16 -13.082 2.958 6.659 1.00 0.00 C ATOM 223 C SER A 16 -11.883 3.554 5.902 1.00 0.00 C ATOM 224 O SER A 16 -11.120 4.329 6.476 1.00 0.00 O ATOM 225 CB SER A 16 -12.597 2.261 7.939 1.00 0.00 C ATOM 226 OG SER A 16 -13.683 1.754 8.708 1.00 0.00 O ATOM 0 H SER A 16 -13.311 1.378 5.307 1.00 0.00 H new ATOM 0 HA SER A 16 -13.738 3.792 6.908 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.925 1.444 7.676 1.00 0.00 H new ATOM 0 HB3 SER A 16 -12.022 2.965 8.541 1.00 0.00 H new ATOM 0 HG SER A 16 -13.337 1.316 9.514 1.00 0.00 H new ATOM 232 N PHE A 17 -11.716 3.242 4.609 1.00 0.00 N ATOM 233 CA PHE A 17 -10.561 3.629 3.789 1.00 0.00 C ATOM 234 C PHE A 17 -10.334 5.146 3.772 1.00 0.00 C ATOM 235 O PHE A 17 -9.201 5.608 3.890 1.00 0.00 O ATOM 236 CB PHE A 17 -10.764 3.084 2.367 1.00 0.00 C ATOM 237 CG PHE A 17 -9.526 3.127 1.488 1.00 0.00 C ATOM 238 CD1 PHE A 17 -9.167 4.308 0.810 1.00 0.00 C ATOM 239 CD2 PHE A 17 -8.747 1.966 1.324 1.00 0.00 C ATOM 240 CE1 PHE A 17 -8.043 4.324 -0.035 1.00 0.00 C ATOM 241 CE2 PHE A 17 -7.631 1.980 0.470 1.00 0.00 C ATOM 242 CZ PHE A 17 -7.280 3.157 -0.212 1.00 0.00 C ATOM 0 H PHE A 17 -12.403 2.696 4.089 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.663 3.197 4.230 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -11.110 2.052 2.434 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -11.556 3.655 1.883 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.756 5.204 0.939 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -9.008 1.063 1.856 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.766 5.233 -0.548 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.042 1.084 0.338 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.425 3.165 -0.872 1.00 0.00 H new ATOM 252 N ALA A 18 -11.403 5.942 3.689 1.00 0.00 N ATOM 253 CA ALA A 18 -11.294 7.399 3.727 1.00 0.00 C ATOM 254 C ALA A 18 -10.795 7.932 5.086 1.00 0.00 C ATOM 255 O ALA A 18 -10.043 8.906 5.127 1.00 0.00 O ATOM 256 CB ALA A 18 -12.644 8.004 3.328 1.00 0.00 C ATOM 0 H ALA A 18 -12.358 5.597 3.595 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.533 7.708 3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.577 9.092 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.905 7.679 2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.412 7.672 4.027 1.00 0.00 H new ATOM 262 N THR A 19 -11.167 7.285 6.194 1.00 0.00 N ATOM 263 CA THR A 19 -10.727 7.640 7.557 1.00 0.00 C ATOM 264 C THR A 19 -9.318 7.126 7.881 1.00 0.00 C ATOM 265 O THR A 19 -8.598 7.748 8.662 1.00 0.00 O ATOM 266 CB THR A 19 -11.731 7.106 8.597 1.00 0.00 C ATOM 267 OG1 THR A 19 -13.061 7.388 8.198 1.00 0.00 O ATOM 268 CG2 THR A 19 -11.550 7.732 9.982 1.00 0.00 C ATOM 0 H THR A 19 -11.796 6.482 6.174 1.00 0.00 H new ATOM 0 HA THR A 19 -10.690 8.728 7.601 1.00 0.00 H new ATOM 0 HB THR A 19 -11.541 6.034 8.655 1.00 0.00 H new ATOM 0 HG1 THR A 19 -13.685 7.040 8.869 1.00 0.00 H new ATOM 0 HG21 THR A 19 -12.286 7.315 10.669 1.00 0.00 H new ATOM 0 HG22 THR A 19 -10.547 7.516 10.350 1.00 0.00 H new ATOM 0 HG23 THR A 19 -11.688 8.811 9.914 1.00 0.00 H new ATOM 276 N ASP A 20 -8.896 6.007 7.284 1.00 0.00 N ATOM 277 CA ASP A 20 -7.605 5.368 7.582 1.00 0.00 C ATOM 278 C ASP A 20 -6.480 5.790 6.622 1.00 0.00 C ATOM 279 O ASP A 20 -5.344 5.992 7.054 1.00 0.00 O ATOM 280 CB ASP A 20 -7.754 3.841 7.568 1.00 0.00 C ATOM 281 CG ASP A 20 -8.650 3.275 8.685 1.00 0.00 C ATOM 282 OD1 ASP A 20 -8.662 3.828 9.812 1.00 0.00 O ATOM 283 OD2 ASP A 20 -9.300 2.231 8.450 1.00 0.00 O ATOM 0 H ASP A 20 -9.441 5.515 6.576 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.316 5.709 8.576 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.162 3.538 6.604 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.764 3.392 7.651 1.00 0.00 H new ATOM 288 N VAL A 21 -6.790 5.930 5.329 1.00 0.00 N ATOM 289 CA VAL A 21 -5.855 6.348 4.274 1.00 0.00 C ATOM 290 C VAL A 21 -6.006 7.846 4.010 1.00 0.00 C ATOM 291 O VAL A 21 -5.096 8.623 4.298 1.00 0.00 O ATOM 292 CB VAL A 21 -6.046 5.514 2.983 1.00 0.00 C ATOM 293 CG1 VAL A 21 -4.987 5.823 1.924 1.00 0.00 C ATOM 294 CG2 VAL A 21 -5.986 4.008 3.280 1.00 0.00 C ATOM 0 H VAL A 21 -7.729 5.750 4.974 1.00 0.00 H new ATOM 0 HA VAL A 21 -4.837 6.161 4.617 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.028 5.789 2.599 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.167 5.211 1.040 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -5.040 6.877 1.653 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -3.997 5.601 2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -6.123 3.449 2.354 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.017 3.761 3.713 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.775 3.744 3.984 1.00 0.00 H new ATOM 304 N LEU A 22 -7.167 8.279 3.514 1.00 0.00 N ATOM 305 CA LEU A 22 -7.320 9.622 2.928 1.00 0.00 C ATOM 306 C LEU A 22 -7.343 10.764 3.964 1.00 0.00 C ATOM 307 O LEU A 22 -7.149 11.924 3.597 1.00 0.00 O ATOM 308 CB LEU A 22 -8.540 9.671 1.986 1.00 0.00 C ATOM 309 CG LEU A 22 -8.630 8.532 0.950 1.00 0.00 C ATOM 310 CD1 LEU A 22 -9.879 8.701 0.088 1.00 0.00 C ATOM 311 CD2 LEU A 22 -7.418 8.447 0.024 1.00 0.00 C ATOM 0 H LEU A 22 -8.020 7.721 3.504 1.00 0.00 H new ATOM 0 HA LEU A 22 -6.420 9.801 2.340 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.445 9.658 2.593 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -8.527 10.622 1.453 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.669 7.610 1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -9.931 7.891 -0.639 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -10.765 8.677 0.722 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.833 9.656 -0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.553 7.623 -0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.316 9.381 -0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.519 8.276 0.616 1.00 0.00 H new ATOM 323 N SER A 23 -7.526 10.447 5.250 1.00 0.00 N ATOM 324 CA SER A 23 -7.494 11.411 6.363 1.00 0.00 C ATOM 325 C SER A 23 -6.078 11.699 6.903 1.00 0.00 C ATOM 326 O SER A 23 -5.924 12.526 7.805 1.00 0.00 O ATOM 327 CB SER A 23 -8.430 10.972 7.490 1.00 0.00 C ATOM 328 OG SER A 23 -9.772 10.985 7.035 1.00 0.00 O ATOM 0 H SER A 23 -7.705 9.491 5.557 1.00 0.00 H new ATOM 0 HA SER A 23 -7.849 12.355 5.949 1.00 0.00 H new ATOM 0 HB2 SER A 23 -8.161 9.971 7.829 1.00 0.00 H new ATOM 0 HB3 SER A 23 -8.320 11.638 8.346 1.00 0.00 H new ATOM 0 HG SER A 23 -9.891 10.297 6.347 1.00 0.00 H new ATOM 334 N SER A 24 -5.039 11.022 6.393 1.00 0.00 N ATOM 335 CA SER A 24 -3.651 11.140 6.855 1.00 0.00 C ATOM 336 C SER A 24 -3.074 12.558 6.712 1.00 0.00 C ATOM 337 O SER A 24 -3.304 13.241 5.711 1.00 0.00 O ATOM 338 CB SER A 24 -2.771 10.165 6.065 1.00 0.00 C ATOM 339 OG SER A 24 -3.159 8.821 6.282 1.00 0.00 O ATOM 0 H SER A 24 -5.146 10.359 5.626 1.00 0.00 H new ATOM 0 HA SER A 24 -3.655 10.903 7.919 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.835 10.396 5.002 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.729 10.295 6.357 1.00 0.00 H new ATOM 0 HG SER A 24 -3.851 8.572 5.635 1.00 0.00 H new ATOM 345 N ASN A 25 -2.268 12.983 7.692 1.00 0.00 N ATOM 346 CA ASN A 25 -1.569 14.281 7.703 1.00 0.00 C ATOM 347 C ASN A 25 -0.241 14.294 6.905 1.00 0.00 C ATOM 348 O ASN A 25 0.394 15.343 6.771 1.00 0.00 O ATOM 349 CB ASN A 25 -1.388 14.750 9.163 1.00 0.00 C ATOM 350 CG ASN A 25 -0.401 13.934 9.990 1.00 0.00 C ATOM 351 OD1 ASN A 25 0.047 12.857 9.621 1.00 0.00 O ATOM 352 ND2 ASN A 25 -0.043 14.414 11.158 1.00 0.00 N ATOM 0 H ASN A 25 -2.077 12.422 8.522 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.198 14.995 7.171 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.059 15.789 9.156 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -2.359 14.726 9.658 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.603 13.890 11.748 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.411 15.311 11.475 1.00 0.00 H new ATOM 359 N LYS A 26 0.168 13.137 6.372 1.00 0.00 N ATOM 360 CA LYS A 26 1.341 12.903 5.511 1.00 0.00 C ATOM 361 C LYS A 26 1.005 11.883 4.403 1.00 0.00 C ATOM 362 O LYS A 26 -0.009 11.189 4.535 1.00 0.00 O ATOM 363 CB LYS A 26 2.544 12.480 6.385 1.00 0.00 C ATOM 364 CG LYS A 26 2.350 11.189 7.206 1.00 0.00 C ATOM 365 CD LYS A 26 3.528 10.993 8.176 1.00 0.00 C ATOM 366 CE LYS A 26 3.218 9.985 9.291 1.00 0.00 C ATOM 367 NZ LYS A 26 3.335 8.576 8.849 1.00 0.00 N ATOM 0 H LYS A 26 -0.348 12.274 6.542 1.00 0.00 H new ATOM 0 HA LYS A 26 1.620 13.824 4.999 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.412 12.351 5.739 1.00 0.00 H new ATOM 0 HB3 LYS A 26 2.776 13.294 7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 26 1.415 11.241 7.764 1.00 0.00 H new ATOM 0 HG3 LYS A 26 2.274 10.332 6.537 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.400 10.653 7.617 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.789 11.953 8.622 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.898 10.155 10.126 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.208 10.161 9.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 3.469 7.962 9.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.468 8.296 8.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 4.150 8.479 8.211 1.00 0.00 H new ATOM 381 N PRO A 27 1.805 11.778 3.324 1.00 0.00 N ATOM 382 CA PRO A 27 1.581 10.806 2.249 1.00 0.00 C ATOM 383 C PRO A 27 1.451 9.364 2.766 1.00 0.00 C ATOM 384 O PRO A 27 2.077 8.983 3.757 1.00 0.00 O ATOM 385 CB PRO A 27 2.777 10.959 1.302 1.00 0.00 C ATOM 386 CG PRO A 27 3.188 12.417 1.500 1.00 0.00 C ATOM 387 CD PRO A 27 2.941 12.629 2.991 1.00 0.00 C ATOM 0 HA PRO A 27 0.635 11.002 1.745 1.00 0.00 H new ATOM 0 HB2 PRO A 27 3.585 10.274 1.558 1.00 0.00 H new ATOM 0 HB3 PRO A 27 2.501 10.754 0.267 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.232 12.584 1.234 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.591 13.094 0.889 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.819 12.357 3.577 1.00 0.00 H new ATOM 0 HD3 PRO A 27 2.724 13.675 3.208 1.00 0.00 H new ATOM 395 N VAL A 28 0.633 8.551 2.098 1.00 0.00 N ATOM 396 CA VAL A 28 0.290 7.185 2.515 1.00 0.00 C ATOM 397 C VAL A 28 0.318 6.210 1.337 1.00 0.00 C ATOM 398 O VAL A 28 -0.214 6.476 0.260 1.00 0.00 O ATOM 399 CB VAL A 28 -1.038 7.164 3.298 1.00 0.00 C ATOM 400 CG1 VAL A 28 -2.200 7.769 2.510 1.00 0.00 C ATOM 401 CG2 VAL A 28 -1.439 5.751 3.749 1.00 0.00 C ATOM 0 H VAL A 28 0.177 8.828 1.229 1.00 0.00 H new ATOM 0 HA VAL A 28 1.058 6.833 3.204 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.846 7.779 4.177 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -3.108 7.727 3.111 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.973 8.807 2.267 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.348 7.205 1.589 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.381 5.797 4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.557 5.110 2.875 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.664 5.342 4.397 1.00 0.00 H new ATOM 411 N LEU A 29 0.959 5.064 1.559 1.00 0.00 N ATOM 412 CA LEU A 29 1.195 3.993 0.598 1.00 0.00 C ATOM 413 C LEU A 29 0.334 2.787 0.995 1.00 0.00 C ATOM 414 O LEU A 29 0.537 2.221 2.068 1.00 0.00 O ATOM 415 CB LEU A 29 2.704 3.683 0.651 1.00 0.00 C ATOM 416 CG LEU A 29 3.297 2.874 -0.514 1.00 0.00 C ATOM 417 CD1 LEU A 29 4.694 2.415 -0.101 1.00 0.00 C ATOM 418 CD2 LEU A 29 2.514 1.617 -0.899 1.00 0.00 C ATOM 0 H LEU A 29 1.352 4.847 2.475 1.00 0.00 H new ATOM 0 HA LEU A 29 0.921 4.264 -0.422 1.00 0.00 H new ATOM 0 HB2 LEU A 29 3.241 4.629 0.713 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.905 3.141 1.575 1.00 0.00 H new ATOM 0 HG LEU A 29 3.278 3.537 -1.379 1.00 0.00 H new ATOM 0 HD11 LEU A 29 5.141 1.837 -0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 29 5.316 3.285 0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 29 4.624 1.795 0.793 1.00 0.00 H new ATOM 0 HD21 LEU A 29 3.013 1.118 -1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 29 2.467 0.942 -0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.503 1.895 -1.198 1.00 0.00 H new ATOM 430 N VAL A 30 -0.611 2.376 0.149 1.00 0.00 N ATOM 431 CA VAL A 30 -1.466 1.204 0.388 1.00 0.00 C ATOM 432 C VAL A 30 -1.065 0.055 -0.536 1.00 0.00 C ATOM 433 O VAL A 30 -1.009 0.220 -1.753 1.00 0.00 O ATOM 434 CB VAL A 30 -2.962 1.527 0.227 1.00 0.00 C ATOM 435 CG1 VAL A 30 -3.811 0.410 0.852 1.00 0.00 C ATOM 436 CG2 VAL A 30 -3.385 2.858 0.858 1.00 0.00 C ATOM 0 H VAL A 30 -0.810 2.850 -0.732 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.314 0.901 1.424 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.129 1.607 -0.847 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.868 0.647 0.733 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.593 -0.535 0.354 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.575 0.324 1.913 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.453 3.012 0.701 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.175 2.837 1.927 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.829 3.673 0.395 1.00 0.00 H new ATOM 446 N ASP A 31 -0.814 -1.122 0.034 1.00 0.00 N ATOM 447 CA ASP A 31 -0.515 -2.359 -0.690 1.00 0.00 C ATOM 448 C ASP A 31 -1.724 -3.310 -0.688 1.00 0.00 C ATOM 449 O ASP A 31 -2.184 -3.763 0.364 1.00 0.00 O ATOM 450 CB ASP A 31 0.757 -2.981 -0.103 1.00 0.00 C ATOM 451 CG ASP A 31 0.992 -4.428 -0.561 1.00 0.00 C ATOM 452 OD1 ASP A 31 0.897 -4.707 -1.777 1.00 0.00 O ATOM 453 OD2 ASP A 31 1.278 -5.277 0.315 1.00 0.00 O ATOM 0 H ASP A 31 -0.813 -1.246 1.046 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.323 -2.145 -1.741 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.616 -2.373 -0.388 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.696 -2.957 0.985 1.00 0.00 H new ATOM 458 N PHE A 32 -2.247 -3.589 -1.882 1.00 0.00 N ATOM 459 CA PHE A 32 -3.401 -4.446 -2.141 1.00 0.00 C ATOM 460 C PHE A 32 -2.887 -5.870 -2.387 1.00 0.00 C ATOM 461 O PHE A 32 -2.266 -6.149 -3.420 1.00 0.00 O ATOM 462 CB PHE A 32 -4.195 -3.906 -3.344 1.00 0.00 C ATOM 463 CG PHE A 32 -5.028 -2.647 -3.118 1.00 0.00 C ATOM 464 CD1 PHE A 32 -4.465 -1.473 -2.572 1.00 0.00 C ATOM 465 CD2 PHE A 32 -6.379 -2.632 -3.519 1.00 0.00 C ATOM 466 CE1 PHE A 32 -5.247 -0.318 -2.414 1.00 0.00 C ATOM 467 CE2 PHE A 32 -7.148 -1.460 -3.388 1.00 0.00 C ATOM 468 CZ PHE A 32 -6.578 -0.299 -2.846 1.00 0.00 C ATOM 0 H PHE A 32 -1.855 -3.202 -2.740 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.080 -4.456 -1.289 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.491 -3.705 -4.152 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.862 -4.695 -3.691 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -3.427 -1.464 -2.274 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.827 -3.525 -3.929 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.819 0.561 -1.956 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -8.180 -1.455 -3.706 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.163 0.605 -2.762 1.00 0.00 H new ATOM 478 N TRP A 33 -3.107 -6.752 -1.412 1.00 0.00 N ATOM 479 CA TRP A 33 -2.343 -7.991 -1.246 1.00 0.00 C ATOM 480 C TRP A 33 -3.186 -9.171 -0.745 1.00 0.00 C ATOM 481 O TRP A 33 -4.269 -8.990 -0.185 1.00 0.00 O ATOM 482 CB TRP A 33 -1.185 -7.720 -0.266 1.00 0.00 C ATOM 483 CG TRP A 33 -1.532 -7.916 1.181 1.00 0.00 C ATOM 484 CD1 TRP A 33 -2.378 -7.139 1.891 1.00 0.00 C ATOM 485 CD2 TRP A 33 -1.156 -9.014 2.072 1.00 0.00 C ATOM 486 NE1 TRP A 33 -2.607 -7.709 3.126 1.00 0.00 N ATOM 487 CE2 TRP A 33 -1.874 -8.863 3.297 1.00 0.00 C ATOM 488 CE3 TRP A 33 -0.300 -10.132 1.964 1.00 0.00 C ATOM 489 CZ2 TRP A 33 -1.763 -9.781 4.350 1.00 0.00 C ATOM 490 CZ3 TRP A 33 -0.166 -11.050 3.023 1.00 0.00 C ATOM 491 CH2 TRP A 33 -0.900 -10.882 4.212 1.00 0.00 C ATOM 0 H TRP A 33 -3.831 -6.625 -0.705 1.00 0.00 H new ATOM 0 HA TRP A 33 -1.973 -8.283 -2.229 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.352 -8.376 -0.518 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.839 -6.696 -0.408 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -2.810 -6.212 1.544 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -3.241 -7.324 3.826 1.00 0.00 H new ATOM 0 HE3 TRP A 33 0.261 -10.285 1.054 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.334 -9.644 5.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 0.505 -11.890 2.922 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -0.801 -11.597 5.016 1.00 0.00 H new ATOM 502 N ALA A 34 -2.649 -10.386 -0.874 1.00 0.00 N ATOM 503 CA ALA A 34 -3.109 -11.563 -0.137 1.00 0.00 C ATOM 504 C ALA A 34 -1.954 -12.536 0.140 1.00 0.00 C ATOM 505 O ALA A 34 -1.009 -12.634 -0.644 1.00 0.00 O ATOM 506 CB ALA A 34 -4.229 -12.253 -0.921 1.00 0.00 C ATOM 0 H ALA A 34 -1.870 -10.582 -1.503 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.497 -11.240 0.829 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.571 -13.130 -0.371 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -5.060 -11.561 -1.053 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.854 -12.560 -1.897 1.00 0.00 H new ATOM 512 N THR A 35 -2.053 -13.308 1.228 1.00 0.00 N ATOM 513 CA THR A 35 -1.024 -14.294 1.617 1.00 0.00 C ATOM 514 C THR A 35 -0.892 -15.461 0.626 1.00 0.00 C ATOM 515 O THR A 35 0.166 -16.088 0.542 1.00 0.00 O ATOM 516 CB THR A 35 -1.263 -14.785 3.055 1.00 0.00 C ATOM 517 OG1 THR A 35 -0.130 -15.493 3.510 1.00 0.00 O ATOM 518 CG2 THR A 35 -2.482 -15.696 3.211 1.00 0.00 C ATOM 0 H THR A 35 -2.847 -13.271 1.867 1.00 0.00 H new ATOM 0 HA THR A 35 -0.064 -13.779 1.584 1.00 0.00 H new ATOM 0 HB THR A 35 -1.449 -13.887 3.644 1.00 0.00 H new ATOM 0 HG1 THR A 35 -0.284 -15.803 4.427 1.00 0.00 H new ATOM 0 HG21 THR A 35 -2.580 -15.998 4.254 1.00 0.00 H new ATOM 0 HG22 THR A 35 -3.379 -15.159 2.903 1.00 0.00 H new ATOM 0 HG23 THR A 35 -2.357 -16.581 2.587 1.00 0.00 H new ATOM 526 N TRP A 36 -1.928 -15.713 -0.185 1.00 0.00 N ATOM 527 CA TRP A 36 -1.907 -16.705 -1.268 1.00 0.00 C ATOM 528 C TRP A 36 -1.119 -16.264 -2.517 1.00 0.00 C ATOM 529 O TRP A 36 -0.886 -17.083 -3.409 1.00 0.00 O ATOM 530 CB TRP A 36 -3.346 -17.139 -1.603 1.00 0.00 C ATOM 531 CG TRP A 36 -4.382 -16.086 -1.902 1.00 0.00 C ATOM 532 CD1 TRP A 36 -5.432 -15.796 -1.096 1.00 0.00 C ATOM 533 CD2 TRP A 36 -4.566 -15.238 -3.088 1.00 0.00 C ATOM 534 NE1 TRP A 36 -6.278 -14.906 -1.715 1.00 0.00 N ATOM 535 CE2 TRP A 36 -5.785 -14.503 -2.932 1.00 0.00 C ATOM 536 CE3 TRP A 36 -3.846 -15.013 -4.285 1.00 0.00 C ATOM 537 CZ2 TRP A 36 -6.262 -13.607 -3.898 1.00 0.00 C ATOM 538 CZ3 TRP A 36 -4.300 -14.090 -5.250 1.00 0.00 C ATOM 539 CH2 TRP A 36 -5.509 -13.398 -5.062 1.00 0.00 C ATOM 0 H TRP A 36 -2.820 -15.225 -0.105 1.00 0.00 H new ATOM 0 HA TRP A 36 -1.352 -17.567 -0.899 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -3.296 -17.804 -2.466 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -3.713 -17.732 -0.765 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -5.583 -16.206 -0.108 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.162 -14.585 -1.320 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -2.931 -15.559 -4.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -7.196 -13.085 -3.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -3.714 -13.914 -6.140 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -5.858 -12.706 -5.814 1.00 0.00 H new ATOM 550 N CYS A 37 -0.687 -15.001 -2.593 1.00 0.00 N ATOM 551 CA CYS A 37 0.087 -14.458 -3.709 1.00 0.00 C ATOM 552 C CYS A 37 1.588 -14.395 -3.359 1.00 0.00 C ATOM 553 O CYS A 37 2.002 -13.662 -2.458 1.00 0.00 O ATOM 554 CB CYS A 37 -0.523 -13.099 -4.076 1.00 0.00 C ATOM 555 SG CYS A 37 0.312 -12.385 -5.521 1.00 0.00 S ATOM 0 H CYS A 37 -0.871 -14.314 -1.862 1.00 0.00 H new ATOM 0 HA CYS A 37 0.033 -15.106 -4.584 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.586 -13.218 -4.287 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.440 -12.418 -3.229 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.342 -11.337 -5.926 1.00 0.00 H new ATOM 561 N GLY A 38 2.424 -15.149 -4.083 1.00 0.00 N ATOM 562 CA GLY A 38 3.880 -15.182 -3.875 1.00 0.00 C ATOM 563 C GLY A 38 4.576 -13.826 -4.097 1.00 0.00 C ATOM 564 O GLY A 38 5.357 -13.413 -3.240 1.00 0.00 O ATOM 0 H GLY A 38 2.108 -15.759 -4.837 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.084 -15.521 -2.859 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.317 -15.918 -4.551 1.00 0.00 H new ATOM 568 N PRO A 39 4.253 -13.068 -5.163 1.00 0.00 N ATOM 569 CA PRO A 39 4.703 -11.683 -5.319 1.00 0.00 C ATOM 570 C PRO A 39 4.301 -10.760 -4.153 1.00 0.00 C ATOM 571 O PRO A 39 5.129 -9.974 -3.691 1.00 0.00 O ATOM 572 CB PRO A 39 4.109 -11.226 -6.652 1.00 0.00 C ATOM 573 CG PRO A 39 4.049 -12.516 -7.466 1.00 0.00 C ATOM 574 CD PRO A 39 3.680 -13.557 -6.410 1.00 0.00 C ATOM 0 HA PRO A 39 5.792 -11.629 -5.310 1.00 0.00 H new ATOM 0 HB2 PRO A 39 3.121 -10.785 -6.523 1.00 0.00 H new ATOM 0 HB3 PRO A 39 4.733 -10.474 -7.134 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.303 -12.461 -8.259 1.00 0.00 H new ATOM 0 HG3 PRO A 39 5.004 -12.741 -7.941 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.599 -13.667 -6.328 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.081 -14.537 -6.668 1.00 0.00 H new ATOM 582 N CYS A 40 3.089 -10.891 -3.597 1.00 0.00 N ATOM 583 CA CYS A 40 2.711 -10.167 -2.374 1.00 0.00 C ATOM 584 C CYS A 40 3.606 -10.559 -1.188 1.00 0.00 C ATOM 585 O CYS A 40 4.090 -9.687 -0.467 1.00 0.00 O ATOM 586 CB CYS A 40 1.240 -10.415 -2.023 1.00 0.00 C ATOM 587 SG CYS A 40 0.144 -9.653 -3.251 1.00 0.00 S ATOM 0 H CYS A 40 2.354 -11.490 -3.973 1.00 0.00 H new ATOM 0 HA CYS A 40 2.852 -9.104 -2.572 1.00 0.00 H new ATOM 0 HB2 CYS A 40 1.049 -11.487 -1.975 1.00 0.00 H new ATOM 0 HB3 CYS A 40 1.024 -10.008 -1.035 1.00 0.00 H new ATOM 0 HG CYS A 40 0.002 -10.456 -4.263 1.00 0.00 H new ATOM 593 N LYS A 41 3.888 -11.859 -1.021 1.00 0.00 N ATOM 594 CA LYS A 41 4.790 -12.388 0.017 1.00 0.00 C ATOM 595 C LYS A 41 6.236 -11.889 -0.149 1.00 0.00 C ATOM 596 O LYS A 41 6.937 -11.713 0.845 1.00 0.00 O ATOM 597 CB LYS A 41 4.706 -13.929 -0.003 1.00 0.00 C ATOM 598 CG LYS A 41 5.208 -14.628 1.274 1.00 0.00 C ATOM 599 CD LYS A 41 4.439 -14.268 2.558 1.00 0.00 C ATOM 600 CE LYS A 41 2.918 -14.468 2.463 1.00 0.00 C ATOM 601 NZ LYS A 41 2.527 -15.901 2.427 1.00 0.00 N ATOM 0 H LYS A 41 3.489 -12.587 -1.614 1.00 0.00 H new ATOM 0 HA LYS A 41 4.468 -12.017 0.990 1.00 0.00 H new ATOM 0 HB2 LYS A 41 3.669 -14.219 -0.173 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.283 -14.298 -0.851 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.152 -15.706 1.126 1.00 0.00 H new ATOM 0 HG3 LYS A 41 6.260 -14.380 1.417 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.823 -14.874 3.379 1.00 0.00 H new ATOM 0 HD3 LYS A 41 4.642 -13.227 2.809 1.00 0.00 H new ATOM 0 HE2 LYS A 41 2.439 -13.987 3.316 1.00 0.00 H new ATOM 0 HE3 LYS A 41 2.546 -13.972 1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 1.561 -16.007 2.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 2.561 -16.246 1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 3.185 -16.455 3.012 1.00 0.00 H new ATOM 615 N MET A 42 6.662 -11.612 -1.386 1.00 0.00 N ATOM 616 CA MET A 42 7.974 -11.043 -1.723 1.00 0.00 C ATOM 617 C MET A 42 8.071 -9.541 -1.398 1.00 0.00 C ATOM 618 O MET A 42 9.051 -9.124 -0.780 1.00 0.00 O ATOM 619 CB MET A 42 8.284 -11.351 -3.200 1.00 0.00 C ATOM 620 CG MET A 42 9.699 -10.952 -3.638 1.00 0.00 C ATOM 621 SD MET A 42 9.941 -9.198 -4.049 1.00 0.00 S ATOM 622 CE MET A 42 11.712 -9.215 -4.437 1.00 0.00 C ATOM 0 H MET A 42 6.084 -11.783 -2.209 1.00 0.00 H new ATOM 0 HA MET A 42 8.733 -11.512 -1.097 1.00 0.00 H new ATOM 0 HB2 MET A 42 8.149 -12.419 -3.374 1.00 0.00 H new ATOM 0 HB3 MET A 42 7.560 -10.831 -3.828 1.00 0.00 H new ATOM 0 HG2 MET A 42 10.393 -11.217 -2.840 1.00 0.00 H new ATOM 0 HG3 MET A 42 9.971 -11.549 -4.508 1.00 0.00 H new ATOM 0 HE1 MET A 42 12.034 -8.211 -4.713 1.00 0.00 H new ATOM 0 HE2 MET A 42 12.273 -9.549 -3.564 1.00 0.00 H new ATOM 0 HE3 MET A 42 11.896 -9.896 -5.268 1.00 0.00 H new ATOM 632 N VAL A 43 7.064 -8.728 -1.754 1.00 0.00 N ATOM 633 CA VAL A 43 7.097 -7.266 -1.509 1.00 0.00 C ATOM 634 C VAL A 43 6.706 -6.864 -0.077 1.00 0.00 C ATOM 635 O VAL A 43 7.163 -5.829 0.409 1.00 0.00 O ATOM 636 CB VAL A 43 6.302 -6.509 -2.593 1.00 0.00 C ATOM 637 CG1 VAL A 43 4.785 -6.667 -2.459 1.00 0.00 C ATOM 638 CG2 VAL A 43 6.648 -5.016 -2.644 1.00 0.00 C ATOM 0 H VAL A 43 6.213 -9.053 -2.213 1.00 0.00 H new ATOM 0 HA VAL A 43 8.139 -6.958 -1.592 1.00 0.00 H new ATOM 0 HB VAL A 43 6.610 -6.978 -3.527 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.289 -6.109 -3.253 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.521 -7.722 -2.537 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.463 -6.283 -1.491 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.060 -4.533 -3.424 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.421 -4.557 -1.682 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.709 -4.896 -2.863 1.00 0.00 H new ATOM 648 N ALA A 44 5.937 -7.686 0.646 1.00 0.00 N ATOM 649 CA ALA A 44 5.537 -7.443 2.039 1.00 0.00 C ATOM 650 C ALA A 44 6.697 -7.120 3.013 1.00 0.00 C ATOM 651 O ALA A 44 6.597 -6.097 3.691 1.00 0.00 O ATOM 652 CB ALA A 44 4.686 -8.623 2.530 1.00 0.00 C ATOM 0 H ALA A 44 5.566 -8.559 0.271 1.00 0.00 H new ATOM 0 HA ALA A 44 4.947 -6.527 2.038 1.00 0.00 H new ATOM 0 HB1 ALA A 44 4.385 -8.450 3.563 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.798 -8.716 1.905 1.00 0.00 H new ATOM 0 HB3 ALA A 44 5.270 -9.542 2.471 1.00 0.00 H new ATOM 658 N PRO A 45 7.809 -7.884 3.092 1.00 0.00 N ATOM 659 CA PRO A 45 8.938 -7.529 3.960 1.00 0.00 C ATOM 660 C PRO A 45 9.653 -6.236 3.526 1.00 0.00 C ATOM 661 O PRO A 45 10.176 -5.514 4.376 1.00 0.00 O ATOM 662 CB PRO A 45 9.878 -8.740 3.933 1.00 0.00 C ATOM 663 CG PRO A 45 9.560 -9.413 2.600 1.00 0.00 C ATOM 664 CD PRO A 45 8.061 -9.173 2.463 1.00 0.00 C ATOM 0 HA PRO A 45 8.589 -7.311 4.969 1.00 0.00 H new ATOM 0 HB2 PRO A 45 10.924 -8.437 3.990 1.00 0.00 H new ATOM 0 HB3 PRO A 45 9.694 -9.409 4.774 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.120 -8.969 1.777 1.00 0.00 H new ATOM 0 HG3 PRO A 45 9.802 -10.476 2.613 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.760 -9.163 1.415 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.492 -9.964 2.950 1.00 0.00 H new ATOM 672 N VAL A 46 9.636 -5.893 2.232 1.00 0.00 N ATOM 673 CA VAL A 46 10.201 -4.625 1.733 1.00 0.00 C ATOM 674 C VAL A 46 9.335 -3.446 2.188 1.00 0.00 C ATOM 675 O VAL A 46 9.849 -2.471 2.733 1.00 0.00 O ATOM 676 CB VAL A 46 10.378 -4.614 0.197 1.00 0.00 C ATOM 677 CG1 VAL A 46 11.289 -3.462 -0.193 1.00 0.00 C ATOM 678 CG2 VAL A 46 11.011 -5.911 -0.324 1.00 0.00 C ATOM 0 H VAL A 46 9.233 -6.480 1.502 1.00 0.00 H new ATOM 0 HA VAL A 46 11.198 -4.526 2.161 1.00 0.00 H new ATOM 0 HB VAL A 46 9.386 -4.510 -0.242 1.00 0.00 H new ATOM 0 HG11 VAL A 46 11.417 -3.450 -1.275 1.00 0.00 H new ATOM 0 HG12 VAL A 46 10.844 -2.521 0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 46 12.260 -3.588 0.286 1.00 0.00 H new ATOM 0 HG21 VAL A 46 11.115 -5.855 -1.408 1.00 0.00 H new ATOM 0 HG22 VAL A 46 11.994 -6.043 0.128 1.00 0.00 H new ATOM 0 HG23 VAL A 46 10.375 -6.757 -0.063 1.00 0.00 H new ATOM 688 N LEU A 47 8.011 -3.563 2.049 1.00 0.00 N ATOM 689 CA LEU A 47 7.038 -2.596 2.567 1.00 0.00 C ATOM 690 C LEU A 47 7.079 -2.477 4.098 1.00 0.00 C ATOM 691 O LEU A 47 6.892 -1.384 4.619 1.00 0.00 O ATOM 692 CB LEU A 47 5.635 -3.025 2.114 1.00 0.00 C ATOM 693 CG LEU A 47 5.317 -2.653 0.659 1.00 0.00 C ATOM 694 CD1 LEU A 47 4.151 -3.506 0.185 1.00 0.00 C ATOM 695 CD2 LEU A 47 4.932 -1.176 0.541 1.00 0.00 C ATOM 0 H LEU A 47 7.577 -4.348 1.564 1.00 0.00 H new ATOM 0 HA LEU A 47 7.293 -1.614 2.170 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.538 -4.104 2.234 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.895 -2.564 2.768 1.00 0.00 H new ATOM 0 HG LEU A 47 6.203 -2.829 0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 47 3.912 -3.254 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.422 -4.560 0.248 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.282 -3.317 0.815 1.00 0.00 H new ATOM 0 HD21 LEU A 47 4.712 -0.939 -0.500 1.00 0.00 H new ATOM 0 HD22 LEU A 47 4.051 -0.980 1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.759 -0.556 0.887 1.00 0.00 H new ATOM 707 N GLU A 48 7.352 -3.562 4.824 1.00 0.00 N ATOM 708 CA GLU A 48 7.507 -3.555 6.286 1.00 0.00 C ATOM 709 C GLU A 48 8.749 -2.755 6.725 1.00 0.00 C ATOM 710 O GLU A 48 8.683 -1.946 7.657 1.00 0.00 O ATOM 711 CB GLU A 48 7.571 -5.011 6.779 1.00 0.00 C ATOM 712 CG GLU A 48 7.345 -5.126 8.286 1.00 0.00 C ATOM 713 CD GLU A 48 7.487 -6.589 8.752 1.00 0.00 C ATOM 714 OE1 GLU A 48 8.617 -7.015 9.091 1.00 0.00 O ATOM 715 OE2 GLU A 48 6.471 -7.326 8.778 1.00 0.00 O ATOM 0 H GLU A 48 7.474 -4.486 4.410 1.00 0.00 H new ATOM 0 HA GLU A 48 6.649 -3.055 6.736 1.00 0.00 H new ATOM 0 HB2 GLU A 48 6.820 -5.602 6.255 1.00 0.00 H new ATOM 0 HB3 GLU A 48 8.543 -5.435 6.527 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.064 -4.500 8.815 1.00 0.00 H new ATOM 0 HG3 GLU A 48 6.352 -4.754 8.539 1.00 0.00 H new ATOM 722 N GLU A 49 9.869 -2.902 6.008 1.00 0.00 N ATOM 723 CA GLU A 49 11.051 -2.054 6.204 1.00 0.00 C ATOM 724 C GLU A 49 10.757 -0.586 5.866 1.00 0.00 C ATOM 725 O GLU A 49 11.091 0.290 6.657 1.00 0.00 O ATOM 726 CB GLU A 49 12.237 -2.553 5.369 1.00 0.00 C ATOM 727 CG GLU A 49 12.898 -3.811 5.950 1.00 0.00 C ATOM 728 CD GLU A 49 14.098 -4.277 5.097 1.00 0.00 C ATOM 729 OE1 GLU A 49 14.812 -3.417 4.522 1.00 0.00 O ATOM 730 OE2 GLU A 49 14.353 -5.502 5.022 1.00 0.00 O ATOM 0 H GLU A 49 9.982 -3.607 5.280 1.00 0.00 H new ATOM 0 HA GLU A 49 11.314 -2.117 7.260 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.896 -2.764 4.355 1.00 0.00 H new ATOM 0 HB3 GLU A 49 12.981 -1.760 5.296 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.233 -3.608 6.967 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.162 -4.613 6.010 1.00 0.00 H new ATOM 737 N ILE A 50 10.077 -0.295 4.749 1.00 0.00 N ATOM 738 CA ILE A 50 9.648 1.074 4.409 1.00 0.00 C ATOM 739 C ILE A 50 8.734 1.653 5.505 1.00 0.00 C ATOM 740 O ILE A 50 8.937 2.788 5.928 1.00 0.00 O ATOM 741 CB ILE A 50 8.971 1.086 3.016 1.00 0.00 C ATOM 742 CG1 ILE A 50 9.960 0.781 1.862 1.00 0.00 C ATOM 743 CG2 ILE A 50 8.214 2.391 2.718 1.00 0.00 C ATOM 744 CD1 ILE A 50 11.054 1.824 1.596 1.00 0.00 C ATOM 0 H ILE A 50 9.809 -0.995 4.057 1.00 0.00 H new ATOM 0 HA ILE A 50 10.525 1.720 4.358 1.00 0.00 H new ATOM 0 HB ILE A 50 8.240 0.279 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.444 -0.173 2.072 1.00 0.00 H new ATOM 0 HG13 ILE A 50 9.384 0.651 0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 50 7.764 2.332 1.727 1.00 0.00 H new ATOM 0 HG22 ILE A 50 7.432 2.537 3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 50 8.909 3.230 2.752 1.00 0.00 H new ATOM 0 HD11 ILE A 50 11.678 1.493 0.766 1.00 0.00 H new ATOM 0 HD12 ILE A 50 10.593 2.779 1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 50 11.669 1.942 2.488 1.00 0.00 H new ATOM 756 N ALA A 51 7.779 0.877 6.027 1.00 0.00 N ATOM 757 CA ALA A 51 6.893 1.295 7.116 1.00 0.00 C ATOM 758 C ALA A 51 7.675 1.668 8.383 1.00 0.00 C ATOM 759 O ALA A 51 7.382 2.675 9.027 1.00 0.00 O ATOM 760 CB ALA A 51 5.915 0.153 7.417 1.00 0.00 C ATOM 0 H ALA A 51 7.598 -0.072 5.700 1.00 0.00 H new ATOM 0 HA ALA A 51 6.353 2.187 6.800 1.00 0.00 H new ATOM 0 HB1 ALA A 51 5.248 0.449 8.227 1.00 0.00 H new ATOM 0 HB2 ALA A 51 5.328 -0.068 6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 51 6.473 -0.735 7.713 1.00 0.00 H new ATOM 766 N THR A 52 8.685 0.863 8.720 1.00 0.00 N ATOM 767 CA THR A 52 9.512 1.041 9.924 1.00 0.00 C ATOM 768 C THR A 52 10.501 2.205 9.777 1.00 0.00 C ATOM 769 O THR A 52 10.676 2.997 10.704 1.00 0.00 O ATOM 770 CB THR A 52 10.255 -0.268 10.248 1.00 0.00 C ATOM 771 OG1 THR A 52 9.335 -1.334 10.377 1.00 0.00 O ATOM 772 CG2 THR A 52 11.029 -0.204 11.566 1.00 0.00 C ATOM 0 H THR A 52 8.958 0.056 8.159 1.00 0.00 H new ATOM 0 HA THR A 52 8.848 1.291 10.751 1.00 0.00 H new ATOM 0 HB THR A 52 10.952 -0.421 9.424 1.00 0.00 H new ATOM 0 HG1 THR A 52 9.042 -1.623 9.487 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.531 -1.156 11.739 1.00 0.00 H new ATOM 0 HG22 THR A 52 11.770 0.594 11.514 1.00 0.00 H new ATOM 0 HG23 THR A 52 10.338 -0.004 12.385 1.00 0.00 H new ATOM 780 N GLU A 53 11.150 2.332 8.615 1.00 0.00 N ATOM 781 CA GLU A 53 12.276 3.249 8.380 1.00 0.00 C ATOM 782 C GLU A 53 11.891 4.603 7.764 1.00 0.00 C ATOM 783 O GLU A 53 12.660 5.563 7.868 1.00 0.00 O ATOM 784 CB GLU A 53 13.320 2.553 7.493 1.00 0.00 C ATOM 785 CG GLU A 53 13.897 1.288 8.147 1.00 0.00 C ATOM 786 CD GLU A 53 15.171 0.825 7.420 1.00 0.00 C ATOM 787 OE1 GLU A 53 15.098 0.510 6.208 1.00 0.00 O ATOM 788 OE2 GLU A 53 16.253 0.769 8.055 1.00 0.00 O ATOM 0 H GLU A 53 10.902 1.787 7.789 1.00 0.00 H new ATOM 0 HA GLU A 53 12.681 3.484 9.364 1.00 0.00 H new ATOM 0 HB2 GLU A 53 12.864 2.289 6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 53 14.131 3.249 7.277 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.123 1.487 9.195 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.153 0.492 8.127 1.00 0.00 H new ATOM 795 N ARG A 54 10.737 4.704 7.089 1.00 0.00 N ATOM 796 CA ARG A 54 10.240 5.920 6.407 1.00 0.00 C ATOM 797 C ARG A 54 8.991 6.506 7.080 1.00 0.00 C ATOM 798 O ARG A 54 8.294 7.314 6.470 1.00 0.00 O ATOM 799 CB ARG A 54 10.015 5.660 4.895 1.00 0.00 C ATOM 800 CG ARG A 54 11.139 4.931 4.126 1.00 0.00 C ATOM 801 CD ARG A 54 12.405 5.755 3.855 1.00 0.00 C ATOM 802 NE ARG A 54 13.115 6.133 5.088 1.00 0.00 N ATOM 803 CZ ARG A 54 14.162 6.924 5.205 1.00 0.00 C ATOM 804 NH1 ARG A 54 14.774 7.417 4.169 1.00 0.00 N ATOM 805 NH2 ARG A 54 14.601 7.226 6.389 1.00 0.00 N ATOM 0 H ARG A 54 10.097 3.915 6.996 1.00 0.00 H new ATOM 0 HA ARG A 54 11.017 6.678 6.502 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.100 5.079 4.785 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.843 6.621 4.410 1.00 0.00 H new ATOM 0 HG2 ARG A 54 11.421 4.041 4.689 1.00 0.00 H new ATOM 0 HG3 ARG A 54 10.739 4.590 3.171 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.076 5.181 3.216 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.135 6.657 3.306 1.00 0.00 H new ATOM 0 HE ARG A 54 12.753 5.735 5.955 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.446 7.194 3.229 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.582 8.026 4.296 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.136 6.852 7.216 1.00 0.00 H new ATOM 0 HH22 ARG A 54 15.411 7.837 6.492 1.00 0.00 H new ATOM 819 N ALA A 55 8.711 6.137 8.334 1.00 0.00 N ATOM 820 CA ALA A 55 7.522 6.557 9.091 1.00 0.00 C ATOM 821 C ALA A 55 7.329 8.089 9.182 1.00 0.00 C ATOM 822 O ALA A 55 6.198 8.574 9.265 1.00 0.00 O ATOM 823 CB ALA A 55 7.626 5.951 10.497 1.00 0.00 C ATOM 0 H ALA A 55 9.322 5.519 8.868 1.00 0.00 H new ATOM 0 HA ALA A 55 6.645 6.195 8.554 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.757 6.245 11.085 1.00 0.00 H new ATOM 0 HB2 ALA A 55 7.664 4.864 10.423 1.00 0.00 H new ATOM 0 HB3 ALA A 55 8.532 6.313 10.983 1.00 0.00 H new ATOM 829 N THR A 56 8.422 8.857 9.132 1.00 0.00 N ATOM 830 CA THR A 56 8.443 10.332 9.098 1.00 0.00 C ATOM 831 C THR A 56 7.916 10.936 7.790 1.00 0.00 C ATOM 832 O THR A 56 7.491 12.091 7.771 1.00 0.00 O ATOM 833 CB THR A 56 9.884 10.833 9.314 1.00 0.00 C ATOM 834 OG1 THR A 56 10.816 10.063 8.574 1.00 0.00 O ATOM 835 CG2 THR A 56 10.289 10.714 10.783 1.00 0.00 C ATOM 0 H THR A 56 9.359 8.455 9.113 1.00 0.00 H new ATOM 0 HA THR A 56 7.775 10.657 9.896 1.00 0.00 H new ATOM 0 HB THR A 56 9.898 11.872 8.986 1.00 0.00 H new ATOM 0 HG1 THR A 56 10.796 10.340 7.634 1.00 0.00 H new ATOM 0 HG21 THR A 56 11.310 11.074 10.909 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.615 11.312 11.396 1.00 0.00 H new ATOM 0 HG23 THR A 56 10.231 9.671 11.093 1.00 0.00 H new ATOM 843 N ASP A 57 7.940 10.170 6.698 1.00 0.00 N ATOM 844 CA ASP A 57 7.658 10.616 5.327 1.00 0.00 C ATOM 845 C ASP A 57 6.439 9.917 4.708 1.00 0.00 C ATOM 846 O ASP A 57 5.744 10.499 3.872 1.00 0.00 O ATOM 847 CB ASP A 57 8.900 10.345 4.471 1.00 0.00 C ATOM 848 CG ASP A 57 10.125 11.115 4.985 1.00 0.00 C ATOM 849 OD1 ASP A 57 10.849 10.582 5.860 1.00 0.00 O ATOM 850 OD2 ASP A 57 10.362 12.250 4.512 1.00 0.00 O ATOM 0 H ASP A 57 8.166 9.177 6.744 1.00 0.00 H new ATOM 0 HA ASP A 57 7.421 11.679 5.359 1.00 0.00 H new ATOM 0 HB2 ASP A 57 9.116 9.277 4.471 1.00 0.00 H new ATOM 0 HB3 ASP A 57 8.699 10.629 3.438 1.00 0.00 H new ATOM 855 N LEU A 58 6.176 8.677 5.129 1.00 0.00 N ATOM 856 CA LEU A 58 5.092 7.812 4.672 1.00 0.00 C ATOM 857 C LEU A 58 4.315 7.227 5.857 1.00 0.00 C ATOM 858 O LEU A 58 4.877 6.931 6.914 1.00 0.00 O ATOM 859 CB LEU A 58 5.656 6.657 3.814 1.00 0.00 C ATOM 860 CG LEU A 58 6.342 7.060 2.501 1.00 0.00 C ATOM 861 CD1 LEU A 58 6.959 5.825 1.847 1.00 0.00 C ATOM 862 CD2 LEU A 58 5.363 7.679 1.507 1.00 0.00 C ATOM 0 H LEU A 58 6.750 8.226 5.841 1.00 0.00 H new ATOM 0 HA LEU A 58 4.413 8.418 4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 58 6.372 6.100 4.418 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.839 5.975 3.578 1.00 0.00 H new ATOM 0 HG LEU A 58 7.103 7.800 2.750 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.446 6.112 0.915 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.695 5.386 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 58 6.177 5.095 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 58 5.893 7.948 0.594 1.00 0.00 H new ATOM 0 HD22 LEU A 58 4.579 6.959 1.272 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.917 8.572 1.944 1.00 0.00 H new ATOM 874 N THR A 59 3.028 6.981 5.649 1.00 0.00 N ATOM 875 CA THR A 59 2.262 5.933 6.345 1.00 0.00 C ATOM 876 C THR A 59 2.164 4.730 5.406 1.00 0.00 C ATOM 877 O THR A 59 1.972 4.919 4.206 1.00 0.00 O ATOM 878 CB THR A 59 0.870 6.446 6.747 1.00 0.00 C ATOM 879 OG1 THR A 59 1.018 7.565 7.595 1.00 0.00 O ATOM 880 CG2 THR A 59 0.041 5.416 7.514 1.00 0.00 C ATOM 0 H THR A 59 2.468 7.510 4.980 1.00 0.00 H new ATOM 0 HA THR A 59 2.765 5.644 7.268 1.00 0.00 H new ATOM 0 HB THR A 59 0.353 6.684 5.818 1.00 0.00 H new ATOM 0 HG1 THR A 59 0.134 7.898 7.854 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.929 5.845 7.766 1.00 0.00 H new ATOM 0 HG22 THR A 59 -0.103 4.531 6.894 1.00 0.00 H new ATOM 0 HG23 THR A 59 0.563 5.137 8.429 1.00 0.00 H new ATOM 888 N VAL A 60 2.308 3.497 5.902 1.00 0.00 N ATOM 889 CA VAL A 60 2.203 2.282 5.069 1.00 0.00 C ATOM 890 C VAL A 60 1.022 1.423 5.529 1.00 0.00 C ATOM 891 O VAL A 60 0.879 1.124 6.715 1.00 0.00 O ATOM 892 CB VAL A 60 3.526 1.496 5.020 1.00 0.00 C ATOM 893 CG1 VAL A 60 3.419 0.266 4.106 1.00 0.00 C ATOM 894 CG2 VAL A 60 4.662 2.363 4.464 1.00 0.00 C ATOM 0 H VAL A 60 2.500 3.307 6.886 1.00 0.00 H new ATOM 0 HA VAL A 60 2.007 2.589 4.042 1.00 0.00 H new ATOM 0 HB VAL A 60 3.734 1.191 6.046 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.371 -0.264 4.096 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.638 -0.397 4.479 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.171 0.585 3.094 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.584 1.783 4.441 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.411 2.687 3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.799 3.236 5.102 1.00 0.00 H new ATOM 904 N ALA A 61 0.168 1.035 4.585 1.00 0.00 N ATOM 905 CA ALA A 61 -1.115 0.378 4.815 1.00 0.00 C ATOM 906 C ALA A 61 -1.296 -0.889 3.958 1.00 0.00 C ATOM 907 O ALA A 61 -0.673 -1.046 2.905 1.00 0.00 O ATOM 908 CB ALA A 61 -2.221 1.405 4.551 1.00 0.00 C ATOM 0 H ALA A 61 0.361 1.177 3.594 1.00 0.00 H new ATOM 0 HA ALA A 61 -1.161 0.031 5.847 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.194 0.942 4.715 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.102 2.250 5.229 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -2.155 1.754 3.521 1.00 0.00 H new ATOM 914 N LYS A 62 -2.179 -1.785 4.404 1.00 0.00 N ATOM 915 CA LYS A 62 -2.452 -3.102 3.813 1.00 0.00 C ATOM 916 C LYS A 62 -3.952 -3.265 3.539 1.00 0.00 C ATOM 917 O LYS A 62 -4.756 -3.142 4.466 1.00 0.00 O ATOM 918 CB LYS A 62 -1.960 -4.196 4.787 1.00 0.00 C ATOM 919 CG LYS A 62 -0.459 -4.148 5.141 1.00 0.00 C ATOM 920 CD LYS A 62 0.490 -4.569 4.008 1.00 0.00 C ATOM 921 CE LYS A 62 0.371 -6.074 3.738 1.00 0.00 C ATOM 922 NZ LYS A 62 1.357 -6.542 2.735 1.00 0.00 N ATOM 0 H LYS A 62 -2.753 -1.605 5.228 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.925 -3.193 2.863 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -2.535 -4.121 5.710 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.181 -5.171 4.352 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -0.206 -3.133 5.448 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.283 -4.794 6.001 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.254 -4.011 3.102 1.00 0.00 H new ATOM 0 HD3 LYS A 62 1.517 -4.322 4.276 1.00 0.00 H new ATOM 0 HE2 LYS A 62 0.515 -6.621 4.670 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -0.636 -6.300 3.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 1.058 -7.464 2.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 1.416 -5.853 1.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 2.290 -6.638 3.184 1.00 0.00 H new ATOM 936 N LEU A 63 -4.324 -3.566 2.294 1.00 0.00 N ATOM 937 CA LEU A 63 -5.678 -3.976 1.904 1.00 0.00 C ATOM 938 C LEU A 63 -5.656 -5.453 1.519 1.00 0.00 C ATOM 939 O LEU A 63 -5.045 -5.849 0.527 1.00 0.00 O ATOM 940 CB LEU A 63 -6.205 -3.052 0.784 1.00 0.00 C ATOM 941 CG LEU A 63 -7.617 -3.335 0.216 1.00 0.00 C ATOM 942 CD1 LEU A 63 -7.697 -4.540 -0.720 1.00 0.00 C ATOM 943 CD2 LEU A 63 -8.678 -3.490 1.302 1.00 0.00 C ATOM 0 H LEU A 63 -3.676 -3.531 1.507 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.375 -3.871 2.736 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.195 -2.030 1.162 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.497 -3.093 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.825 -2.441 -0.373 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.722 -4.662 -1.069 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.039 -4.381 -1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.387 -5.438 -0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.645 -3.687 0.840 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -8.412 -4.321 1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.736 -2.573 1.888 1.00 0.00 H new ATOM 955 N ASP A 64 -6.341 -6.265 2.315 1.00 0.00 N ATOM 956 CA ASP A 64 -6.400 -7.714 2.167 1.00 0.00 C ATOM 957 C ASP A 64 -7.463 -8.077 1.113 1.00 0.00 C ATOM 958 O ASP A 64 -8.657 -8.107 1.416 1.00 0.00 O ATOM 959 CB ASP A 64 -6.730 -8.331 3.536 1.00 0.00 C ATOM 960 CG ASP A 64 -5.600 -8.268 4.578 1.00 0.00 C ATOM 961 OD1 ASP A 64 -4.884 -7.245 4.694 1.00 0.00 O ATOM 962 OD2 ASP A 64 -5.450 -9.235 5.363 1.00 0.00 O ATOM 0 H ASP A 64 -6.887 -5.923 3.105 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.443 -8.109 1.826 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.605 -7.824 3.943 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.007 -9.375 3.388 1.00 0.00 H new ATOM 967 N VAL A 65 -7.063 -8.363 -0.133 1.00 0.00 N ATOM 968 CA VAL A 65 -8.018 -8.648 -1.230 1.00 0.00 C ATOM 969 C VAL A 65 -8.800 -9.949 -1.025 1.00 0.00 C ATOM 970 O VAL A 65 -9.846 -10.152 -1.640 1.00 0.00 O ATOM 971 CB VAL A 65 -7.367 -8.641 -2.629 1.00 0.00 C ATOM 972 CG1 VAL A 65 -6.679 -7.300 -2.905 1.00 0.00 C ATOM 973 CG2 VAL A 65 -6.374 -9.775 -2.894 1.00 0.00 C ATOM 0 H VAL A 65 -6.083 -8.405 -0.414 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.724 -7.819 -1.189 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.201 -8.801 -3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.228 -7.320 -3.897 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.415 -6.497 -2.857 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.905 -7.128 -2.158 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.974 -9.680 -3.903 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -5.558 -9.720 -2.173 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -6.882 -10.734 -2.794 1.00 0.00 H new ATOM 983 N ASP A 66 -8.318 -10.820 -0.135 1.00 0.00 N ATOM 984 CA ASP A 66 -8.982 -12.069 0.241 1.00 0.00 C ATOM 985 C ASP A 66 -10.209 -11.855 1.152 1.00 0.00 C ATOM 986 O ASP A 66 -11.117 -12.689 1.159 1.00 0.00 O ATOM 987 CB ASP A 66 -7.950 -12.979 0.915 1.00 0.00 C ATOM 988 CG ASP A 66 -8.462 -14.422 1.020 1.00 0.00 C ATOM 989 OD1 ASP A 66 -8.651 -15.055 -0.046 1.00 0.00 O ATOM 990 OD2 ASP A 66 -8.637 -14.932 2.153 1.00 0.00 O ATOM 0 H ASP A 66 -7.436 -10.672 0.355 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.371 -12.535 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -7.020 -12.961 0.346 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.722 -12.599 1.911 1.00 0.00 H new ATOM 995 N THR A 67 -10.259 -10.742 1.899 1.00 0.00 N ATOM 996 CA THR A 67 -11.358 -10.412 2.832 1.00 0.00 C ATOM 997 C THR A 67 -12.096 -9.114 2.494 1.00 0.00 C ATOM 998 O THR A 67 -13.283 -9.004 2.813 1.00 0.00 O ATOM 999 CB THR A 67 -10.870 -10.356 4.289 1.00 0.00 C ATOM 1000 OG1 THR A 67 -9.868 -9.376 4.441 1.00 0.00 O ATOM 1001 CG2 THR A 67 -10.295 -11.692 4.765 1.00 0.00 C ATOM 0 H THR A 67 -9.527 -10.032 1.875 1.00 0.00 H new ATOM 0 HA THR A 67 -12.071 -11.228 2.714 1.00 0.00 H new ATOM 0 HB THR A 67 -11.745 -10.112 4.891 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.571 -9.354 5.375 1.00 0.00 H new ATOM 0 HG21 THR A 67 -9.965 -11.598 5.800 1.00 0.00 H new ATOM 0 HG22 THR A 67 -11.062 -12.463 4.697 1.00 0.00 H new ATOM 0 HG23 THR A 67 -9.447 -11.968 4.137 1.00 0.00 H new ATOM 1009 N ASN A 68 -11.464 -8.153 1.804 1.00 0.00 N ATOM 1010 CA ASN A 68 -12.120 -6.957 1.279 1.00 0.00 C ATOM 1011 C ASN A 68 -11.730 -6.676 -0.195 1.00 0.00 C ATOM 1012 O ASN A 68 -11.007 -5.717 -0.480 1.00 0.00 O ATOM 1013 CB ASN A 68 -11.849 -5.787 2.241 1.00 0.00 C ATOM 1014 CG ASN A 68 -12.784 -4.626 1.970 1.00 0.00 C ATOM 1015 OD1 ASN A 68 -12.443 -3.642 1.337 1.00 0.00 O ATOM 1016 ND2 ASN A 68 -14.011 -4.706 2.431 1.00 0.00 N ATOM 0 H ASN A 68 -10.466 -8.190 1.594 1.00 0.00 H new ATOM 0 HA ASN A 68 -13.199 -7.109 1.238 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -11.972 -6.123 3.270 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -10.816 -5.457 2.135 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -14.671 -3.948 2.258 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -14.304 -5.526 2.962 1.00 0.00 H new ATOM 1023 N PRO A 69 -12.254 -7.456 -1.163 1.00 0.00 N ATOM 1024 CA PRO A 69 -12.157 -7.127 -2.590 1.00 0.00 C ATOM 1025 C PRO A 69 -12.973 -5.875 -2.968 1.00 0.00 C ATOM 1026 O PRO A 69 -12.797 -5.325 -4.055 1.00 0.00 O ATOM 1027 CB PRO A 69 -12.659 -8.378 -3.319 1.00 0.00 C ATOM 1028 CG PRO A 69 -13.670 -8.972 -2.340 1.00 0.00 C ATOM 1029 CD PRO A 69 -13.047 -8.668 -0.978 1.00 0.00 C ATOM 0 HA PRO A 69 -11.134 -6.874 -2.869 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -13.122 -8.129 -4.274 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -11.847 -9.074 -3.530 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -14.653 -8.513 -2.446 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -13.800 -10.043 -2.494 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.817 -8.519 -0.221 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -12.423 -9.495 -0.640 1.00 0.00 H new ATOM 1037 N GLU A 70 -13.835 -5.386 -2.067 1.00 0.00 N ATOM 1038 CA GLU A 70 -14.630 -4.165 -2.244 1.00 0.00 C ATOM 1039 C GLU A 70 -13.753 -2.936 -2.517 1.00 0.00 C ATOM 1040 O GLU A 70 -14.054 -2.169 -3.430 1.00 0.00 O ATOM 1041 CB GLU A 70 -15.511 -3.924 -1.006 1.00 0.00 C ATOM 1042 CG GLU A 70 -16.496 -5.063 -0.696 1.00 0.00 C ATOM 1043 CD GLU A 70 -17.519 -5.254 -1.828 1.00 0.00 C ATOM 1044 OE1 GLU A 70 -17.230 -5.984 -2.804 1.00 0.00 O ATOM 1045 OE2 GLU A 70 -18.608 -4.637 -1.792 1.00 0.00 O ATOM 0 H GLU A 70 -14.003 -5.842 -1.170 1.00 0.00 H new ATOM 0 HA GLU A 70 -15.263 -4.312 -3.119 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -14.866 -3.772 -0.140 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -16.074 -3.002 -1.150 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -15.944 -5.990 -0.544 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -17.020 -4.848 0.235 1.00 0.00 H new ATOM 1052 N THR A 71 -12.622 -2.781 -1.812 1.00 0.00 N ATOM 1053 CA THR A 71 -11.667 -1.694 -2.099 1.00 0.00 C ATOM 1054 C THR A 71 -11.023 -1.877 -3.477 1.00 0.00 C ATOM 1055 O THR A 71 -10.924 -0.921 -4.245 1.00 0.00 O ATOM 1056 CB THR A 71 -10.574 -1.576 -1.032 1.00 0.00 C ATOM 1057 OG1 THR A 71 -11.108 -1.503 0.266 1.00 0.00 O ATOM 1058 CG2 THR A 71 -9.761 -0.291 -1.171 1.00 0.00 C ATOM 0 H THR A 71 -12.345 -3.390 -1.042 1.00 0.00 H new ATOM 0 HA THR A 71 -12.244 -0.769 -2.089 1.00 0.00 H new ATOM 0 HB THR A 71 -9.963 -2.466 -1.180 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.522 -2.360 0.498 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.000 -0.256 -0.391 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.280 -0.269 -2.149 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.422 0.570 -1.072 1.00 0.00 H new ATOM 1066 N ALA A 72 -10.629 -3.107 -3.835 1.00 0.00 N ATOM 1067 CA ALA A 72 -9.976 -3.407 -5.111 1.00 0.00 C ATOM 1068 C ALA A 72 -10.862 -3.088 -6.330 1.00 0.00 C ATOM 1069 O ALA A 72 -10.360 -2.557 -7.323 1.00 0.00 O ATOM 1070 CB ALA A 72 -9.513 -4.869 -5.089 1.00 0.00 C ATOM 0 H ALA A 72 -10.757 -3.926 -3.241 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.110 -2.755 -5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.024 -5.110 -6.033 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.811 -5.016 -4.268 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.375 -5.522 -4.950 1.00 0.00 H new ATOM 1076 N ARG A 73 -12.179 -3.340 -6.250 1.00 0.00 N ATOM 1077 CA ARG A 73 -13.136 -2.937 -7.299 1.00 0.00 C ATOM 1078 C ARG A 73 -13.526 -1.452 -7.248 1.00 0.00 C ATOM 1079 O ARG A 73 -13.611 -0.822 -8.300 1.00 0.00 O ATOM 1080 CB ARG A 73 -14.339 -3.900 -7.355 1.00 0.00 C ATOM 1081 CG ARG A 73 -15.323 -3.777 -6.183 1.00 0.00 C ATOM 1082 CD ARG A 73 -16.436 -4.827 -6.284 1.00 0.00 C ATOM 1083 NE ARG A 73 -17.474 -4.618 -5.254 1.00 0.00 N ATOM 1084 CZ ARG A 73 -18.542 -3.846 -5.333 1.00 0.00 C ATOM 1085 NH1 ARG A 73 -18.839 -3.166 -6.407 1.00 0.00 N ATOM 1086 NH2 ARG A 73 -19.346 -3.734 -4.318 1.00 0.00 N ATOM 0 H ARG A 73 -12.610 -3.825 -5.463 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.616 -3.030 -8.253 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -14.881 -3.727 -8.285 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -13.965 -4.923 -7.390 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -14.788 -3.899 -5.241 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -15.760 -2.779 -6.175 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.890 -4.783 -7.274 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -16.008 -5.824 -6.174 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.351 -5.130 -4.380 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -18.236 -3.220 -7.228 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -19.675 -2.581 -6.426 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -19.153 -4.244 -3.456 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -20.170 -3.136 -4.384 1.00 0.00 H new ATOM 1100 N ASN A 74 -13.702 -0.863 -6.060 1.00 0.00 N ATOM 1101 CA ASN A 74 -14.116 0.543 -5.902 1.00 0.00 C ATOM 1102 C ASN A 74 -13.018 1.539 -6.342 1.00 0.00 C ATOM 1103 O ASN A 74 -13.313 2.553 -6.976 1.00 0.00 O ATOM 1104 CB ASN A 74 -14.543 0.765 -4.438 1.00 0.00 C ATOM 1105 CG ASN A 74 -15.176 2.126 -4.171 1.00 0.00 C ATOM 1106 OD1 ASN A 74 -15.676 2.812 -5.052 1.00 0.00 O ATOM 1107 ND2 ASN A 74 -15.213 2.550 -2.931 1.00 0.00 N ATOM 0 H ASN A 74 -13.561 -1.348 -5.174 1.00 0.00 H new ATOM 0 HA ASN A 74 -14.961 0.739 -6.563 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -15.251 -0.014 -4.156 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -13.670 0.650 -3.795 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -15.655 3.442 -2.710 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -14.800 1.988 -2.187 1.00 0.00 H new ATOM 1114 N PHE A 75 -11.748 1.213 -6.083 1.00 0.00 N ATOM 1115 CA PHE A 75 -10.575 1.977 -6.537 1.00 0.00 C ATOM 1116 C PHE A 75 -10.011 1.453 -7.875 1.00 0.00 C ATOM 1117 O PHE A 75 -8.942 1.876 -8.310 1.00 0.00 O ATOM 1118 CB PHE A 75 -9.531 2.049 -5.407 1.00 0.00 C ATOM 1119 CG PHE A 75 -9.951 2.943 -4.251 1.00 0.00 C ATOM 1120 CD1 PHE A 75 -10.814 2.462 -3.248 1.00 0.00 C ATOM 1121 CD2 PHE A 75 -9.501 4.278 -4.195 1.00 0.00 C ATOM 1122 CE1 PHE A 75 -11.232 3.305 -2.203 1.00 0.00 C ATOM 1123 CE2 PHE A 75 -9.917 5.122 -3.149 1.00 0.00 C ATOM 1124 CZ PHE A 75 -10.787 4.638 -2.156 1.00 0.00 C ATOM 0 H PHE A 75 -11.497 0.389 -5.537 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.885 2.998 -6.758 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -9.345 1.043 -5.030 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -8.589 2.415 -5.816 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -11.157 1.439 -3.281 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -8.835 4.654 -4.957 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -11.894 2.929 -1.437 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -9.568 6.143 -3.109 1.00 0.00 H new ATOM 0 HZ PHE A 75 -11.113 5.289 -1.358 1.00 0.00 H new ATOM 1134 N GLN A 76 -10.732 0.537 -8.536 1.00 0.00 N ATOM 1135 CA GLN A 76 -10.457 -0.085 -9.842 1.00 0.00 C ATOM 1136 C GLN A 76 -9.149 -0.906 -9.965 1.00 0.00 C ATOM 1137 O GLN A 76 -8.979 -1.653 -10.931 1.00 0.00 O ATOM 1138 CB GLN A 76 -10.640 0.982 -10.943 1.00 0.00 C ATOM 1139 CG GLN A 76 -10.736 0.416 -12.369 1.00 0.00 C ATOM 1140 CD GLN A 76 -11.129 1.492 -13.380 1.00 0.00 C ATOM 1141 OE1 GLN A 76 -10.298 2.082 -14.060 1.00 0.00 O ATOM 1142 NE2 GLN A 76 -12.402 1.804 -13.517 1.00 0.00 N ATOM 0 H GLN A 76 -11.600 0.180 -8.136 1.00 0.00 H new ATOM 0 HA GLN A 76 -11.191 -0.880 -9.971 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -11.544 1.554 -10.731 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -9.804 1.680 -10.898 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -9.777 -0.018 -12.654 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -11.470 -0.390 -12.392 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -13.108 1.323 -12.959 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -12.681 2.526 -14.181 1.00 0.00 H new ATOM 1151 N VAL A 77 -8.246 -0.846 -8.984 1.00 0.00 N ATOM 1152 CA VAL A 77 -6.955 -1.563 -8.938 1.00 0.00 C ATOM 1153 C VAL A 77 -7.095 -3.058 -8.579 1.00 0.00 C ATOM 1154 O VAL A 77 -6.455 -3.579 -7.666 1.00 0.00 O ATOM 1155 CB VAL A 77 -5.933 -0.812 -8.060 1.00 0.00 C ATOM 1156 CG1 VAL A 77 -5.575 0.551 -8.670 1.00 0.00 C ATOM 1157 CG2 VAL A 77 -6.403 -0.566 -6.620 1.00 0.00 C ATOM 0 H VAL A 77 -8.396 -0.270 -8.156 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.557 -1.568 -9.953 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.067 -1.473 -8.027 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.853 1.058 -8.030 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.142 0.404 -9.660 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.475 1.160 -8.754 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.627 -0.033 -6.070 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.315 0.031 -6.632 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.601 -1.521 -6.134 1.00 0.00 H new ATOM 1167 N VAL A 78 -7.956 -3.766 -9.316 1.00 0.00 N ATOM 1168 CA VAL A 78 -8.232 -5.206 -9.160 1.00 0.00 C ATOM 1169 C VAL A 78 -7.116 -6.099 -9.730 1.00 0.00 C ATOM 1170 O VAL A 78 -6.962 -7.245 -9.307 1.00 0.00 O ATOM 1171 CB VAL A 78 -9.622 -5.529 -9.741 1.00 0.00 C ATOM 1172 CG1 VAL A 78 -9.671 -5.459 -11.274 1.00 0.00 C ATOM 1173 CG2 VAL A 78 -10.152 -6.890 -9.278 1.00 0.00 C ATOM 0 H VAL A 78 -8.502 -3.341 -10.066 1.00 0.00 H new ATOM 0 HA VAL A 78 -8.245 -5.439 -8.095 1.00 0.00 H new ATOM 0 HB VAL A 78 -10.270 -4.746 -9.346 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.678 -5.697 -11.617 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.404 -4.454 -11.601 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -8.966 -6.176 -11.694 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.134 -7.067 -9.717 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -9.466 -7.675 -9.596 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -10.234 -6.898 -8.191 1.00 0.00 H new ATOM 1183 N SER A 79 -6.290 -5.568 -10.639 1.00 0.00 N ATOM 1184 CA SER A 79 -5.011 -6.170 -11.045 1.00 0.00 C ATOM 1185 C SER A 79 -3.973 -6.060 -9.917 1.00 0.00 C ATOM 1186 O SER A 79 -3.778 -4.992 -9.335 1.00 0.00 O ATOM 1187 CB SER A 79 -4.519 -5.570 -12.370 1.00 0.00 C ATOM 1188 OG SER A 79 -4.723 -4.164 -12.451 1.00 0.00 O ATOM 0 H SER A 79 -6.493 -4.693 -11.122 1.00 0.00 H new ATOM 0 HA SER A 79 -5.165 -7.234 -11.225 1.00 0.00 H new ATOM 0 HB2 SER A 79 -3.457 -5.785 -12.488 1.00 0.00 H new ATOM 0 HB3 SER A 79 -5.037 -6.055 -13.197 1.00 0.00 H new ATOM 0 HG SER A 79 -4.391 -3.834 -13.312 1.00 0.00 H new ATOM 1194 N ILE A 80 -3.335 -7.183 -9.576 1.00 0.00 N ATOM 1195 CA ILE A 80 -2.583 -7.384 -8.321 1.00 0.00 C ATOM 1196 C ILE A 80 -1.255 -8.140 -8.534 1.00 0.00 C ATOM 1197 O ILE A 80 -1.182 -8.976 -9.441 1.00 0.00 O ATOM 1198 CB ILE A 80 -3.453 -8.094 -7.250 1.00 0.00 C ATOM 1199 CG1 ILE A 80 -4.214 -9.316 -7.817 1.00 0.00 C ATOM 1200 CG2 ILE A 80 -4.393 -7.069 -6.592 1.00 0.00 C ATOM 1201 CD1 ILE A 80 -5.012 -10.102 -6.773 1.00 0.00 C ATOM 0 H ILE A 80 -3.323 -8.005 -10.179 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.327 -6.389 -7.956 1.00 0.00 H new ATOM 0 HB ILE A 80 -2.793 -8.501 -6.484 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.895 -8.975 -8.597 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -3.498 -9.987 -8.291 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.005 -7.567 -5.840 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.802 -6.285 -6.119 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -5.039 -6.628 -7.351 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -5.514 -10.941 -7.255 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -4.336 -10.477 -6.005 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.755 -9.449 -6.315 1.00 0.00 H new ATOM 1213 N PRO A 81 -0.208 -7.887 -7.714 1.00 0.00 N ATOM 1214 CA PRO A 81 -0.149 -6.908 -6.618 1.00 0.00 C ATOM 1215 C PRO A 81 -0.225 -5.452 -7.101 1.00 0.00 C ATOM 1216 O PRO A 81 0.260 -5.138 -8.189 1.00 0.00 O ATOM 1217 CB PRO A 81 1.192 -7.134 -5.905 1.00 0.00 C ATOM 1218 CG PRO A 81 1.684 -8.488 -6.404 1.00 0.00 C ATOM 1219 CD PRO A 81 1.036 -8.635 -7.776 1.00 0.00 C ATOM 0 HA PRO A 81 -1.009 -7.056 -5.965 1.00 0.00 H new ATOM 0 HB2 PRO A 81 1.904 -6.344 -6.144 1.00 0.00 H new ATOM 0 HB3 PRO A 81 1.068 -7.134 -4.822 1.00 0.00 H new ATOM 0 HG2 PRO A 81 2.772 -8.517 -6.471 1.00 0.00 H new ATOM 0 HG3 PRO A 81 1.385 -9.293 -5.733 1.00 0.00 H new ATOM 0 HD2 PRO A 81 1.687 -8.245 -8.559 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.850 -9.683 -8.009 1.00 0.00 H new ATOM 1227 N THR A 82 -0.793 -4.569 -6.274 1.00 0.00 N ATOM 1228 CA THR A 82 -0.761 -3.109 -6.470 1.00 0.00 C ATOM 1229 C THR A 82 -0.277 -2.402 -5.210 1.00 0.00 C ATOM 1230 O THR A 82 -0.831 -2.594 -4.130 1.00 0.00 O ATOM 1231 CB THR A 82 -2.128 -2.530 -6.875 1.00 0.00 C ATOM 1232 OG1 THR A 82 -2.367 -2.827 -8.227 1.00 0.00 O ATOM 1233 CG2 THR A 82 -2.191 -1.002 -6.786 1.00 0.00 C ATOM 0 H THR A 82 -1.298 -4.850 -5.433 1.00 0.00 H new ATOM 0 HA THR A 82 -0.064 -2.932 -7.289 1.00 0.00 H new ATOM 0 HB THR A 82 -2.853 -2.969 -6.189 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.862 -3.670 -8.294 1.00 0.00 H new ATOM 0 HG21 THR A 82 -3.182 -0.661 -7.085 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.994 -0.689 -5.761 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.442 -0.568 -7.449 1.00 0.00 H new ATOM 1241 N LEU A 83 0.692 -1.509 -5.384 1.00 0.00 N ATOM 1242 CA LEU A 83 1.062 -0.458 -4.445 1.00 0.00 C ATOM 1243 C LEU A 83 0.494 0.862 -4.992 1.00 0.00 C ATOM 1244 O LEU A 83 0.855 1.270 -6.096 1.00 0.00 O ATOM 1245 CB LEU A 83 2.597 -0.414 -4.329 1.00 0.00 C ATOM 1246 CG LEU A 83 3.237 -1.487 -3.424 1.00 0.00 C ATOM 1247 CD1 LEU A 83 3.092 -2.921 -3.939 1.00 0.00 C ATOM 1248 CD2 LEU A 83 4.733 -1.200 -3.330 1.00 0.00 C ATOM 0 H LEU A 83 1.268 -1.499 -6.225 1.00 0.00 H new ATOM 0 HA LEU A 83 0.659 -0.637 -3.448 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.020 -0.511 -5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.885 0.568 -3.954 1.00 0.00 H new ATOM 0 HG LEU A 83 2.715 -1.428 -2.469 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.570 -3.608 -3.241 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.035 -3.171 -4.027 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.568 -3.007 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU A 83 5.208 -1.947 -2.694 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.174 -1.238 -4.326 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.887 -0.209 -2.903 1.00 0.00 H new ATOM 1260 N ILE A 84 -0.387 1.529 -4.251 1.00 0.00 N ATOM 1261 CA ILE A 84 -1.006 2.811 -4.634 1.00 0.00 C ATOM 1262 C ILE A 84 -0.668 3.882 -3.588 1.00 0.00 C ATOM 1263 O ILE A 84 -0.853 3.686 -2.386 1.00 0.00 O ATOM 1264 CB ILE A 84 -2.523 2.639 -4.917 1.00 0.00 C ATOM 1265 CG1 ILE A 84 -3.235 3.946 -5.331 1.00 0.00 C ATOM 1266 CG2 ILE A 84 -3.280 2.023 -3.736 1.00 0.00 C ATOM 1267 CD1 ILE A 84 -2.756 4.499 -6.676 1.00 0.00 C ATOM 0 H ILE A 84 -0.704 1.190 -3.342 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.587 3.162 -5.577 1.00 0.00 H new ATOM 0 HB ILE A 84 -2.550 1.953 -5.764 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -4.309 3.766 -5.382 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -3.075 4.699 -4.559 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.335 1.927 -3.991 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.869 1.038 -3.514 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.175 2.665 -2.862 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -3.297 5.417 -6.905 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -1.688 4.711 -6.623 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.941 3.763 -7.459 1.00 0.00 H new ATOM 1279 N LEU A 85 -0.121 5.006 -4.050 1.00 0.00 N ATOM 1280 CA LEU A 85 0.416 6.083 -3.221 1.00 0.00 C ATOM 1281 C LEU A 85 -0.477 7.328 -3.314 1.00 0.00 C ATOM 1282 O LEU A 85 -0.663 7.887 -4.399 1.00 0.00 O ATOM 1283 CB LEU A 85 1.867 6.340 -3.671 1.00 0.00 C ATOM 1284 CG LEU A 85 2.679 7.277 -2.762 1.00 0.00 C ATOM 1285 CD1 LEU A 85 3.065 6.635 -1.434 1.00 0.00 C ATOM 1286 CD2 LEU A 85 3.975 7.675 -3.466 1.00 0.00 C ATOM 0 H LEU A 85 -0.037 5.198 -5.048 1.00 0.00 H new ATOM 0 HA LEU A 85 0.425 5.807 -2.167 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.385 5.383 -3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.849 6.761 -4.676 1.00 0.00 H new ATOM 0 HG LEU A 85 2.039 8.136 -2.560 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.636 7.347 -0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.163 6.349 -0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.672 5.749 -1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 85 4.550 8.339 -2.821 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.561 6.782 -3.682 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.740 8.188 -4.398 1.00 0.00 H new ATOM 1298 N PHE A 86 -0.998 7.771 -2.170 1.00 0.00 N ATOM 1299 CA PHE A 86 -1.796 8.988 -2.005 1.00 0.00 C ATOM 1300 C PHE A 86 -0.950 10.053 -1.292 1.00 0.00 C ATOM 1301 O PHE A 86 -0.350 9.756 -0.259 1.00 0.00 O ATOM 1302 CB PHE A 86 -3.081 8.689 -1.209 1.00 0.00 C ATOM 1303 CG PHE A 86 -3.962 7.570 -1.741 1.00 0.00 C ATOM 1304 CD1 PHE A 86 -3.652 6.227 -1.456 1.00 0.00 C ATOM 1305 CD2 PHE A 86 -5.127 7.868 -2.475 1.00 0.00 C ATOM 1306 CE1 PHE A 86 -4.485 5.194 -1.920 1.00 0.00 C ATOM 1307 CE2 PHE A 86 -5.951 6.834 -2.954 1.00 0.00 C ATOM 1308 CZ PHE A 86 -5.629 5.494 -2.679 1.00 0.00 C ATOM 0 H PHE A 86 -0.870 7.269 -1.292 1.00 0.00 H new ATOM 0 HA PHE A 86 -2.092 9.362 -2.985 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -2.799 8.444 -0.185 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.676 9.601 -1.166 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.771 5.989 -0.879 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -5.389 8.897 -2.671 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -4.245 4.166 -1.692 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -6.831 7.070 -3.533 1.00 0.00 H new ATOM 0 HZ PHE A 86 -6.258 4.698 -3.049 1.00 0.00 H new ATOM 1318 N LYS A 87 -0.892 11.293 -1.798 1.00 0.00 N ATOM 1319 CA LYS A 87 -0.009 12.340 -1.222 1.00 0.00 C ATOM 1320 C LYS A 87 -0.739 13.325 -0.296 1.00 0.00 C ATOM 1321 O LYS A 87 -0.156 13.821 0.666 1.00 0.00 O ATOM 1322 CB LYS A 87 0.752 13.039 -2.365 1.00 0.00 C ATOM 1323 CG LYS A 87 2.006 13.778 -1.863 1.00 0.00 C ATOM 1324 CD LYS A 87 2.763 14.546 -2.957 1.00 0.00 C ATOM 1325 CE LYS A 87 3.359 13.628 -4.031 1.00 0.00 C ATOM 1326 NZ LYS A 87 4.105 14.408 -5.055 1.00 0.00 N ATOM 0 H LYS A 87 -1.440 11.603 -2.601 1.00 0.00 H new ATOM 0 HA LYS A 87 0.710 11.853 -0.564 1.00 0.00 H new ATOM 0 HB2 LYS A 87 1.043 12.299 -3.111 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.089 13.748 -2.860 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.713 14.477 -1.080 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.683 13.055 -1.408 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.085 15.256 -3.430 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.563 15.126 -2.498 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.027 12.904 -3.564 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.561 13.062 -4.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 4.496 13.760 -5.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 3.460 15.081 -5.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 4.880 14.929 -4.598 1.00 0.00 H new ATOM 1340 N ASP A 88 -2.024 13.559 -0.555 1.00 0.00 N ATOM 1341 CA ASP A 88 -2.901 14.477 0.194 1.00 0.00 C ATOM 1342 C ASP A 88 -4.381 14.050 0.064 1.00 0.00 C ATOM 1343 O ASP A 88 -5.216 14.770 -0.489 1.00 0.00 O ATOM 1344 CB ASP A 88 -2.649 15.919 -0.292 1.00 0.00 C ATOM 1345 CG ASP A 88 -3.431 16.976 0.513 1.00 0.00 C ATOM 1346 OD1 ASP A 88 -3.558 16.833 1.753 1.00 0.00 O ATOM 1347 OD2 ASP A 88 -3.886 17.981 -0.087 1.00 0.00 O ATOM 0 H ASP A 88 -2.510 13.098 -1.324 1.00 0.00 H new ATOM 0 HA ASP A 88 -2.668 14.435 1.258 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -1.583 16.137 -0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.925 15.995 -1.344 1.00 0.00 H new ATOM 1352 N GLY A 89 -4.680 12.803 0.455 1.00 0.00 N ATOM 1353 CA GLY A 89 -6.014 12.186 0.320 1.00 0.00 C ATOM 1354 C GLY A 89 -6.471 11.964 -1.130 1.00 0.00 C ATOM 1355 O GLY A 89 -7.664 11.810 -1.392 1.00 0.00 O ATOM 0 H GLY A 89 -3.993 12.182 0.881 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.010 11.226 0.837 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.745 12.817 0.825 1.00 0.00 H new ATOM 1359 N GLN A 90 -5.526 11.992 -2.073 1.00 0.00 N ATOM 1360 CA GLN A 90 -5.723 11.852 -3.519 1.00 0.00 C ATOM 1361 C GLN A 90 -4.574 11.028 -4.134 1.00 0.00 C ATOM 1362 O GLN A 90 -3.424 11.217 -3.719 1.00 0.00 O ATOM 1363 CB GLN A 90 -5.858 13.250 -4.152 1.00 0.00 C ATOM 1364 CG GLN A 90 -4.611 14.145 -4.009 1.00 0.00 C ATOM 1365 CD GLN A 90 -4.967 15.625 -4.118 1.00 0.00 C ATOM 1366 OE1 GLN A 90 -4.907 16.236 -5.178 1.00 0.00 O ATOM 1367 NE2 GLN A 90 -5.365 16.253 -3.031 1.00 0.00 N ATOM 0 H GLN A 90 -4.543 12.121 -1.833 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.644 11.307 -3.724 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.085 13.134 -5.212 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -6.708 13.759 -3.698 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.134 13.955 -3.048 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -3.886 13.887 -4.781 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -5.418 15.753 -2.144 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -5.620 17.240 -3.076 1.00 0.00 H new ATOM 1376 N PRO A 91 -4.848 10.101 -5.074 1.00 0.00 N ATOM 1377 CA PRO A 91 -3.840 9.199 -5.628 1.00 0.00 C ATOM 1378 C PRO A 91 -2.877 9.927 -6.575 1.00 0.00 C ATOM 1379 O PRO A 91 -3.281 10.805 -7.341 1.00 0.00 O ATOM 1380 CB PRO A 91 -4.623 8.091 -6.341 1.00 0.00 C ATOM 1381 CG PRO A 91 -5.914 8.790 -6.761 1.00 0.00 C ATOM 1382 CD PRO A 91 -6.161 9.782 -5.624 1.00 0.00 C ATOM 0 HA PRO A 91 -3.202 8.789 -4.845 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -4.078 7.702 -7.201 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -4.819 7.247 -5.680 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -5.804 9.296 -7.720 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -6.738 8.084 -6.866 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -6.658 10.680 -5.991 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -6.808 9.348 -4.862 1.00 0.00 H new ATOM 1390 N VAL A 92 -1.598 9.539 -6.534 1.00 0.00 N ATOM 1391 CA VAL A 92 -0.508 10.169 -7.305 1.00 0.00 C ATOM 1392 C VAL A 92 0.339 9.153 -8.083 1.00 0.00 C ATOM 1393 O VAL A 92 0.700 9.432 -9.228 1.00 0.00 O ATOM 1394 CB VAL A 92 0.373 11.036 -6.378 1.00 0.00 C ATOM 1395 CG1 VAL A 92 1.547 11.682 -7.127 1.00 0.00 C ATOM 1396 CG2 VAL A 92 -0.449 12.178 -5.761 1.00 0.00 C ATOM 0 H VAL A 92 -1.280 8.763 -5.954 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.974 10.810 -8.053 1.00 0.00 H new ATOM 0 HB VAL A 92 0.754 10.362 -5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.136 12.281 -6.433 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.176 10.903 -7.559 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.164 12.321 -7.922 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.190 12.777 -5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.851 12.807 -6.555 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.270 11.761 -5.178 1.00 0.00 H new ATOM 1406 N LYS A 93 0.650 7.982 -7.503 1.00 0.00 N ATOM 1407 CA LYS A 93 1.567 6.995 -8.109 1.00 0.00 C ATOM 1408 C LYS A 93 1.101 5.559 -7.860 1.00 0.00 C ATOM 1409 O LYS A 93 0.783 5.210 -6.726 1.00 0.00 O ATOM 1410 CB LYS A 93 2.986 7.237 -7.554 1.00 0.00 C ATOM 1411 CG LYS A 93 4.087 6.672 -8.461 1.00 0.00 C ATOM 1412 CD LYS A 93 5.467 6.872 -7.811 1.00 0.00 C ATOM 1413 CE LYS A 93 6.618 6.505 -8.759 1.00 0.00 C ATOM 1414 NZ LYS A 93 6.831 7.544 -9.800 1.00 0.00 N ATOM 0 H LYS A 93 0.274 7.690 -6.601 1.00 0.00 H new ATOM 0 HA LYS A 93 1.573 7.127 -9.191 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.142 8.308 -7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.067 6.782 -6.567 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.912 5.611 -8.640 1.00 0.00 H new ATOM 0 HG3 LYS A 93 4.059 7.168 -9.431 1.00 0.00 H new ATOM 0 HD2 LYS A 93 5.573 7.912 -7.501 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.533 6.262 -6.910 1.00 0.00 H new ATOM 0 HE2 LYS A 93 7.535 6.374 -8.184 1.00 0.00 H new ATOM 0 HE3 LYS A 93 6.403 5.550 -9.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 7.678 7.310 -10.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 6.003 7.580 -10.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 6.961 8.470 -9.345 1.00 0.00 H new ATOM 1428 N ARG A 94 1.093 4.721 -8.902 1.00 0.00 N ATOM 1429 CA ARG A 94 0.793 3.279 -8.833 1.00 0.00 C ATOM 1430 C ARG A 94 2.001 2.449 -9.279 1.00 0.00 C ATOM 1431 O ARG A 94 2.596 2.725 -10.321 1.00 0.00 O ATOM 1432 CB ARG A 94 -0.465 2.950 -9.663 1.00 0.00 C ATOM 1433 CG ARG A 94 -0.969 1.516 -9.414 1.00 0.00 C ATOM 1434 CD ARG A 94 -2.113 1.139 -10.363 1.00 0.00 C ATOM 1435 NE ARG A 94 -2.522 -0.271 -10.194 1.00 0.00 N ATOM 1436 CZ ARG A 94 -3.256 -0.990 -11.024 1.00 0.00 C ATOM 1437 NH1 ARG A 94 -3.719 -0.522 -12.147 1.00 0.00 N ATOM 1438 NH2 ARG A 94 -3.551 -2.213 -10.721 1.00 0.00 N ATOM 0 H ARG A 94 1.302 5.034 -9.850 1.00 0.00 H new ATOM 0 HA ARG A 94 0.584 3.015 -7.796 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -1.256 3.659 -9.417 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.242 3.076 -10.723 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.145 0.814 -9.542 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -1.308 1.424 -8.382 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -2.968 1.790 -10.179 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.801 1.306 -11.394 1.00 0.00 H new ATOM 0 HE ARG A 94 -2.203 -0.739 -9.346 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -3.519 0.440 -12.420 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -4.282 -1.118 -12.754 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -3.217 -2.616 -9.846 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -4.117 -2.774 -11.358 1.00 0.00 H new ATOM 1452 N ILE A 95 2.320 1.414 -8.508 1.00 0.00 N ATOM 1453 CA ILE A 95 3.289 0.358 -8.824 1.00 0.00 C ATOM 1454 C ILE A 95 2.567 -0.985 -8.822 1.00 0.00 C ATOM 1455 O ILE A 95 1.651 -1.211 -8.032 1.00 0.00 O ATOM 1456 CB ILE A 95 4.510 0.329 -7.858 1.00 0.00 C ATOM 1457 CG1 ILE A 95 4.653 1.479 -6.828 1.00 0.00 C ATOM 1458 CG2 ILE A 95 5.803 0.152 -8.671 1.00 0.00 C ATOM 1459 CD1 ILE A 95 5.023 2.870 -7.360 1.00 0.00 C ATOM 0 H ILE A 95 1.888 1.278 -7.594 1.00 0.00 H new ATOM 0 HA ILE A 95 3.701 0.570 -9.811 1.00 0.00 H new ATOM 0 HB ILE A 95 4.312 -0.528 -7.214 1.00 0.00 H new ATOM 0 HG12 ILE A 95 3.710 1.566 -6.289 1.00 0.00 H new ATOM 0 HG13 ILE A 95 5.410 1.186 -6.101 1.00 0.00 H new ATOM 0 HG21 ILE A 95 6.658 0.132 -7.995 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.758 -0.784 -9.227 1.00 0.00 H new ATOM 0 HG23 ILE A 95 5.911 0.983 -9.368 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.088 3.572 -6.529 1.00 0.00 H new ATOM 0 HD12 ILE A 95 5.985 2.821 -7.869 1.00 0.00 H new ATOM 0 HD13 ILE A 95 4.259 3.207 -8.061 1.00 0.00 H new ATOM 1471 N VAL A 96 2.975 -1.875 -9.721 1.00 0.00 N ATOM 1472 CA VAL A 96 2.343 -3.171 -9.959 1.00 0.00 C ATOM 1473 C VAL A 96 3.389 -4.284 -10.042 1.00 0.00 C ATOM 1474 O VAL A 96 4.507 -4.063 -10.516 1.00 0.00 O ATOM 1475 CB VAL A 96 1.456 -3.125 -11.213 1.00 0.00 C ATOM 1476 CG1 VAL A 96 0.133 -2.403 -10.936 1.00 0.00 C ATOM 1477 CG2 VAL A 96 2.122 -2.486 -12.439 1.00 0.00 C ATOM 0 H VAL A 96 3.781 -1.710 -10.324 1.00 0.00 H new ATOM 0 HA VAL A 96 1.697 -3.398 -9.111 1.00 0.00 H new ATOM 0 HB VAL A 96 1.275 -4.172 -11.455 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.470 -2.388 -11.844 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.409 -2.926 -10.148 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.336 -1.380 -10.619 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.426 -2.495 -13.278 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.398 -1.457 -12.208 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.016 -3.051 -12.703 1.00 0.00 H new ATOM 1487 N GLY A 97 3.045 -5.476 -9.548 1.00 0.00 N ATOM 1488 CA GLY A 97 4.017 -6.549 -9.307 1.00 0.00 C ATOM 1489 C GLY A 97 4.794 -6.359 -7.995 1.00 0.00 C ATOM 1490 O GLY A 97 4.381 -5.598 -7.117 1.00 0.00 O ATOM 0 H GLY A 97 2.087 -5.726 -9.304 1.00 0.00 H new ATOM 0 HA2 GLY A 97 3.497 -7.506 -9.281 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.720 -6.591 -10.139 1.00 0.00 H new ATOM 1494 N ALA A 98 5.919 -7.063 -7.861 1.00 0.00 N ATOM 1495 CA ALA A 98 6.777 -7.054 -6.673 1.00 0.00 C ATOM 1496 C ALA A 98 8.204 -6.567 -6.987 1.00 0.00 C ATOM 1497 O ALA A 98 8.774 -6.921 -8.024 1.00 0.00 O ATOM 1498 CB ALA A 98 6.763 -8.460 -6.068 1.00 0.00 C ATOM 0 H ALA A 98 6.270 -7.674 -8.598 1.00 0.00 H new ATOM 0 HA ALA A 98 6.388 -6.340 -5.947 1.00 0.00 H new ATOM 0 HB1 ALA A 98 7.395 -8.480 -5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.743 -8.728 -5.793 1.00 0.00 H new ATOM 0 HB3 ALA A 98 7.141 -9.175 -6.799 1.00 0.00 H new ATOM 1504 N LYS A 99 8.780 -5.759 -6.084 1.00 0.00 N ATOM 1505 CA LYS A 99 10.132 -5.172 -6.193 1.00 0.00 C ATOM 1506 C LYS A 99 10.916 -5.279 -4.879 1.00 0.00 C ATOM 1507 O LYS A 99 10.315 -5.320 -3.805 1.00 0.00 O ATOM 1508 CB LYS A 99 10.042 -3.706 -6.655 1.00 0.00 C ATOM 1509 CG LYS A 99 9.382 -3.563 -8.037 1.00 0.00 C ATOM 1510 CD LYS A 99 9.735 -2.224 -8.691 1.00 0.00 C ATOM 1511 CE LYS A 99 8.977 -2.063 -10.011 1.00 0.00 C ATOM 1512 NZ LYS A 99 9.533 -0.945 -10.816 1.00 0.00 N ATOM 0 H LYS A 99 8.303 -5.484 -5.225 1.00 0.00 H new ATOM 0 HA LYS A 99 10.680 -5.747 -6.940 1.00 0.00 H new ATOM 0 HB2 LYS A 99 9.473 -3.132 -5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 99 11.043 -3.277 -6.688 1.00 0.00 H new ATOM 0 HG2 LYS A 99 9.705 -4.380 -8.682 1.00 0.00 H new ATOM 0 HG3 LYS A 99 8.300 -3.645 -7.935 1.00 0.00 H new ATOM 0 HD2 LYS A 99 9.484 -1.405 -8.017 1.00 0.00 H new ATOM 0 HD3 LYS A 99 10.809 -2.171 -8.871 1.00 0.00 H new ATOM 0 HE2 LYS A 99 9.035 -2.990 -10.582 1.00 0.00 H new ATOM 0 HE3 LYS A 99 7.922 -1.879 -9.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 8.759 -0.450 -11.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 10.030 -0.280 -10.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 10.200 -1.322 -11.520 1.00 0.00 H new ATOM 1526 N GLY A 100 12.250 -5.288 -4.963 1.00 0.00 N ATOM 1527 CA GLY A 100 13.153 -5.251 -3.809 1.00 0.00 C ATOM 1528 C GLY A 100 13.340 -3.835 -3.258 1.00 0.00 C ATOM 1529 O GLY A 100 12.927 -2.852 -3.878 1.00 0.00 O ATOM 0 H GLY A 100 12.743 -5.322 -5.855 1.00 0.00 H new ATOM 0 HA2 GLY A 100 12.759 -5.895 -3.022 1.00 0.00 H new ATOM 0 HA3 GLY A 100 14.123 -5.657 -4.097 1.00 0.00 H new ATOM 1533 N LYS A 101 13.997 -3.725 -2.099 1.00 0.00 N ATOM 1534 CA LYS A 101 14.213 -2.466 -1.351 1.00 0.00 C ATOM 1535 C LYS A 101 14.807 -1.334 -2.174 1.00 0.00 C ATOM 1536 O LYS A 101 14.406 -0.186 -2.005 1.00 0.00 O ATOM 1537 CB LYS A 101 15.118 -2.768 -0.145 1.00 0.00 C ATOM 1538 CG LYS A 101 15.202 -1.649 0.905 1.00 0.00 C ATOM 1539 CD LYS A 101 13.869 -1.408 1.635 1.00 0.00 C ATOM 1540 CE LYS A 101 13.983 -0.361 2.750 1.00 0.00 C ATOM 1541 NZ LYS A 101 14.994 -0.745 3.769 1.00 0.00 N ATOM 0 H LYS A 101 14.410 -4.533 -1.633 1.00 0.00 H new ATOM 0 HA LYS A 101 13.230 -2.109 -1.042 1.00 0.00 H new ATOM 0 HB2 LYS A 101 14.758 -3.675 0.341 1.00 0.00 H new ATOM 0 HB3 LYS A 101 16.123 -2.979 -0.509 1.00 0.00 H new ATOM 0 HG2 LYS A 101 15.970 -1.901 1.636 1.00 0.00 H new ATOM 0 HG3 LYS A 101 15.516 -0.725 0.419 1.00 0.00 H new ATOM 0 HD2 LYS A 101 13.119 -1.084 0.914 1.00 0.00 H new ATOM 0 HD3 LYS A 101 13.518 -2.348 2.060 1.00 0.00 H new ATOM 0 HE2 LYS A 101 14.252 0.603 2.317 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.013 -0.235 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 14.766 -0.287 4.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 14.988 -1.778 3.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 15.937 -0.439 3.455 1.00 0.00 H new ATOM 1555 N ALA A 102 15.721 -1.663 -3.078 1.00 0.00 N ATOM 1556 CA ALA A 102 16.392 -0.664 -3.910 1.00 0.00 C ATOM 1557 C ALA A 102 15.400 -0.004 -4.884 1.00 0.00 C ATOM 1558 O ALA A 102 15.229 1.217 -4.880 1.00 0.00 O ATOM 1559 CB ALA A 102 17.578 -1.325 -4.626 1.00 0.00 C ATOM 0 H ALA A 102 16.019 -2.622 -3.257 1.00 0.00 H new ATOM 0 HA ALA A 102 16.781 0.141 -3.286 1.00 0.00 H new ATOM 0 HB1 ALA A 102 18.084 -0.587 -5.249 1.00 0.00 H new ATOM 0 HB2 ALA A 102 18.277 -1.717 -3.887 1.00 0.00 H new ATOM 0 HB3 ALA A 102 17.216 -2.141 -5.252 1.00 0.00 H new ATOM 1565 N ALA A 103 14.677 -0.814 -5.661 1.00 0.00 N ATOM 1566 CA ALA A 103 13.716 -0.322 -6.642 1.00 0.00 C ATOM 1567 C ALA A 103 12.445 0.251 -5.987 1.00 0.00 C ATOM 1568 O ALA A 103 11.979 1.313 -6.413 1.00 0.00 O ATOM 1569 CB ALA A 103 13.429 -1.445 -7.640 1.00 0.00 C ATOM 0 H ALA A 103 14.744 -1.831 -5.625 1.00 0.00 H new ATOM 0 HA ALA A 103 14.144 0.524 -7.180 1.00 0.00 H new ATOM 0 HB1 ALA A 103 12.712 -1.097 -8.383 1.00 0.00 H new ATOM 0 HB2 ALA A 103 14.355 -1.735 -8.137 1.00 0.00 H new ATOM 0 HB3 ALA A 103 13.016 -2.304 -7.112 1.00 0.00 H new ATOM 1575 N LEU A 104 11.926 -0.360 -4.905 1.00 0.00 N ATOM 1576 CA LEU A 104 10.806 0.226 -4.168 1.00 0.00 C ATOM 1577 C LEU A 104 11.203 1.570 -3.538 1.00 0.00 C ATOM 1578 O LEU A 104 10.450 2.533 -3.674 1.00 0.00 O ATOM 1579 CB LEU A 104 10.238 -0.777 -3.141 1.00 0.00 C ATOM 1580 CG LEU A 104 9.011 -0.247 -2.364 1.00 0.00 C ATOM 1581 CD1 LEU A 104 7.883 0.233 -3.280 1.00 0.00 C ATOM 1582 CD2 LEU A 104 8.428 -1.328 -1.457 1.00 0.00 C ATOM 0 H LEU A 104 12.263 -1.247 -4.531 1.00 0.00 H new ATOM 0 HA LEU A 104 10.000 0.441 -4.870 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.960 -1.695 -3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.022 -1.038 -2.430 1.00 0.00 H new ATOM 0 HG LEU A 104 9.383 0.597 -1.783 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.051 0.593 -2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.248 1.042 -3.913 1.00 0.00 H new ATOM 0 HD13 LEU A 104 7.546 -0.593 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 104 7.566 -0.928 -0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.117 -2.181 -2.061 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.184 -1.648 -0.740 1.00 0.00 H new ATOM 1594 N LEU A 105 12.397 1.701 -2.939 1.00 0.00 N ATOM 1595 CA LEU A 105 12.834 3.007 -2.443 1.00 0.00 C ATOM 1596 C LEU A 105 13.164 3.993 -3.565 1.00 0.00 C ATOM 1597 O LEU A 105 12.998 5.167 -3.304 1.00 0.00 O ATOM 1598 CB LEU A 105 13.939 2.934 -1.372 1.00 0.00 C ATOM 1599 CG LEU A 105 14.229 4.298 -0.681 1.00 0.00 C ATOM 1600 CD1 LEU A 105 13.012 4.940 -0.002 1.00 0.00 C ATOM 1601 CD2 LEU A 105 15.283 4.093 0.405 1.00 0.00 C ATOM 0 H LEU A 105 13.058 0.939 -2.791 1.00 0.00 H new ATOM 0 HA LEU A 105 11.964 3.412 -1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 105 13.651 2.206 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 105 14.856 2.568 -1.833 1.00 0.00 H new ATOM 0 HG LEU A 105 14.555 4.965 -1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 105 13.306 5.886 0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.234 5.121 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 105 12.630 4.270 0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 105 15.492 5.045 0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 105 14.913 3.380 1.142 1.00 0.00 H new ATOM 0 HD23 LEU A 105 16.198 3.708 -0.044 1.00 0.00 H new ATOM 1613 N ARG A 106 13.538 3.632 -4.802 1.00 0.00 N ATOM 1614 CA ARG A 106 13.557 4.634 -5.903 1.00 0.00 C ATOM 1615 C ARG A 106 12.152 5.163 -6.222 1.00 0.00 C ATOM 1616 O ARG A 106 11.910 6.381 -6.214 1.00 0.00 O ATOM 1617 CB ARG A 106 14.237 4.080 -7.169 1.00 0.00 C ATOM 1618 CG ARG A 106 15.759 3.878 -7.059 1.00 0.00 C ATOM 1619 CD ARG A 106 16.528 5.087 -6.507 1.00 0.00 C ATOM 1620 NE ARG A 106 16.324 6.303 -7.324 1.00 0.00 N ATOM 1621 CZ ARG A 106 16.405 7.558 -6.919 1.00 0.00 C ATOM 1622 NH1 ARG A 106 16.664 7.877 -5.682 1.00 0.00 N ATOM 1623 NH2 ARG A 106 16.223 8.533 -7.763 1.00 0.00 N ATOM 0 H ARG A 106 13.824 2.690 -5.070 1.00 0.00 H new ATOM 0 HA ARG A 106 14.152 5.475 -5.548 1.00 0.00 H new ATOM 0 HB2 ARG A 106 13.777 3.125 -7.421 1.00 0.00 H new ATOM 0 HB3 ARG A 106 14.035 4.759 -7.997 1.00 0.00 H new ATOM 0 HG2 ARG A 106 15.952 3.018 -6.418 1.00 0.00 H new ATOM 0 HG3 ARG A 106 16.152 3.634 -8.046 1.00 0.00 H new ATOM 0 HD2 ARG A 106 16.208 5.282 -5.483 1.00 0.00 H new ATOM 0 HD3 ARG A 106 17.592 4.852 -6.469 1.00 0.00 H new ATOM 0 HE ARG A 106 16.096 6.157 -8.307 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.813 7.145 -4.987 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.718 8.858 -5.409 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.017 8.329 -8.741 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.286 9.500 -7.446 1.00 0.00 H new ATOM 1637 N GLU A 107 11.209 4.242 -6.407 1.00 0.00 N ATOM 1638 CA GLU A 107 9.808 4.565 -6.702 1.00 0.00 C ATOM 1639 C GLU A 107 9.138 5.392 -5.591 1.00 0.00 C ATOM 1640 O GLU A 107 8.262 6.207 -5.883 1.00 0.00 O ATOM 1641 CB GLU A 107 9.019 3.270 -6.973 1.00 0.00 C ATOM 1642 CG GLU A 107 8.907 2.947 -8.469 1.00 0.00 C ATOM 1643 CD GLU A 107 10.221 2.495 -9.132 1.00 0.00 C ATOM 1644 OE1 GLU A 107 11.070 3.354 -9.470 1.00 0.00 O ATOM 1645 OE2 GLU A 107 10.354 1.278 -9.409 1.00 0.00 O ATOM 0 H GLU A 107 11.394 3.240 -6.357 1.00 0.00 H new ATOM 0 HA GLU A 107 9.800 5.190 -7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 107 9.505 2.439 -6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 107 8.019 3.363 -6.550 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.161 2.164 -8.602 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.538 3.830 -8.990 1.00 0.00 H new ATOM 1652 N LEU A 108 9.583 5.241 -4.339 1.00 0.00 N ATOM 1653 CA LEU A 108 9.163 6.069 -3.206 1.00 0.00 C ATOM 1654 C LEU A 108 10.063 7.289 -2.980 1.00 0.00 C ATOM 1655 O LEU A 108 9.561 8.310 -2.527 1.00 0.00 O ATOM 1656 CB LEU A 108 9.071 5.201 -1.946 1.00 0.00 C ATOM 1657 CG LEU A 108 8.035 4.069 -2.060 1.00 0.00 C ATOM 1658 CD1 LEU A 108 8.158 3.176 -0.831 1.00 0.00 C ATOM 1659 CD2 LEU A 108 6.599 4.589 -2.167 1.00 0.00 C ATOM 0 H LEU A 108 10.260 4.523 -4.081 1.00 0.00 H new ATOM 0 HA LEU A 108 8.179 6.475 -3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 108 10.050 4.769 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 108 8.816 5.833 -1.096 1.00 0.00 H new ATOM 0 HG LEU A 108 8.243 3.516 -2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 108 7.430 2.367 -0.895 1.00 0.00 H new ATOM 0 HD12 LEU A 108 9.163 2.757 -0.785 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.969 3.764 0.067 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.912 3.747 -2.245 1.00 0.00 H new ATOM 0 HD22 LEU A 108 6.357 5.174 -1.280 1.00 0.00 H new ATOM 0 HD23 LEU A 108 6.505 5.217 -3.053 1.00 0.00 H new ATOM 1671 N SER A 109 11.348 7.244 -3.343 1.00 0.00 N ATOM 1672 CA SER A 109 12.281 8.390 -3.290 1.00 0.00 C ATOM 1673 C SER A 109 11.783 9.534 -4.178 1.00 0.00 C ATOM 1674 O SER A 109 12.018 10.706 -3.885 1.00 0.00 O ATOM 1675 CB SER A 109 13.699 8.077 -3.780 1.00 0.00 C ATOM 1676 OG SER A 109 14.405 7.313 -2.832 1.00 0.00 O ATOM 0 H SER A 109 11.786 6.391 -3.692 1.00 0.00 H new ATOM 0 HA SER A 109 12.316 8.652 -2.233 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.650 7.535 -4.724 1.00 0.00 H new ATOM 0 HB3 SER A 109 14.234 9.007 -3.974 1.00 0.00 H new ATOM 0 HG SER A 109 14.295 6.360 -3.032 1.00 0.00 H new ATOM 1682 N ASP A 110 11.044 9.192 -5.243 1.00 0.00 N ATOM 1683 CA ASP A 110 10.279 10.147 -6.064 1.00 0.00 C ATOM 1684 C ASP A 110 9.320 11.062 -5.251 1.00 0.00 C ATOM 1685 O ASP A 110 8.953 12.144 -5.714 1.00 0.00 O ATOM 1686 CB ASP A 110 9.507 9.330 -7.112 1.00 0.00 C ATOM 1687 CG ASP A 110 8.893 10.180 -8.236 1.00 0.00 C ATOM 1688 OD1 ASP A 110 9.592 11.057 -8.799 1.00 0.00 O ATOM 1689 OD2 ASP A 110 7.730 9.906 -8.617 1.00 0.00 O ATOM 0 H ASP A 110 10.958 8.228 -5.565 1.00 0.00 H new ATOM 0 HA ASP A 110 10.981 10.839 -6.530 1.00 0.00 H new ATOM 0 HB2 ASP A 110 10.180 8.594 -7.552 1.00 0.00 H new ATOM 0 HB3 ASP A 110 8.712 8.776 -6.613 1.00 0.00 H new ATOM 1694 N VAL A 111 8.949 10.663 -4.024 1.00 0.00 N ATOM 1695 CA VAL A 111 8.169 11.427 -3.030 1.00 0.00 C ATOM 1696 C VAL A 111 8.954 11.677 -1.723 1.00 0.00 C ATOM 1697 O VAL A 111 8.716 12.679 -1.047 1.00 0.00 O ATOM 1698 CB VAL A 111 6.838 10.679 -2.779 1.00 0.00 C ATOM 1699 CG1 VAL A 111 6.023 11.228 -1.606 1.00 0.00 C ATOM 1700 CG2 VAL A 111 5.962 10.763 -4.038 1.00 0.00 C ATOM 0 H VAL A 111 9.201 9.738 -3.675 1.00 0.00 H new ATOM 0 HA VAL A 111 7.960 12.421 -3.427 1.00 0.00 H new ATOM 0 HB VAL A 111 7.115 9.654 -2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 111 5.106 10.649 -1.498 1.00 0.00 H new ATOM 0 HG12 VAL A 111 6.609 11.155 -0.690 1.00 0.00 H new ATOM 0 HG13 VAL A 111 5.773 12.272 -1.794 1.00 0.00 H new ATOM 0 HG21 VAL A 111 5.023 10.237 -3.864 1.00 0.00 H new ATOM 0 HG22 VAL A 111 5.755 11.808 -4.268 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.485 10.304 -4.877 1.00 0.00 H new ATOM 1710 N VAL A 112 9.905 10.804 -1.373 1.00 0.00 N ATOM 1711 CA VAL A 112 10.682 10.790 -0.119 1.00 0.00 C ATOM 1712 C VAL A 112 12.130 11.258 -0.363 1.00 0.00 C ATOM 1713 O VAL A 112 12.987 10.442 -0.711 1.00 0.00 O ATOM 1714 CB VAL A 112 10.632 9.379 0.527 1.00 0.00 C ATOM 1715 CG1 VAL A 112 11.380 9.361 1.867 1.00 0.00 C ATOM 1716 CG2 VAL A 112 9.187 8.933 0.797 1.00 0.00 C ATOM 0 H VAL A 112 10.173 10.039 -1.993 1.00 0.00 H new ATOM 0 HA VAL A 112 10.232 11.494 0.581 1.00 0.00 H new ATOM 0 HB VAL A 112 11.104 8.699 -0.182 1.00 0.00 H new ATOM 0 HG11 VAL A 112 11.330 8.361 2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 112 12.423 9.634 1.705 1.00 0.00 H new ATOM 0 HG13 VAL A 112 10.920 10.075 2.550 1.00 0.00 H new ATOM 0 HG21 VAL A 112 9.191 7.941 1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 112 8.709 9.639 1.476 1.00 0.00 H new ATOM 0 HG23 VAL A 112 8.634 8.901 -0.142 1.00 0.00 H new ATOM 1726 N PRO A 113 12.467 12.546 -0.138 1.00 0.00 N ATOM 1727 CA PRO A 113 13.846 13.037 -0.253 1.00 0.00 C ATOM 1728 C PRO A 113 14.765 12.535 0.878 1.00 0.00 C ATOM 1729 O PRO A 113 15.985 12.685 0.799 1.00 0.00 O ATOM 1730 CB PRO A 113 13.722 14.564 -0.251 1.00 0.00 C ATOM 1731 CG PRO A 113 12.485 14.810 0.610 1.00 0.00 C ATOM 1732 CD PRO A 113 11.577 13.640 0.235 1.00 0.00 C ATOM 0 HA PRO A 113 14.319 12.661 -1.160 1.00 0.00 H new ATOM 0 HB2 PRO A 113 14.608 15.040 0.170 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.597 14.960 -1.259 1.00 0.00 H new ATOM 0 HG2 PRO A 113 12.725 14.811 1.673 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.021 15.771 0.387 1.00 0.00 H new ATOM 0 HD2 PRO A 113 10.939 13.356 1.072 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.918 13.906 -0.591 1.00 0.00 H new ATOM 1740 N ASN A 114 14.202 11.905 1.920 1.00 0.00 N ATOM 1741 CA ASN A 114 14.908 11.448 3.126 1.00 0.00 C ATOM 1742 C ASN A 114 15.854 10.238 2.902 1.00 0.00 C ATOM 1743 O ASN A 114 16.425 9.702 3.854 1.00 0.00 O ATOM 1744 CB ASN A 114 13.845 11.209 4.219 1.00 0.00 C ATOM 1745 CG ASN A 114 14.373 11.211 5.648 1.00 0.00 C ATOM 1746 OD1 ASN A 114 15.498 11.587 5.954 1.00 0.00 O ATOM 1747 ND2 ASN A 114 13.545 10.822 6.587 1.00 0.00 N ATOM 0 H ASN A 114 13.205 11.692 1.947 1.00 0.00 H new ATOM 0 HA ASN A 114 15.604 12.224 3.445 1.00 0.00 H new ATOM 0 HB2 ASN A 114 13.077 11.978 4.131 1.00 0.00 H new ATOM 0 HB3 ASN A 114 13.360 10.251 4.029 1.00 0.00 H new ATOM 0 HD21 ASN A 114 13.839 10.834 7.564 1.00 0.00 H new ATOM 0 HD22 ASN A 114 12.606 10.507 6.341 1.00 0.00 H new ATOM 1754 N LEU A 115 16.047 9.788 1.653 1.00 0.00 N ATOM 1755 CA LEU A 115 17.189 8.946 1.261 1.00 0.00 C ATOM 1756 C LEU A 115 18.533 9.691 1.437 1.00 0.00 C ATOM 1757 O LEU A 115 19.546 9.059 1.748 1.00 0.00 O ATOM 1758 CB LEU A 115 16.952 8.461 -0.188 1.00 0.00 C ATOM 1759 CG LEU A 115 18.101 7.619 -0.791 1.00 0.00 C ATOM 1760 CD1 LEU A 115 17.562 6.586 -1.781 1.00 0.00 C ATOM 1761 CD2 LEU A 115 19.107 8.473 -1.574 1.00 0.00 C ATOM 0 H LEU A 115 15.413 9.999 0.882 1.00 0.00 H new ATOM 0 HA LEU A 115 17.260 8.077 1.915 1.00 0.00 H new ATOM 0 HB2 LEU A 115 16.037 7.870 -0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 115 16.786 9.331 -0.824 1.00 0.00 H new ATOM 0 HG LEU A 115 18.589 7.147 0.062 1.00 0.00 H new ATOM 0 HD11 LEU A 115 18.390 6.008 -2.190 1.00 0.00 H new ATOM 0 HD12 LEU A 115 16.871 5.917 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 115 17.040 7.096 -2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 115 19.892 7.833 -1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 115 18.596 8.978 -2.394 1.00 0.00 H new ATOM 0 HD23 LEU A 115 19.549 9.216 -0.910 1.00 0.00 H new ATOM 1773 N ASN A 116 18.539 11.022 1.262 1.00 0.00 N ATOM 1774 CA ASN A 116 19.710 11.903 1.397 1.00 0.00 C ATOM 1775 C ASN A 116 19.869 12.431 2.841 1.00 0.00 C ATOM 1776 O ASN A 116 19.214 13.440 3.194 1.00 0.00 O ATOM 1777 CB ASN A 116 19.603 13.009 0.319 1.00 0.00 C ATOM 1778 CG ASN A 116 20.771 13.988 0.311 1.00 0.00 C ATOM 1779 OD1 ASN A 116 21.608 13.996 -0.583 1.00 0.00 O ATOM 1780 ND2 ASN A 116 20.854 14.847 1.300 1.00 0.00 N ATOM 1781 OXT ASN A 116 20.680 11.853 3.601 1.00 0.00 O ATOM 0 H ASN A 116 17.693 11.535 1.012 1.00 0.00 H new ATOM 0 HA ASN A 116 20.632 11.350 1.220 1.00 0.00 H new ATOM 0 HB2 ASN A 116 19.531 12.539 -0.662 1.00 0.00 H new ATOM 0 HB3 ASN A 116 18.678 13.565 0.475 1.00 0.00 H new ATOM 0 HD21 ASN A 116 21.617 15.523 1.325 1.00 0.00 H new ATOM 0 HD22 ASN A 116 20.155 14.838 2.043 1.00 0.00 H new TER 1788 ASN A 116