USER MOD reduce.3.24.130724 H: found=0, std=0, add=651, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 649 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0217 USER MOD Single : A 8 GLN :FLIP amide:sc= -0.47 F(o=-1.8,f=-0.47) USER MOD Single : A 10 ASN : amide:sc= -0.0566 X(o=-0.057,f=0) USER MOD Single : A 12 THR OG1 : rot 27:sc= 0.607 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.465 USER MOD Single : A 16 GLN : amide:sc= -0.864 X(o=-0.86,f=-0.76) USER MOD Single : A 18 GLN : amide:sc= -0.417 K(o=-0.42,f=-2) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00484 USER MOD Single : A 30 HIS :FLIP no HD1:sc= 0.31 F(o=-2.4,f=0.36) USER MOD Single : A 31 TYR OH : rot 180:sc= -0.0253 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -2.11 K(o=-2.1,f=-6.8!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 71 GLN : amide:sc=-0.00684 K(o=-0.0068,f=-1.5) USER MOD Single : A 74 GLN : amide:sc= -0.107 K(o=-0.11,f=-1.6) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 47:sc= 1.09 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.349 10.027 29.636 1.00 0.00 N ATOM 2 CA GLY A 1 8.425 9.134 29.247 1.00 0.00 C ATOM 3 C GLY A 1 7.969 8.066 28.274 1.00 0.00 C ATOM 4 O GLY A 1 6.993 7.360 28.529 1.00 0.00 O ATOM 0 H1 GLY A 1 7.712 10.739 30.302 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.971 10.503 28.792 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.592 9.480 30.093 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.229 9.714 28.794 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.838 8.658 30.137 1.00 0.00 H new ATOM 8 N SER A 2 8.675 7.947 27.154 1.00 0.00 N ATOM 9 CA SER A 2 8.334 6.960 26.136 1.00 0.00 C ATOM 10 C SER A 2 9.574 6.194 25.684 1.00 0.00 C ATOM 11 O SER A 2 10.683 6.726 25.695 1.00 0.00 O ATOM 12 CB SER A 2 7.675 7.643 24.934 1.00 0.00 C ATOM 13 OG SER A 2 6.276 7.765 25.122 1.00 0.00 O ATOM 0 H SER A 2 9.487 8.522 26.929 1.00 0.00 H new ATOM 0 HA SER A 2 7.631 6.251 26.573 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.113 8.630 24.787 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.875 7.068 24.030 1.00 0.00 H new ATOM 0 HG SER A 2 5.878 8.206 24.342 1.00 0.00 H new ATOM 19 N SER A 3 9.375 4.942 25.287 1.00 0.00 N ATOM 20 CA SER A 3 10.476 4.100 24.835 1.00 0.00 C ATOM 21 C SER A 3 11.347 4.841 23.824 1.00 0.00 C ATOM 22 O SER A 3 10.852 5.635 23.025 1.00 0.00 O ATOM 23 CB SER A 3 9.938 2.811 24.212 1.00 0.00 C ATOM 24 OG SER A 3 10.996 1.973 23.777 1.00 0.00 O ATOM 0 H SER A 3 8.462 4.488 25.269 1.00 0.00 H new ATOM 0 HA SER A 3 11.088 3.849 25.701 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.325 2.280 24.940 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.292 3.053 23.368 1.00 0.00 H new ATOM 0 HG SER A 3 10.625 1.155 23.384 1.00 0.00 H new ATOM 30 N GLY A 4 12.649 4.574 23.866 1.00 0.00 N ATOM 31 CA GLY A 4 13.569 5.224 22.951 1.00 0.00 C ATOM 32 C GLY A 4 14.641 4.281 22.441 1.00 0.00 C ATOM 33 O GLY A 4 15.788 4.335 22.887 1.00 0.00 O ATOM 0 H GLY A 4 13.083 3.919 24.517 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.012 5.627 22.105 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.041 6.068 23.454 1.00 0.00 H new ATOM 37 N SER A 5 14.268 3.413 21.505 1.00 0.00 N ATOM 38 CA SER A 5 15.206 2.451 20.938 1.00 0.00 C ATOM 39 C SER A 5 15.769 2.956 19.613 1.00 0.00 C ATOM 40 O SER A 5 15.057 3.565 18.815 1.00 0.00 O ATOM 41 CB SER A 5 14.519 1.100 20.732 1.00 0.00 C ATOM 42 OG SER A 5 14.500 0.348 21.933 1.00 0.00 O ATOM 0 H SER A 5 13.324 3.356 21.124 1.00 0.00 H new ATOM 0 HA SER A 5 16.032 2.328 21.639 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.499 1.257 20.382 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.040 0.539 19.956 1.00 0.00 H new ATOM 0 HG SER A 5 14.054 -0.510 21.775 1.00 0.00 H new ATOM 48 N SER A 6 17.053 2.699 19.387 1.00 0.00 N ATOM 49 CA SER A 6 17.714 3.129 18.161 1.00 0.00 C ATOM 50 C SER A 6 18.270 1.933 17.393 1.00 0.00 C ATOM 51 O SER A 6 18.175 0.793 17.845 1.00 0.00 O ATOM 52 CB SER A 6 18.844 4.111 18.483 1.00 0.00 C ATOM 53 OG SER A 6 19.251 4.819 17.325 1.00 0.00 O ATOM 0 H SER A 6 17.656 2.195 20.037 1.00 0.00 H new ATOM 0 HA SER A 6 16.974 3.628 17.536 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.511 4.815 19.245 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.693 3.569 18.899 1.00 0.00 H new ATOM 0 HG SER A 6 19.972 5.440 17.558 1.00 0.00 H new ATOM 59 N GLY A 7 18.850 2.204 16.227 1.00 0.00 N ATOM 60 CA GLY A 7 19.411 1.141 15.415 1.00 0.00 C ATOM 61 C GLY A 7 19.092 1.308 13.942 1.00 0.00 C ATOM 62 O GLY A 7 19.678 2.155 13.266 1.00 0.00 O ATOM 0 H GLY A 7 18.941 3.140 15.831 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.492 1.117 15.549 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.026 0.182 15.761 1.00 0.00 H new ATOM 66 N GLN A 8 18.165 0.498 13.443 1.00 0.00 N ATOM 67 CA GLN A 8 17.772 0.559 12.040 1.00 0.00 C ATOM 68 C GLN A 8 16.501 1.385 11.866 1.00 0.00 C ATOM 69 O GLN A 8 15.410 0.945 12.227 1.00 0.00 O ATOM 70 CB GLN A 8 17.558 -0.851 11.487 1.00 0.00 C ATOM 71 CG GLN A 8 18.825 -1.490 10.941 1.00 0.00 C ATOM 72 CD GLN A 8 19.417 -0.712 9.782 1.00 0.00 C ATOM 73 OE1 GLN A 8 18.913 -0.963 8.580 1.00 0.00 O flip ATOM 74 NE2 GLN A 8 20.319 0.106 9.965 1.00 0.00 N flip ATOM 0 H GLN A 8 17.672 -0.208 13.989 1.00 0.00 H new ATOM 0 HA GLN A 8 18.576 1.042 11.484 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.153 -1.484 12.276 1.00 0.00 H new ATOM 0 HB3 GLN A 8 16.810 -0.812 10.695 1.00 0.00 H new ATOM 0 HG2 GLN A 8 19.563 -1.564 11.739 1.00 0.00 H new ATOM 0 HG3 GLN A 8 18.604 -2.507 10.616 1.00 0.00 H new ATOM 0 HE21 GLN A 8 20.677 0.268 10.906 1.00 0.00 H new ATOM 0 HE22 GLN A 8 20.708 0.621 9.175 1.00 0.00 H new ATOM 83 N ARG A 9 16.652 2.582 11.309 1.00 0.00 N ATOM 84 CA ARG A 9 15.517 3.470 11.089 1.00 0.00 C ATOM 85 C ARG A 9 14.614 2.933 9.981 1.00 0.00 C ATOM 86 O ARG A 9 13.408 2.783 10.169 1.00 0.00 O ATOM 87 CB ARG A 9 16.003 4.875 10.729 1.00 0.00 C ATOM 88 CG ARG A 9 16.542 5.656 11.917 1.00 0.00 C ATOM 89 CD ARG A 9 17.281 6.908 11.471 1.00 0.00 C ATOM 90 NE ARG A 9 18.512 6.590 10.752 1.00 0.00 N ATOM 91 CZ ARG A 9 19.421 7.497 10.415 1.00 0.00 C ATOM 92 NH1 ARG A 9 19.239 8.772 10.731 1.00 0.00 N ATOM 93 NH2 ARG A 9 20.516 7.130 9.762 1.00 0.00 N ATOM 0 H ARG A 9 17.549 2.959 11.002 1.00 0.00 H new ATOM 0 HA ARG A 9 14.941 3.518 12.013 1.00 0.00 H new ATOM 0 HB2 ARG A 9 16.783 4.798 9.972 1.00 0.00 H new ATOM 0 HB3 ARG A 9 15.179 5.432 10.282 1.00 0.00 H new ATOM 0 HG2 ARG A 9 15.719 5.933 12.575 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.214 5.022 12.496 1.00 0.00 H new ATOM 0 HD2 ARG A 9 16.631 7.504 10.831 1.00 0.00 H new ATOM 0 HD3 ARG A 9 17.517 7.519 12.342 1.00 0.00 H new ATOM 0 HE ARG A 9 18.683 5.618 10.495 1.00 0.00 H new ATOM 0 HH11 ARG A 9 18.399 9.058 11.234 1.00 0.00 H new ATOM 0 HH12 ARG A 9 19.939 9.467 10.471 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.660 6.150 9.518 1.00 0.00 H new ATOM 0 HH22 ARG A 9 21.214 7.828 9.504 1.00 0.00 H new ATOM 107 N ASN A 10 15.209 2.647 8.828 1.00 0.00 N ATOM 108 CA ASN A 10 14.458 2.128 7.690 1.00 0.00 C ATOM 109 C ASN A 10 15.208 0.979 7.022 1.00 0.00 C ATOM 110 O ASN A 10 16.364 1.127 6.625 1.00 0.00 O ATOM 111 CB ASN A 10 14.198 3.241 6.674 1.00 0.00 C ATOM 112 CG ASN A 10 13.027 4.121 7.067 1.00 0.00 C ATOM 113 OD1 ASN A 10 13.184 5.323 7.283 1.00 0.00 O ATOM 114 ND2 ASN A 10 11.844 3.524 7.160 1.00 0.00 N ATOM 0 H ASN A 10 16.207 2.765 8.657 1.00 0.00 H new ATOM 0 HA ASN A 10 13.504 1.751 8.058 1.00 0.00 H new ATOM 0 HB2 ASN A 10 15.093 3.855 6.575 1.00 0.00 H new ATOM 0 HB3 ASN A 10 14.005 2.799 5.697 1.00 0.00 H new ATOM 0 HD21 ASN A 10 11.019 4.065 7.419 1.00 0.00 H new ATOM 0 HD22 ASN A 10 11.761 2.525 6.972 1.00 0.00 H new ATOM 121 N ARG A 11 14.541 -0.164 6.902 1.00 0.00 N ATOM 122 CA ARG A 11 15.145 -1.339 6.283 1.00 0.00 C ATOM 123 C ARG A 11 14.719 -1.462 4.823 1.00 0.00 C ATOM 124 O ARG A 11 13.532 -1.397 4.502 1.00 0.00 O ATOM 125 CB ARG A 11 14.752 -2.604 7.048 1.00 0.00 C ATOM 126 CG ARG A 11 15.658 -3.791 6.767 1.00 0.00 C ATOM 127 CD ARG A 11 16.969 -3.684 7.528 1.00 0.00 C ATOM 128 NE ARG A 11 17.646 -4.974 7.637 1.00 0.00 N ATOM 129 CZ ARG A 11 18.885 -5.118 8.093 1.00 0.00 C ATOM 130 NH1 ARG A 11 19.579 -4.057 8.480 1.00 0.00 N ATOM 131 NH2 ARG A 11 19.433 -6.325 8.162 1.00 0.00 N ATOM 0 H ARG A 11 13.583 -0.302 7.225 1.00 0.00 H new ATOM 0 HA ARG A 11 16.228 -1.222 6.320 1.00 0.00 H new ATOM 0 HB2 ARG A 11 14.767 -2.391 8.117 1.00 0.00 H new ATOM 0 HB3 ARG A 11 13.727 -2.871 6.790 1.00 0.00 H new ATOM 0 HG2 ARG A 11 15.148 -4.713 7.046 1.00 0.00 H new ATOM 0 HG3 ARG A 11 15.861 -3.850 5.698 1.00 0.00 H new ATOM 0 HD2 ARG A 11 17.623 -2.973 7.024 1.00 0.00 H new ATOM 0 HD3 ARG A 11 16.778 -3.290 8.526 1.00 0.00 H new ATOM 0 HE ARG A 11 17.139 -5.810 7.347 1.00 0.00 H new ATOM 0 HH11 ARG A 11 19.162 -3.128 8.428 1.00 0.00 H new ATOM 0 HH12 ARG A 11 20.530 -4.170 8.830 1.00 0.00 H new ATOM 0 HH21 ARG A 11 18.902 -7.144 7.865 1.00 0.00 H new ATOM 0 HH22 ARG A 11 20.385 -6.434 8.512 1.00 0.00 H new ATOM 145 N THR A 12 15.697 -1.641 3.939 1.00 0.00 N ATOM 146 CA THR A 12 15.426 -1.772 2.513 1.00 0.00 C ATOM 147 C THR A 12 15.148 -3.222 2.138 1.00 0.00 C ATOM 148 O THR A 12 16.017 -4.084 2.267 1.00 0.00 O ATOM 149 CB THR A 12 16.601 -1.250 1.668 1.00 0.00 C ATOM 150 OG1 THR A 12 17.791 -1.984 1.978 1.00 0.00 O ATOM 151 CG2 THR A 12 16.834 0.232 1.918 1.00 0.00 C ATOM 0 H THR A 12 16.685 -1.698 4.187 1.00 0.00 H new ATOM 0 HA THR A 12 14.542 -1.170 2.302 1.00 0.00 H new ATOM 0 HB THR A 12 16.352 -1.389 0.616 1.00 0.00 H new ATOM 0 HG1 THR A 12 17.550 -2.879 2.295 1.00 0.00 H new ATOM 0 HG21 THR A 12 17.670 0.577 1.309 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.937 0.791 1.653 1.00 0.00 H new ATOM 0 HG23 THR A 12 17.063 0.392 2.972 1.00 0.00 H new ATOM 159 N SER A 13 13.931 -3.486 1.672 1.00 0.00 N ATOM 160 CA SER A 13 13.538 -4.835 1.280 1.00 0.00 C ATOM 161 C SER A 13 13.139 -4.878 -0.192 1.00 0.00 C ATOM 162 O SER A 13 13.705 -5.639 -0.978 1.00 0.00 O ATOM 163 CB SER A 13 12.378 -5.323 2.149 1.00 0.00 C ATOM 164 OG SER A 13 12.800 -5.553 3.482 1.00 0.00 O ATOM 0 H SER A 13 13.200 -2.784 1.557 1.00 0.00 H new ATOM 0 HA SER A 13 14.394 -5.494 1.426 1.00 0.00 H new ATOM 0 HB2 SER A 13 11.577 -4.584 2.140 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.968 -6.242 1.731 1.00 0.00 H new ATOM 0 HG SER A 13 12.040 -5.863 4.017 1.00 0.00 H new ATOM 170 N PHE A 14 12.162 -4.055 -0.559 1.00 0.00 N ATOM 171 CA PHE A 14 11.686 -4.000 -1.936 1.00 0.00 C ATOM 172 C PHE A 14 12.390 -2.889 -2.710 1.00 0.00 C ATOM 173 O PHE A 14 13.041 -2.024 -2.124 1.00 0.00 O ATOM 174 CB PHE A 14 10.173 -3.778 -1.967 1.00 0.00 C ATOM 175 CG PHE A 14 9.399 -4.810 -1.197 1.00 0.00 C ATOM 176 CD1 PHE A 14 9.205 -4.675 0.168 1.00 0.00 C ATOM 177 CD2 PHE A 14 8.869 -5.918 -1.838 1.00 0.00 C ATOM 178 CE1 PHE A 14 8.494 -5.623 0.879 1.00 0.00 C ATOM 179 CE2 PHE A 14 8.156 -6.869 -1.132 1.00 0.00 C ATOM 180 CZ PHE A 14 7.970 -6.723 0.228 1.00 0.00 C ATOM 0 H PHE A 14 11.685 -3.417 0.078 1.00 0.00 H new ATOM 0 HA PHE A 14 11.916 -4.953 -2.412 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.950 -2.791 -1.561 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.835 -3.780 -3.003 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.614 -3.818 0.683 1.00 0.00 H new ATOM 0 HD2 PHE A 14 9.014 -6.040 -2.901 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.348 -5.504 1.942 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.745 -7.726 -1.644 1.00 0.00 H new ATOM 0 HZ PHE A 14 7.416 -7.467 0.782 1.00 0.00 H new ATOM 190 N THR A 15 12.255 -2.919 -4.033 1.00 0.00 N ATOM 191 CA THR A 15 12.878 -1.918 -4.887 1.00 0.00 C ATOM 192 C THR A 15 11.829 -1.036 -5.556 1.00 0.00 C ATOM 193 O THR A 15 10.692 -1.459 -5.764 1.00 0.00 O ATOM 194 CB THR A 15 13.751 -2.573 -5.975 1.00 0.00 C ATOM 195 OG1 THR A 15 12.928 -3.314 -6.883 1.00 0.00 O ATOM 196 CG2 THR A 15 14.789 -3.494 -5.353 1.00 0.00 C ATOM 0 H THR A 15 11.719 -3.627 -4.535 1.00 0.00 H new ATOM 0 HA THR A 15 13.510 -1.304 -4.245 1.00 0.00 H new ATOM 0 HB THR A 15 14.270 -1.784 -6.519 1.00 0.00 H new ATOM 0 HG1 THR A 15 13.490 -3.726 -7.572 1.00 0.00 H new ATOM 0 HG21 THR A 15 15.393 -3.945 -6.140 1.00 0.00 H new ATOM 0 HG22 THR A 15 15.432 -2.920 -4.686 1.00 0.00 H new ATOM 0 HG23 THR A 15 14.287 -4.278 -4.787 1.00 0.00 H new ATOM 204 N GLN A 16 12.220 0.190 -5.891 1.00 0.00 N ATOM 205 CA GLN A 16 11.311 1.130 -6.536 1.00 0.00 C ATOM 206 C GLN A 16 10.664 0.504 -7.768 1.00 0.00 C ATOM 207 O GLN A 16 9.542 0.853 -8.133 1.00 0.00 O ATOM 208 CB GLN A 16 12.059 2.405 -6.931 1.00 0.00 C ATOM 209 CG GLN A 16 11.149 3.604 -7.142 1.00 0.00 C ATOM 210 CD GLN A 16 10.490 3.604 -8.507 1.00 0.00 C ATOM 211 OE1 GLN A 16 9.265 3.661 -8.618 1.00 0.00 O ATOM 212 NE2 GLN A 16 11.302 3.539 -9.556 1.00 0.00 N ATOM 0 H GLN A 16 13.158 0.555 -5.727 1.00 0.00 H new ATOM 0 HA GLN A 16 10.525 1.383 -5.824 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.787 2.644 -6.156 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.619 2.219 -7.847 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.379 3.611 -6.371 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.728 4.520 -7.022 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.312 3.493 -9.417 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.916 3.535 -10.500 1.00 0.00 H new ATOM 221 N GLU A 17 11.379 -0.420 -8.401 1.00 0.00 N ATOM 222 CA GLU A 17 10.874 -1.092 -9.591 1.00 0.00 C ATOM 223 C GLU A 17 9.714 -2.019 -9.242 1.00 0.00 C ATOM 224 O GLU A 17 8.825 -2.254 -10.059 1.00 0.00 O ATOM 225 CB GLU A 17 11.992 -1.889 -10.268 1.00 0.00 C ATOM 226 CG GLU A 17 12.837 -1.061 -11.221 1.00 0.00 C ATOM 227 CD GLU A 17 13.832 -1.901 -11.998 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.483 -2.770 -11.381 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.960 -1.690 -13.222 1.00 0.00 O ATOM 0 H GLU A 17 12.309 -0.720 -8.109 1.00 0.00 H new ATOM 0 HA GLU A 17 10.512 -0.329 -10.281 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.638 -2.317 -9.501 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.552 -2.722 -10.816 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.184 -0.539 -11.920 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.374 -0.299 -10.656 1.00 0.00 H new ATOM 236 N GLN A 18 9.732 -2.544 -8.021 1.00 0.00 N ATOM 237 CA GLN A 18 8.682 -3.448 -7.562 1.00 0.00 C ATOM 238 C GLN A 18 7.557 -2.674 -6.883 1.00 0.00 C ATOM 239 O GLN A 18 6.382 -3.012 -7.031 1.00 0.00 O ATOM 240 CB GLN A 18 9.258 -4.486 -6.598 1.00 0.00 C ATOM 241 CG GLN A 18 10.370 -5.328 -7.205 1.00 0.00 C ATOM 242 CD GLN A 18 10.969 -6.306 -6.212 1.00 0.00 C ATOM 243 OE1 GLN A 18 11.017 -6.038 -5.012 1.00 0.00 O ATOM 244 NE2 GLN A 18 11.428 -7.448 -6.710 1.00 0.00 N ATOM 0 H GLN A 18 10.461 -2.360 -7.332 1.00 0.00 H new ATOM 0 HA GLN A 18 8.272 -3.960 -8.432 1.00 0.00 H new ATOM 0 HB2 GLN A 18 9.641 -3.976 -5.714 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.456 -5.144 -6.264 1.00 0.00 H new ATOM 0 HG2 GLN A 18 9.978 -5.878 -8.060 1.00 0.00 H new ATOM 0 HG3 GLN A 18 11.154 -4.671 -7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 18 11.368 -7.628 -7.712 1.00 0.00 H new ATOM 0 HE22 GLN A 18 11.841 -8.145 -6.090 1.00 0.00 H new ATOM 253 N ILE A 19 7.924 -1.638 -6.137 1.00 0.00 N ATOM 254 CA ILE A 19 6.946 -0.818 -5.435 1.00 0.00 C ATOM 255 C ILE A 19 5.999 -0.134 -6.415 1.00 0.00 C ATOM 256 O ILE A 19 4.850 0.158 -6.082 1.00 0.00 O ATOM 257 CB ILE A 19 7.630 0.255 -4.567 1.00 0.00 C ATOM 258 CG1 ILE A 19 8.506 -0.405 -3.499 1.00 0.00 C ATOM 259 CG2 ILE A 19 6.588 1.157 -3.922 1.00 0.00 C ATOM 260 CD1 ILE A 19 9.177 0.584 -2.573 1.00 0.00 C ATOM 0 H ILE A 19 8.892 -1.347 -6.003 1.00 0.00 H new ATOM 0 HA ILE A 19 6.377 -1.488 -4.790 1.00 0.00 H new ATOM 0 HB ILE A 19 8.267 0.867 -5.206 1.00 0.00 H new ATOM 0 HG12 ILE A 19 7.893 -1.086 -2.908 1.00 0.00 H new ATOM 0 HG13 ILE A 19 9.270 -1.008 -3.989 1.00 0.00 H new ATOM 0 HG21 ILE A 19 7.086 1.910 -3.312 1.00 0.00 H new ATOM 0 HG22 ILE A 19 6.002 1.649 -4.698 1.00 0.00 H new ATOM 0 HG23 ILE A 19 5.928 0.559 -3.293 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.781 0.046 -1.842 1.00 0.00 H new ATOM 0 HD12 ILE A 19 9.816 1.250 -3.153 1.00 0.00 H new ATOM 0 HD13 ILE A 19 8.418 1.170 -2.055 1.00 0.00 H new ATOM 272 N GLU A 20 6.487 0.118 -7.625 1.00 0.00 N ATOM 273 CA GLU A 20 5.683 0.767 -8.654 1.00 0.00 C ATOM 274 C GLU A 20 4.563 -0.154 -9.130 1.00 0.00 C ATOM 275 O GLU A 20 3.435 0.287 -9.349 1.00 0.00 O ATOM 276 CB GLU A 20 6.562 1.173 -9.839 1.00 0.00 C ATOM 277 CG GLU A 20 7.443 0.049 -10.358 1.00 0.00 C ATOM 278 CD GLU A 20 8.119 0.397 -11.670 1.00 0.00 C ATOM 279 OE1 GLU A 20 9.158 1.088 -11.637 1.00 0.00 O ATOM 280 OE2 GLU A 20 7.610 -0.026 -12.728 1.00 0.00 O ATOM 0 H GLU A 20 7.436 -0.117 -7.917 1.00 0.00 H new ATOM 0 HA GLU A 20 5.236 1.661 -8.220 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.924 1.527 -10.649 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.193 2.010 -9.542 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.203 -0.186 -9.613 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.839 -0.849 -10.491 1.00 0.00 H new ATOM 287 N ALA A 21 4.883 -1.434 -9.287 1.00 0.00 N ATOM 288 CA ALA A 21 3.905 -2.417 -9.735 1.00 0.00 C ATOM 289 C ALA A 21 2.985 -2.836 -8.593 1.00 0.00 C ATOM 290 O ALA A 21 1.814 -3.149 -8.810 1.00 0.00 O ATOM 291 CB ALA A 21 4.608 -3.632 -10.322 1.00 0.00 C ATOM 0 H ALA A 21 5.813 -1.815 -9.110 1.00 0.00 H new ATOM 0 HA ALA A 21 3.292 -1.956 -10.510 1.00 0.00 H new ATOM 0 HB1 ALA A 21 3.865 -4.358 -10.652 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.218 -3.324 -11.172 1.00 0.00 H new ATOM 0 HB3 ALA A 21 5.246 -4.085 -9.563 1.00 0.00 H new ATOM 297 N LEU A 22 3.522 -2.839 -7.378 1.00 0.00 N ATOM 298 CA LEU A 22 2.749 -3.220 -6.201 1.00 0.00 C ATOM 299 C LEU A 22 1.754 -2.126 -5.826 1.00 0.00 C ATOM 300 O LEU A 22 0.732 -2.394 -5.195 1.00 0.00 O ATOM 301 CB LEU A 22 3.682 -3.503 -5.023 1.00 0.00 C ATOM 302 CG LEU A 22 4.447 -4.826 -5.075 1.00 0.00 C ATOM 303 CD1 LEU A 22 5.778 -4.702 -4.350 1.00 0.00 C ATOM 304 CD2 LEU A 22 3.613 -5.948 -4.476 1.00 0.00 C ATOM 0 H LEU A 22 4.489 -2.582 -7.182 1.00 0.00 H new ATOM 0 HA LEU A 22 2.192 -4.126 -6.440 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.405 -2.691 -4.955 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.093 -3.483 -4.106 1.00 0.00 H new ATOM 0 HG LEU A 22 4.647 -5.067 -6.119 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.308 -5.653 -4.398 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.380 -3.927 -4.824 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.601 -4.437 -3.308 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.173 -6.882 -4.521 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.381 -5.714 -3.437 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.686 -6.053 -5.040 1.00 0.00 H new ATOM 316 N GLU A 23 2.061 -0.894 -6.218 1.00 0.00 N ATOM 317 CA GLU A 23 1.193 0.240 -5.923 1.00 0.00 C ATOM 318 C GLU A 23 0.033 0.308 -6.912 1.00 0.00 C ATOM 319 O GLU A 23 -1.115 0.530 -6.527 1.00 0.00 O ATOM 320 CB GLU A 23 1.990 1.545 -5.964 1.00 0.00 C ATOM 321 CG GLU A 23 2.593 1.932 -4.624 1.00 0.00 C ATOM 322 CD GLU A 23 2.769 3.430 -4.473 1.00 0.00 C ATOM 323 OE1 GLU A 23 3.394 4.046 -5.361 1.00 0.00 O ATOM 324 OE2 GLU A 23 2.280 3.986 -3.468 1.00 0.00 O ATOM 0 H GLU A 23 2.904 -0.655 -6.740 1.00 0.00 H new ATOM 0 HA GLU A 23 0.786 0.103 -4.921 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.789 1.450 -6.699 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.338 2.349 -6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.954 1.563 -3.822 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.561 1.443 -4.511 1.00 0.00 H new ATOM 331 N LYS A 24 0.341 0.116 -8.190 1.00 0.00 N ATOM 332 CA LYS A 24 -0.674 0.155 -9.236 1.00 0.00 C ATOM 333 C LYS A 24 -1.722 -0.931 -9.019 1.00 0.00 C ATOM 334 O LYS A 24 -2.876 -0.782 -9.419 1.00 0.00 O ATOM 335 CB LYS A 24 -0.025 -0.015 -10.612 1.00 0.00 C ATOM 336 CG LYS A 24 -0.776 0.685 -11.730 1.00 0.00 C ATOM 337 CD LYS A 24 0.085 0.832 -12.974 1.00 0.00 C ATOM 338 CE LYS A 24 -0.653 1.574 -14.078 1.00 0.00 C ATOM 339 NZ LYS A 24 -0.014 1.366 -15.407 1.00 0.00 N ATOM 0 H LYS A 24 1.286 -0.068 -8.527 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.168 1.126 -9.191 1.00 0.00 H new ATOM 0 HB2 LYS A 24 0.994 0.370 -10.574 1.00 0.00 H new ATOM 0 HB3 LYS A 24 0.045 -1.078 -10.843 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.676 0.121 -11.974 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -1.099 1.669 -11.392 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.000 1.368 -12.723 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.381 -0.154 -13.332 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.688 1.234 -14.115 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.675 2.639 -13.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.546 1.887 -16.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 0.966 1.713 -15.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -0.016 0.352 -15.638 1.00 0.00 H new ATOM 353 N GLU A 25 -1.312 -2.023 -8.381 1.00 0.00 N ATOM 354 CA GLU A 25 -2.217 -3.134 -8.109 1.00 0.00 C ATOM 355 C GLU A 25 -3.037 -2.873 -6.850 1.00 0.00 C ATOM 356 O GLU A 25 -4.131 -3.412 -6.684 1.00 0.00 O ATOM 357 CB GLU A 25 -1.430 -4.437 -7.958 1.00 0.00 C ATOM 358 CG GLU A 25 -2.306 -5.650 -7.692 1.00 0.00 C ATOM 359 CD GLU A 25 -3.111 -6.067 -8.908 1.00 0.00 C ATOM 360 OE1 GLU A 25 -2.549 -6.759 -9.783 1.00 0.00 O ATOM 361 OE2 GLU A 25 -4.302 -5.701 -8.984 1.00 0.00 O ATOM 0 H GLU A 25 -0.360 -2.162 -8.043 1.00 0.00 H new ATOM 0 HA GLU A 25 -2.900 -3.227 -8.953 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -0.851 -4.609 -8.865 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.717 -4.328 -7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -1.679 -6.483 -7.373 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -2.986 -5.429 -6.869 1.00 0.00 H new ATOM 368 N PHE A 26 -2.500 -2.041 -5.963 1.00 0.00 N ATOM 369 CA PHE A 26 -3.180 -1.708 -4.717 1.00 0.00 C ATOM 370 C PHE A 26 -4.157 -0.554 -4.922 1.00 0.00 C ATOM 371 O PHE A 26 -5.252 -0.549 -4.361 1.00 0.00 O ATOM 372 CB PHE A 26 -2.160 -1.343 -3.637 1.00 0.00 C ATOM 373 CG PHE A 26 -2.786 -0.964 -2.325 1.00 0.00 C ATOM 374 CD1 PHE A 26 -3.427 0.255 -2.175 1.00 0.00 C ATOM 375 CD2 PHE A 26 -2.733 -1.826 -1.242 1.00 0.00 C ATOM 376 CE1 PHE A 26 -4.005 0.607 -0.969 1.00 0.00 C ATOM 377 CE2 PHE A 26 -3.308 -1.480 -0.034 1.00 0.00 C ATOM 378 CZ PHE A 26 -3.944 -0.262 0.103 1.00 0.00 C ATOM 0 H PHE A 26 -1.596 -1.585 -6.084 1.00 0.00 H new ATOM 0 HA PHE A 26 -3.743 -2.584 -4.394 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -1.490 -2.189 -3.480 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.548 -0.514 -3.992 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -3.476 0.938 -3.010 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -2.236 -2.780 -1.343 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.503 1.560 -0.865 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.260 -2.162 0.802 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.393 0.011 1.047 1.00 0.00 H new ATOM 388 N GLU A 27 -3.749 0.422 -5.727 1.00 0.00 N ATOM 389 CA GLU A 27 -4.588 1.582 -6.004 1.00 0.00 C ATOM 390 C GLU A 27 -5.904 1.161 -6.652 1.00 0.00 C ATOM 391 O GLU A 27 -6.915 1.854 -6.538 1.00 0.00 O ATOM 392 CB GLU A 27 -3.850 2.567 -6.914 1.00 0.00 C ATOM 393 CG GLU A 27 -3.431 1.967 -8.245 1.00 0.00 C ATOM 394 CD GLU A 27 -4.544 1.999 -9.275 1.00 0.00 C ATOM 395 OE1 GLU A 27 -5.478 2.812 -9.116 1.00 0.00 O ATOM 396 OE2 GLU A 27 -4.479 1.209 -10.241 1.00 0.00 O ATOM 0 H GLU A 27 -2.844 0.433 -6.198 1.00 0.00 H new ATOM 0 HA GLU A 27 -4.811 2.071 -5.056 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -4.491 3.429 -7.099 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -2.964 2.934 -6.396 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.569 2.512 -8.630 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.113 0.936 -8.091 1.00 0.00 H new ATOM 403 N ARG A 28 -5.881 0.020 -7.335 1.00 0.00 N ATOM 404 CA ARG A 28 -7.070 -0.494 -8.003 1.00 0.00 C ATOM 405 C ARG A 28 -7.849 -1.431 -7.084 1.00 0.00 C ATOM 406 O ARG A 28 -9.063 -1.298 -6.926 1.00 0.00 O ATOM 407 CB ARG A 28 -6.682 -1.227 -9.288 1.00 0.00 C ATOM 408 CG ARG A 28 -7.871 -1.603 -10.158 1.00 0.00 C ATOM 409 CD ARG A 28 -8.417 -2.974 -9.794 1.00 0.00 C ATOM 410 NE ARG A 28 -9.600 -3.319 -10.576 1.00 0.00 N ATOM 411 CZ ARG A 28 -9.548 -3.793 -11.817 1.00 0.00 C ATOM 412 NH1 ARG A 28 -8.377 -3.978 -12.411 1.00 0.00 N ATOM 413 NH2 ARG A 28 -10.670 -4.083 -12.465 1.00 0.00 N ATOM 0 H ARG A 28 -5.052 -0.565 -7.440 1.00 0.00 H new ATOM 0 HA ARG A 28 -7.709 0.352 -8.255 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -6.005 -0.597 -9.865 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -6.132 -2.132 -9.028 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.656 -0.856 -10.045 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.573 -1.596 -11.206 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -7.644 -3.726 -9.955 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -8.666 -2.995 -8.733 1.00 0.00 H new ATOM 0 HE ARG A 28 -10.516 -3.189 -10.147 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.513 -3.757 -11.916 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -8.340 -4.342 -13.363 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -11.572 -3.942 -12.011 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -10.630 -4.447 -13.417 1.00 0.00 H new ATOM 427 N THR A 29 -7.141 -2.381 -6.481 1.00 0.00 N ATOM 428 CA THR A 29 -7.765 -3.342 -5.580 1.00 0.00 C ATOM 429 C THR A 29 -6.881 -3.613 -4.368 1.00 0.00 C ATOM 430 O THR A 29 -5.727 -4.019 -4.506 1.00 0.00 O ATOM 431 CB THR A 29 -8.059 -4.674 -6.294 1.00 0.00 C ATOM 432 OG1 THR A 29 -8.593 -5.622 -5.364 1.00 0.00 O ATOM 433 CG2 THR A 29 -6.796 -5.237 -6.931 1.00 0.00 C ATOM 0 H THR A 29 -6.136 -2.505 -6.600 1.00 0.00 H new ATOM 0 HA THR A 29 -8.705 -2.900 -5.250 1.00 0.00 H new ATOM 0 HB THR A 29 -8.791 -4.485 -7.080 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.778 -6.466 -5.827 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.028 -6.178 -7.429 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.408 -4.526 -7.661 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.046 -5.411 -6.160 1.00 0.00 H new ATOM 441 N HIS A 30 -7.430 -3.386 -3.178 1.00 0.00 N ATOM 442 CA HIS A 30 -6.691 -3.607 -1.940 1.00 0.00 C ATOM 443 C HIS A 30 -6.559 -5.098 -1.645 1.00 0.00 C ATOM 444 O HIS A 30 -5.779 -5.504 -0.783 1.00 0.00 O ATOM 445 CB HIS A 30 -7.386 -2.904 -0.774 1.00 0.00 C ATOM 446 CG HIS A 30 -7.496 -1.421 -0.949 1.00 0.00 C ATOM 447 ND1 HIS A 30 -7.260 -0.636 -2.026 1.00 0.00 N flip ATOM 448 CD2 HIS A 30 -7.890 -0.571 0.062 1.00 0.00 C flip ATOM 449 CE1 HIS A 30 -7.514 0.660 -1.650 1.00 0.00 C flip ATOM 450 NE2 HIS A 30 -7.894 0.672 -0.386 1.00 0.00 N flip ATOM 0 H HIS A 30 -8.384 -3.049 -3.045 1.00 0.00 H new ATOM 0 HA HIS A 30 -5.692 -3.189 -2.063 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -8.385 -3.322 -0.652 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -6.838 -3.114 0.145 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -8.154 -0.874 1.064 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -7.418 1.528 -2.285 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -8.148 1.500 0.153 1.00 0.00 H new ATOM 459 N TYR A 31 -7.327 -5.909 -2.365 1.00 0.00 N ATOM 460 CA TYR A 31 -7.298 -7.354 -2.178 1.00 0.00 C ATOM 461 C TYR A 31 -7.037 -8.069 -3.500 1.00 0.00 C ATOM 462 O TYR A 31 -7.951 -8.567 -4.157 1.00 0.00 O ATOM 463 CB TYR A 31 -8.618 -7.838 -1.576 1.00 0.00 C ATOM 464 CG TYR A 31 -9.048 -7.060 -0.352 1.00 0.00 C ATOM 465 CD1 TYR A 31 -8.112 -6.613 0.573 1.00 0.00 C ATOM 466 CD2 TYR A 31 -10.387 -6.772 -0.122 1.00 0.00 C ATOM 467 CE1 TYR A 31 -8.499 -5.902 1.693 1.00 0.00 C ATOM 468 CE2 TYR A 31 -10.783 -6.061 0.995 1.00 0.00 C ATOM 469 CZ TYR A 31 -9.835 -5.628 1.898 1.00 0.00 C ATOM 470 OH TYR A 31 -10.226 -4.920 3.012 1.00 0.00 O ATOM 0 H TYR A 31 -7.977 -5.590 -3.083 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.485 -7.590 -1.491 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.399 -7.769 -2.333 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.522 -8.891 -1.312 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.065 -6.825 0.414 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -11.131 -7.109 -0.828 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -7.760 -5.563 2.404 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -11.828 -5.846 1.160 1.00 0.00 H new ATOM 0 HH TYR A 31 -11.200 -4.812 3.006 1.00 0.00 H new ATOM 480 N PRO A 32 -5.757 -8.123 -3.899 1.00 0.00 N ATOM 481 CA PRO A 32 -5.343 -8.776 -5.145 1.00 0.00 C ATOM 482 C PRO A 32 -5.491 -10.293 -5.081 1.00 0.00 C ATOM 483 O PRO A 32 -4.599 -10.992 -4.599 1.00 0.00 O ATOM 484 CB PRO A 32 -3.870 -8.386 -5.277 1.00 0.00 C ATOM 485 CG PRO A 32 -3.422 -8.119 -3.881 1.00 0.00 C ATOM 486 CD PRO A 32 -4.616 -7.552 -3.165 1.00 0.00 C ATOM 0 HA PRO A 32 -5.956 -8.467 -5.991 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -3.288 -9.187 -5.733 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -3.749 -7.505 -5.907 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.077 -9.034 -3.400 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -2.588 -7.417 -3.866 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.629 -7.841 -2.114 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.623 -6.462 -3.196 1.00 0.00 H new ATOM 494 N ASP A 33 -6.618 -10.795 -5.571 1.00 0.00 N ATOM 495 CA ASP A 33 -6.881 -12.230 -5.570 1.00 0.00 C ATOM 496 C ASP A 33 -5.671 -13.003 -6.086 1.00 0.00 C ATOM 497 O ASP A 33 -4.686 -12.413 -6.530 1.00 0.00 O ATOM 498 CB ASP A 33 -8.107 -12.546 -6.427 1.00 0.00 C ATOM 499 CG ASP A 33 -9.392 -12.021 -5.815 1.00 0.00 C ATOM 500 OD1 ASP A 33 -9.610 -10.792 -5.859 1.00 0.00 O ATOM 501 OD2 ASP A 33 -10.177 -12.838 -5.291 1.00 0.00 O ATOM 0 H ASP A 33 -7.365 -10.230 -5.974 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.077 -12.539 -4.543 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.976 -12.111 -7.418 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -8.186 -13.625 -6.560 1.00 0.00 H new ATOM 506 N VAL A 34 -5.752 -14.328 -6.025 1.00 0.00 N ATOM 507 CA VAL A 34 -4.665 -15.183 -6.486 1.00 0.00 C ATOM 508 C VAL A 34 -4.278 -14.852 -7.923 1.00 0.00 C ATOM 509 O VAL A 34 -3.114 -14.970 -8.307 1.00 0.00 O ATOM 510 CB VAL A 34 -5.046 -16.673 -6.399 1.00 0.00 C ATOM 511 CG1 VAL A 34 -6.313 -16.948 -7.194 1.00 0.00 C ATOM 512 CG2 VAL A 34 -3.900 -17.546 -6.888 1.00 0.00 C ATOM 0 H VAL A 34 -6.560 -14.833 -5.661 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.815 -14.995 -5.830 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.240 -16.919 -5.355 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.566 -18.006 -7.121 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.131 -16.350 -6.793 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.151 -16.685 -8.239 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -4.187 -18.595 -6.819 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.672 -17.299 -7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.019 -17.370 -6.271 1.00 0.00 H new ATOM 522 N PHE A 35 -5.261 -14.437 -8.714 1.00 0.00 N ATOM 523 CA PHE A 35 -5.025 -14.089 -10.110 1.00 0.00 C ATOM 524 C PHE A 35 -4.217 -12.800 -10.220 1.00 0.00 C ATOM 525 O PHE A 35 -3.637 -12.504 -11.265 1.00 0.00 O ATOM 526 CB PHE A 35 -6.354 -13.938 -10.853 1.00 0.00 C ATOM 527 CG PHE A 35 -6.889 -15.233 -11.394 1.00 0.00 C ATOM 528 CD1 PHE A 35 -6.137 -15.997 -12.272 1.00 0.00 C ATOM 529 CD2 PHE A 35 -8.146 -15.685 -11.026 1.00 0.00 C ATOM 530 CE1 PHE A 35 -6.627 -17.189 -12.771 1.00 0.00 C ATOM 531 CE2 PHE A 35 -8.641 -16.877 -11.522 1.00 0.00 C ATOM 532 CZ PHE A 35 -7.881 -17.628 -12.396 1.00 0.00 C ATOM 0 H PHE A 35 -6.230 -14.333 -8.412 1.00 0.00 H new ATOM 0 HA PHE A 35 -4.452 -14.896 -10.567 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.091 -13.503 -10.178 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.223 -13.236 -11.676 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -5.156 -15.657 -12.570 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.746 -15.100 -10.344 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -6.030 -17.776 -13.453 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -9.621 -17.220 -11.226 1.00 0.00 H new ATOM 0 HZ PHE A 35 -8.267 -18.558 -12.786 1.00 0.00 H new ATOM 542 N ALA A 36 -4.185 -12.034 -9.134 1.00 0.00 N ATOM 543 CA ALA A 36 -3.449 -10.777 -9.106 1.00 0.00 C ATOM 544 C ALA A 36 -2.046 -10.974 -8.540 1.00 0.00 C ATOM 545 O ALA A 36 -1.061 -10.526 -9.127 1.00 0.00 O ATOM 546 CB ALA A 36 -4.208 -9.738 -8.293 1.00 0.00 C ATOM 0 H ALA A 36 -4.661 -12.263 -8.261 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.352 -10.419 -10.131 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.646 -8.804 -8.281 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.186 -9.567 -8.743 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.336 -10.098 -7.272 1.00 0.00 H new ATOM 552 N ARG A 37 -1.964 -11.646 -7.397 1.00 0.00 N ATOM 553 CA ARG A 37 -0.683 -11.901 -6.751 1.00 0.00 C ATOM 554 C ARG A 37 0.196 -12.796 -7.620 1.00 0.00 C ATOM 555 O ARG A 37 1.409 -12.602 -7.701 1.00 0.00 O ATOM 556 CB ARG A 37 -0.897 -12.551 -5.383 1.00 0.00 C ATOM 557 CG ARG A 37 -1.309 -11.567 -4.299 1.00 0.00 C ATOM 558 CD ARG A 37 -0.860 -12.035 -2.924 1.00 0.00 C ATOM 559 NE ARG A 37 -1.778 -13.017 -2.353 1.00 0.00 N ATOM 560 CZ ARG A 37 -2.939 -12.700 -1.792 1.00 0.00 C ATOM 561 NH1 ARG A 37 -3.323 -11.432 -1.728 1.00 0.00 N ATOM 562 NH2 ARG A 37 -3.720 -13.651 -1.295 1.00 0.00 N ATOM 0 H ARG A 37 -2.770 -12.024 -6.899 1.00 0.00 H new ATOM 0 HA ARG A 37 -0.177 -10.945 -6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.662 -13.322 -5.472 1.00 0.00 H new ATOM 0 HB3 ARG A 37 0.023 -13.049 -5.079 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -0.877 -10.589 -4.511 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -2.392 -11.446 -4.308 1.00 0.00 H new ATOM 0 HD2 ARG A 37 0.137 -12.470 -2.997 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -0.785 -11.177 -2.256 1.00 0.00 H new ATOM 0 HE ARG A 37 -1.512 -14.001 -2.387 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -2.726 -10.698 -2.110 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.215 -11.190 -1.297 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.429 -14.627 -1.344 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -4.611 -13.406 -0.864 1.00 0.00 H new ATOM 576 N GLU A 38 -0.425 -13.777 -8.267 1.00 0.00 N ATOM 577 CA GLU A 38 0.301 -14.703 -9.129 1.00 0.00 C ATOM 578 C GLU A 38 0.884 -13.978 -10.338 1.00 0.00 C ATOM 579 O GLU A 38 2.083 -14.063 -10.607 1.00 0.00 O ATOM 580 CB GLU A 38 -0.621 -15.832 -9.593 1.00 0.00 C ATOM 581 CG GLU A 38 -0.828 -16.917 -8.550 1.00 0.00 C ATOM 582 CD GLU A 38 -1.209 -18.250 -9.164 1.00 0.00 C ATOM 583 OE1 GLU A 38 -0.555 -18.662 -10.145 1.00 0.00 O ATOM 584 OE2 GLU A 38 -2.162 -18.883 -8.662 1.00 0.00 O ATOM 0 H GLU A 38 -1.428 -13.951 -8.211 1.00 0.00 H new ATOM 0 HA GLU A 38 1.122 -15.128 -8.552 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.589 -15.411 -9.864 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.205 -16.281 -10.495 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.086 -17.037 -7.969 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.608 -16.605 -7.856 1.00 0.00 H new ATOM 591 N ARG A 39 0.028 -13.265 -11.063 1.00 0.00 N ATOM 592 CA ARG A 39 0.457 -12.526 -12.244 1.00 0.00 C ATOM 593 C ARG A 39 1.487 -11.462 -11.875 1.00 0.00 C ATOM 594 O ARG A 39 2.493 -11.290 -12.564 1.00 0.00 O ATOM 595 CB ARG A 39 -0.745 -11.873 -12.927 1.00 0.00 C ATOM 596 CG ARG A 39 -1.419 -12.765 -13.957 1.00 0.00 C ATOM 597 CD ARG A 39 -0.806 -12.586 -15.337 1.00 0.00 C ATOM 598 NE ARG A 39 -1.604 -13.224 -16.379 1.00 0.00 N ATOM 599 CZ ARG A 39 -1.483 -12.948 -17.672 1.00 0.00 C ATOM 600 NH1 ARG A 39 -0.597 -12.050 -18.080 1.00 0.00 N ATOM 601 NH2 ARG A 39 -2.246 -13.572 -18.561 1.00 0.00 N ATOM 0 H ARG A 39 -0.967 -13.184 -10.853 1.00 0.00 H new ATOM 0 HA ARG A 39 0.920 -13.231 -12.935 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -1.475 -11.593 -12.168 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.421 -10.953 -13.413 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -1.330 -13.807 -13.651 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.484 -12.535 -13.998 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -0.709 -11.522 -15.555 1.00 0.00 H new ATOM 0 HD3 ARG A 39 0.200 -13.005 -15.344 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.294 -13.921 -16.098 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.007 -11.570 -17.400 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -0.505 -11.839 -19.074 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.927 -14.265 -18.251 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -2.151 -13.358 -19.554 1.00 0.00 H new ATOM 615 N LEU A 40 1.228 -10.748 -10.785 1.00 0.00 N ATOM 616 CA LEU A 40 2.131 -9.700 -10.324 1.00 0.00 C ATOM 617 C LEU A 40 3.460 -10.289 -9.863 1.00 0.00 C ATOM 618 O LEU A 40 4.521 -9.711 -10.096 1.00 0.00 O ATOM 619 CB LEU A 40 1.487 -8.910 -9.183 1.00 0.00 C ATOM 620 CG LEU A 40 1.960 -7.465 -9.016 1.00 0.00 C ATOM 621 CD1 LEU A 40 1.096 -6.523 -9.843 1.00 0.00 C ATOM 622 CD2 LEU A 40 1.938 -7.062 -7.549 1.00 0.00 C ATOM 0 H LEU A 40 0.400 -10.876 -10.204 1.00 0.00 H new ATOM 0 HA LEU A 40 2.324 -9.028 -11.160 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.408 -8.902 -9.337 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.672 -9.442 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 40 2.987 -7.395 -9.375 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.446 -5.499 -9.713 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.163 -6.798 -10.896 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.060 -6.597 -9.514 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.278 -6.031 -7.450 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.922 -7.148 -7.163 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.598 -7.718 -6.982 1.00 0.00 H new ATOM 634 N ALA A 41 3.394 -11.445 -9.210 1.00 0.00 N ATOM 635 CA ALA A 41 4.592 -12.115 -8.721 1.00 0.00 C ATOM 636 C ALA A 41 5.664 -12.184 -9.803 1.00 0.00 C ATOM 637 O ALA A 41 6.855 -12.056 -9.519 1.00 0.00 O ATOM 638 CB ALA A 41 4.250 -13.513 -8.225 1.00 0.00 C ATOM 0 H ALA A 41 2.523 -11.936 -9.008 1.00 0.00 H new ATOM 0 HA ALA A 41 4.989 -11.533 -7.890 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.154 -14.002 -7.863 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.525 -13.444 -7.414 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.825 -14.095 -9.043 1.00 0.00 H new ATOM 644 N ALA A 42 5.233 -12.385 -11.044 1.00 0.00 N ATOM 645 CA ALA A 42 6.157 -12.469 -12.169 1.00 0.00 C ATOM 646 C ALA A 42 6.413 -11.092 -12.772 1.00 0.00 C ATOM 647 O ALA A 42 7.375 -10.899 -13.514 1.00 0.00 O ATOM 648 CB ALA A 42 5.614 -13.418 -13.227 1.00 0.00 C ATOM 0 H ALA A 42 4.250 -12.493 -11.296 1.00 0.00 H new ATOM 0 HA ALA A 42 7.106 -12.858 -11.800 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.313 -13.471 -14.061 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.488 -14.411 -12.795 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.651 -13.053 -13.584 1.00 0.00 H new ATOM 654 N LYS A 43 5.546 -10.139 -12.449 1.00 0.00 N ATOM 655 CA LYS A 43 5.678 -8.779 -12.957 1.00 0.00 C ATOM 656 C LYS A 43 6.781 -8.026 -12.219 1.00 0.00 C ATOM 657 O LYS A 43 7.471 -7.190 -12.801 1.00 0.00 O ATOM 658 CB LYS A 43 4.352 -8.029 -12.818 1.00 0.00 C ATOM 659 CG LYS A 43 4.461 -6.542 -13.106 1.00 0.00 C ATOM 660 CD LYS A 43 4.271 -6.244 -14.584 1.00 0.00 C ATOM 661 CE LYS A 43 3.771 -4.825 -14.806 1.00 0.00 C ATOM 662 NZ LYS A 43 2.284 -4.755 -14.808 1.00 0.00 N ATOM 0 H LYS A 43 4.743 -10.284 -11.837 1.00 0.00 H new ATOM 0 HA LYS A 43 5.946 -8.837 -14.012 1.00 0.00 H new ATOM 0 HB2 LYS A 43 3.622 -8.470 -13.497 1.00 0.00 H new ATOM 0 HB3 LYS A 43 3.970 -8.168 -11.807 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.712 -6.002 -12.526 1.00 0.00 H new ATOM 0 HG3 LYS A 43 5.437 -6.179 -12.783 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.216 -6.384 -15.109 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.561 -6.952 -15.011 1.00 0.00 H new ATOM 0 HE2 LYS A 43 4.164 -4.175 -14.024 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.154 -4.449 -15.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.983 -3.772 -14.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.909 -5.355 -15.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 1.919 -5.089 -13.893 1.00 0.00 H new ATOM 676 N ILE A 44 6.941 -8.331 -10.935 1.00 0.00 N ATOM 677 CA ILE A 44 7.960 -7.684 -10.119 1.00 0.00 C ATOM 678 C ILE A 44 8.966 -8.700 -9.589 1.00 0.00 C ATOM 679 O ILE A 44 9.831 -8.369 -8.779 1.00 0.00 O ATOM 680 CB ILE A 44 7.335 -6.929 -8.931 1.00 0.00 C ATOM 681 CG1 ILE A 44 6.258 -7.787 -8.263 1.00 0.00 C ATOM 682 CG2 ILE A 44 6.752 -5.602 -9.394 1.00 0.00 C ATOM 683 CD1 ILE A 44 5.500 -7.063 -7.173 1.00 0.00 C ATOM 0 H ILE A 44 6.378 -9.022 -10.438 1.00 0.00 H new ATOM 0 HA ILE A 44 8.473 -6.970 -10.763 1.00 0.00 H new ATOM 0 HB ILE A 44 8.116 -6.724 -8.198 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.552 -8.126 -9.022 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.724 -8.677 -7.841 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.314 -5.080 -8.543 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.542 -4.989 -9.828 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.982 -5.785 -10.143 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.753 -7.731 -6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.195 -6.748 -6.395 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.005 -6.188 -7.594 1.00 0.00 H new ATOM 695 N ASP A 45 8.846 -9.939 -10.053 1.00 0.00 N ATOM 696 CA ASP A 45 9.747 -11.005 -9.628 1.00 0.00 C ATOM 697 C ASP A 45 9.717 -11.169 -8.112 1.00 0.00 C ATOM 698 O ASP A 45 10.760 -11.185 -7.458 1.00 0.00 O ATOM 699 CB ASP A 45 11.174 -10.712 -10.094 1.00 0.00 C ATOM 700 CG ASP A 45 11.465 -11.287 -11.466 1.00 0.00 C ATOM 701 OD1 ASP A 45 11.122 -12.465 -11.700 1.00 0.00 O ATOM 702 OD2 ASP A 45 12.037 -10.561 -12.306 1.00 0.00 O ATOM 0 H ASP A 45 8.134 -10.230 -10.723 1.00 0.00 H new ATOM 0 HA ASP A 45 9.409 -11.936 -10.083 1.00 0.00 H new ATOM 0 HB2 ASP A 45 11.332 -9.634 -10.114 1.00 0.00 H new ATOM 0 HB3 ASP A 45 11.880 -11.124 -9.373 1.00 0.00 H new ATOM 707 N LEU A 46 8.515 -11.291 -7.559 1.00 0.00 N ATOM 708 CA LEU A 46 8.348 -11.454 -6.119 1.00 0.00 C ATOM 709 C LEU A 46 7.423 -12.625 -5.806 1.00 0.00 C ATOM 710 O LEU A 46 6.508 -12.944 -6.566 1.00 0.00 O ATOM 711 CB LEU A 46 7.792 -10.170 -5.502 1.00 0.00 C ATOM 712 CG LEU A 46 8.807 -9.059 -5.234 1.00 0.00 C ATOM 713 CD1 LEU A 46 8.098 -7.751 -4.921 1.00 0.00 C ATOM 714 CD2 LEU A 46 9.736 -9.449 -4.093 1.00 0.00 C ATOM 0 H LEU A 46 7.642 -11.280 -8.086 1.00 0.00 H new ATOM 0 HA LEU A 46 9.326 -11.664 -5.686 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.020 -9.777 -6.164 1.00 0.00 H new ATOM 0 HB3 LEU A 46 7.305 -10.424 -4.561 1.00 0.00 H new ATOM 0 HG LEU A 46 9.406 -8.918 -6.133 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.837 -6.972 -4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.475 -7.463 -5.768 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.473 -7.878 -4.037 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.452 -8.646 -3.916 1.00 0.00 H new ATOM 0 HD22 LEU A 46 9.151 -9.619 -3.189 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.271 -10.361 -4.355 1.00 0.00 H new ATOM 726 N PRO A 47 7.661 -13.279 -4.660 1.00 0.00 N ATOM 727 CA PRO A 47 6.858 -14.423 -4.219 1.00 0.00 C ATOM 728 C PRO A 47 5.448 -14.017 -3.806 1.00 0.00 C ATOM 729 O PRO A 47 5.258 -13.010 -3.126 1.00 0.00 O ATOM 730 CB PRO A 47 7.634 -14.959 -3.014 1.00 0.00 C ATOM 731 CG PRO A 47 8.394 -13.785 -2.501 1.00 0.00 C ATOM 732 CD PRO A 47 8.735 -12.953 -3.707 1.00 0.00 C ATOM 0 HA PRO A 47 6.721 -15.155 -5.015 1.00 0.00 H new ATOM 0 HB2 PRO A 47 6.961 -15.357 -2.255 1.00 0.00 H new ATOM 0 HB3 PRO A 47 8.304 -15.769 -3.303 1.00 0.00 H new ATOM 0 HG2 PRO A 47 7.797 -13.214 -1.789 1.00 0.00 H new ATOM 0 HG3 PRO A 47 9.296 -14.102 -1.978 1.00 0.00 H new ATOM 0 HD2 PRO A 47 8.753 -11.889 -3.470 1.00 0.00 H new ATOM 0 HD3 PRO A 47 9.717 -13.207 -4.106 1.00 0.00 H new ATOM 740 N GLU A 48 4.463 -14.805 -4.224 1.00 0.00 N ATOM 741 CA GLU A 48 3.070 -14.526 -3.897 1.00 0.00 C ATOM 742 C GLU A 48 2.908 -14.235 -2.407 1.00 0.00 C ATOM 743 O GLU A 48 1.922 -13.633 -1.985 1.00 0.00 O ATOM 744 CB GLU A 48 2.181 -15.706 -4.296 1.00 0.00 C ATOM 745 CG GLU A 48 0.757 -15.306 -4.641 1.00 0.00 C ATOM 746 CD GLU A 48 -0.190 -16.489 -4.669 1.00 0.00 C ATOM 747 OE1 GLU A 48 0.015 -17.432 -3.875 1.00 0.00 O ATOM 748 OE2 GLU A 48 -1.137 -16.474 -5.482 1.00 0.00 O ATOM 0 H GLU A 48 4.604 -15.642 -4.790 1.00 0.00 H new ATOM 0 HA GLU A 48 2.763 -13.643 -4.458 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.625 -16.211 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.159 -16.426 -3.478 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.401 -14.578 -3.912 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.747 -14.814 -5.614 1.00 0.00 H new ATOM 755 N ALA A 49 3.885 -14.668 -1.616 1.00 0.00 N ATOM 756 CA ALA A 49 3.853 -14.454 -0.176 1.00 0.00 C ATOM 757 C ALA A 49 4.268 -13.029 0.177 1.00 0.00 C ATOM 758 O ALA A 49 3.706 -12.415 1.083 1.00 0.00 O ATOM 759 CB ALA A 49 4.753 -15.458 0.528 1.00 0.00 C ATOM 0 H ALA A 49 4.708 -15.169 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 49 2.828 -14.601 0.165 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.719 -15.286 1.604 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.409 -16.469 0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.777 -15.339 0.174 1.00 0.00 H new ATOM 765 N ARG A 50 5.257 -12.511 -0.544 1.00 0.00 N ATOM 766 CA ARG A 50 5.749 -11.160 -0.306 1.00 0.00 C ATOM 767 C ARG A 50 4.654 -10.129 -0.562 1.00 0.00 C ATOM 768 O ARG A 50 4.363 -9.293 0.294 1.00 0.00 O ATOM 769 CB ARG A 50 6.958 -10.868 -1.199 1.00 0.00 C ATOM 770 CG ARG A 50 8.288 -11.236 -0.562 1.00 0.00 C ATOM 771 CD ARG A 50 8.830 -10.100 0.291 1.00 0.00 C ATOM 772 NE ARG A 50 9.926 -10.536 1.151 1.00 0.00 N ATOM 773 CZ ARG A 50 11.143 -10.825 0.701 1.00 0.00 C ATOM 774 NH1 ARG A 50 11.416 -10.724 -0.593 1.00 0.00 N ATOM 775 NH2 ARG A 50 12.089 -11.214 1.545 1.00 0.00 N ATOM 0 H ARG A 50 5.733 -13.007 -1.298 1.00 0.00 H new ATOM 0 HA ARG A 50 6.053 -11.091 0.739 1.00 0.00 H new ATOM 0 HB2 ARG A 50 6.849 -11.416 -2.135 1.00 0.00 H new ATOM 0 HB3 ARG A 50 6.966 -9.807 -1.450 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.164 -12.127 0.053 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.009 -11.484 -1.341 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.176 -9.294 -0.356 1.00 0.00 H new ATOM 0 HD3 ARG A 50 8.027 -9.693 0.906 1.00 0.00 H new ATOM 0 HE ARG A 50 9.748 -10.624 2.152 1.00 0.00 H new ATOM 0 HH11 ARG A 50 10.691 -10.424 -1.245 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.351 -10.946 -0.936 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.883 -11.292 2.541 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.022 -11.435 1.198 1.00 0.00 H new ATOM 789 N ILE A 51 4.052 -10.194 -1.744 1.00 0.00 N ATOM 790 CA ILE A 51 2.989 -9.268 -2.112 1.00 0.00 C ATOM 791 C ILE A 51 1.978 -9.114 -0.981 1.00 0.00 C ATOM 792 O ILE A 51 1.627 -7.998 -0.598 1.00 0.00 O ATOM 793 CB ILE A 51 2.253 -9.731 -3.383 1.00 0.00 C ATOM 794 CG1 ILE A 51 3.202 -9.711 -4.583 1.00 0.00 C ATOM 795 CG2 ILE A 51 1.041 -8.850 -3.645 1.00 0.00 C ATOM 796 CD1 ILE A 51 2.802 -10.666 -5.687 1.00 0.00 C ATOM 0 H ILE A 51 4.282 -10.879 -2.464 1.00 0.00 H new ATOM 0 HA ILE A 51 3.463 -8.306 -2.307 1.00 0.00 H new ATOM 0 HB ILE A 51 1.908 -10.754 -3.233 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.243 -8.699 -4.986 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.208 -9.961 -4.245 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.532 -9.190 -4.547 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.358 -8.910 -2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.364 -7.817 -3.778 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.520 -10.598 -6.505 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.789 -11.685 -5.300 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.809 -10.404 -6.053 1.00 0.00 H new ATOM 808 N GLN A 52 1.515 -10.241 -0.451 1.00 0.00 N ATOM 809 CA GLN A 52 0.545 -10.231 0.638 1.00 0.00 C ATOM 810 C GLN A 52 0.974 -9.267 1.740 1.00 0.00 C ATOM 811 O GLN A 52 0.208 -8.394 2.147 1.00 0.00 O ATOM 812 CB GLN A 52 0.378 -11.638 1.213 1.00 0.00 C ATOM 813 CG GLN A 52 0.509 -12.740 0.174 1.00 0.00 C ATOM 814 CD GLN A 52 -0.322 -13.963 0.511 1.00 0.00 C ATOM 815 OE1 GLN A 52 -1.528 -13.994 0.269 1.00 0.00 O ATOM 816 NE2 GLN A 52 0.322 -14.980 1.072 1.00 0.00 N ATOM 0 H GLN A 52 1.796 -11.172 -0.758 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.411 -9.894 0.237 1.00 0.00 H new ATOM 0 HB2 GLN A 52 1.124 -11.794 1.992 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -0.600 -11.713 1.689 1.00 0.00 H new ATOM 0 HG2 GLN A 52 0.203 -12.355 -0.799 1.00 0.00 H new ATOM 0 HG3 GLN A 52 1.556 -13.030 0.088 1.00 0.00 H new ATOM 0 HE21 GLN A 52 1.323 -14.911 1.255 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -0.184 -15.830 1.320 1.00 0.00 H new ATOM 825 N VAL A 53 2.203 -9.432 2.219 1.00 0.00 N ATOM 826 CA VAL A 53 2.733 -8.576 3.273 1.00 0.00 C ATOM 827 C VAL A 53 2.713 -7.111 2.854 1.00 0.00 C ATOM 828 O VAL A 53 2.088 -6.276 3.508 1.00 0.00 O ATOM 829 CB VAL A 53 4.175 -8.972 3.646 1.00 0.00 C ATOM 830 CG1 VAL A 53 4.668 -8.147 4.824 1.00 0.00 C ATOM 831 CG2 VAL A 53 4.255 -10.459 3.955 1.00 0.00 C ATOM 0 H VAL A 53 2.850 -10.150 1.894 1.00 0.00 H new ATOM 0 HA VAL A 53 2.090 -8.711 4.143 1.00 0.00 H new ATOM 0 HB VAL A 53 4.822 -8.766 2.794 1.00 0.00 H new ATOM 0 HG11 VAL A 53 5.688 -8.441 5.073 1.00 0.00 H new ATOM 0 HG12 VAL A 53 4.649 -7.089 4.561 1.00 0.00 H new ATOM 0 HG13 VAL A 53 4.021 -8.318 5.684 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.280 -10.722 4.216 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.596 -10.693 4.791 1.00 0.00 H new ATOM 0 HG23 VAL A 53 3.946 -11.030 3.079 1.00 0.00 H new ATOM 841 N TRP A 54 3.401 -6.805 1.759 1.00 0.00 N ATOM 842 CA TRP A 54 3.461 -5.439 1.251 1.00 0.00 C ATOM 843 C TRP A 54 2.071 -4.813 1.205 1.00 0.00 C ATOM 844 O TRP A 54 1.917 -3.606 1.392 1.00 0.00 O ATOM 845 CB TRP A 54 4.090 -5.419 -0.143 1.00 0.00 C ATOM 846 CG TRP A 54 4.351 -4.035 -0.656 1.00 0.00 C ATOM 847 CD1 TRP A 54 5.541 -3.366 -0.640 1.00 0.00 C ATOM 848 CD2 TRP A 54 3.399 -3.151 -1.259 1.00 0.00 C ATOM 849 NE1 TRP A 54 5.387 -2.120 -1.198 1.00 0.00 N ATOM 850 CE2 TRP A 54 4.083 -1.964 -1.586 1.00 0.00 C ATOM 851 CE3 TRP A 54 2.038 -3.248 -1.557 1.00 0.00 C ATOM 852 CZ2 TRP A 54 3.448 -0.884 -2.193 1.00 0.00 C ATOM 853 CZ3 TRP A 54 1.410 -2.176 -2.160 1.00 0.00 C ATOM 854 CH2 TRP A 54 2.115 -1.006 -2.474 1.00 0.00 C ATOM 0 H TRP A 54 3.925 -7.484 1.207 1.00 0.00 H new ATOM 0 HA TRP A 54 4.080 -4.852 1.930 1.00 0.00 H new ATOM 0 HB2 TRP A 54 5.028 -5.973 -0.119 1.00 0.00 H new ATOM 0 HB3 TRP A 54 3.431 -5.939 -0.839 1.00 0.00 H new ATOM 0 HD1 TRP A 54 6.467 -3.758 -0.247 1.00 0.00 H new ATOM 0 HE1 TRP A 54 6.125 -1.424 -1.306 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.486 -4.146 -1.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 3.989 0.019 -2.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 0.358 -2.240 -2.394 1.00 0.00 H new ATOM 0 HH2 TRP A 54 1.596 -0.185 -2.947 1.00 0.00 H new ATOM 865 N PHE A 55 1.063 -5.642 0.954 1.00 0.00 N ATOM 866 CA PHE A 55 -0.315 -5.168 0.882 1.00 0.00 C ATOM 867 C PHE A 55 -0.912 -5.018 2.278 1.00 0.00 C ATOM 868 O PHE A 55 -1.637 -4.063 2.555 1.00 0.00 O ATOM 869 CB PHE A 55 -1.165 -6.134 0.053 1.00 0.00 C ATOM 870 CG PHE A 55 -1.197 -5.800 -1.411 1.00 0.00 C ATOM 871 CD1 PHE A 55 -0.043 -5.868 -2.176 1.00 0.00 C ATOM 872 CD2 PHE A 55 -2.379 -5.417 -2.022 1.00 0.00 C ATOM 873 CE1 PHE A 55 -0.069 -5.560 -3.522 1.00 0.00 C ATOM 874 CE2 PHE A 55 -2.411 -5.108 -3.370 1.00 0.00 C ATOM 875 CZ PHE A 55 -1.255 -5.181 -4.121 1.00 0.00 C ATOM 0 H PHE A 55 1.174 -6.644 0.797 1.00 0.00 H new ATOM 0 HA PHE A 55 -0.313 -4.190 0.400 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -0.778 -7.145 0.178 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -2.184 -6.133 0.440 1.00 0.00 H new ATOM 0 HD1 PHE A 55 0.887 -6.165 -1.714 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -3.287 -5.359 -1.439 1.00 0.00 H new ATOM 0 HE1 PHE A 55 0.838 -5.615 -4.106 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -3.339 -4.810 -3.834 1.00 0.00 H new ATOM 0 HZ PHE A 55 -1.278 -4.942 -5.174 1.00 0.00 H new ATOM 885 N SER A 56 -0.601 -5.968 3.154 1.00 0.00 N ATOM 886 CA SER A 56 -1.110 -5.945 4.520 1.00 0.00 C ATOM 887 C SER A 56 -0.781 -4.619 5.200 1.00 0.00 C ATOM 888 O SER A 56 -1.666 -3.932 5.707 1.00 0.00 O ATOM 889 CB SER A 56 -0.521 -7.104 5.326 1.00 0.00 C ATOM 890 OG SER A 56 -0.914 -7.032 6.686 1.00 0.00 O ATOM 0 H SER A 56 0.001 -6.763 2.942 1.00 0.00 H new ATOM 0 HA SER A 56 -2.194 -6.054 4.479 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.849 -8.052 4.899 1.00 0.00 H new ATOM 0 HB3 SER A 56 0.567 -7.083 5.257 1.00 0.00 H new ATOM 0 HG SER A 56 -0.526 -7.785 7.179 1.00 0.00 H new ATOM 896 N ASN A 57 0.501 -4.267 5.205 1.00 0.00 N ATOM 897 CA ASN A 57 0.950 -3.024 5.823 1.00 0.00 C ATOM 898 C ASN A 57 0.278 -1.819 5.170 1.00 0.00 C ATOM 899 O ASN A 57 -0.044 -0.837 5.840 1.00 0.00 O ATOM 900 CB ASN A 57 2.470 -2.895 5.713 1.00 0.00 C ATOM 901 CG ASN A 57 3.199 -3.791 6.696 1.00 0.00 C ATOM 902 OD1 ASN A 57 3.441 -3.408 7.840 1.00 0.00 O ATOM 903 ND2 ASN A 57 3.551 -4.992 6.252 1.00 0.00 N ATOM 0 H ASN A 57 1.247 -4.824 4.788 1.00 0.00 H new ATOM 0 HA ASN A 57 0.670 -3.049 6.876 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.781 -3.145 4.699 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.758 -1.858 5.888 1.00 0.00 H new ATOM 0 HD21 ASN A 57 4.043 -5.639 6.868 1.00 0.00 H new ATOM 0 HD22 ASN A 57 3.329 -5.267 5.295 1.00 0.00 H new ATOM 910 N ARG A 58 0.068 -1.903 3.860 1.00 0.00 N ATOM 911 CA ARG A 58 -0.565 -0.819 3.118 1.00 0.00 C ATOM 912 C ARG A 58 -1.962 -0.532 3.660 1.00 0.00 C ATOM 913 O ARG A 58 -2.281 0.604 4.010 1.00 0.00 O ATOM 914 CB ARG A 58 -0.647 -1.172 1.631 1.00 0.00 C ATOM 915 CG ARG A 58 0.602 -0.801 0.849 1.00 0.00 C ATOM 916 CD ARG A 58 0.673 0.695 0.588 1.00 0.00 C ATOM 917 NE ARG A 58 0.003 1.066 -0.657 1.00 0.00 N ATOM 918 CZ ARG A 58 -0.124 2.319 -1.078 1.00 0.00 C ATOM 919 NH1 ARG A 58 0.372 3.317 -0.359 1.00 0.00 N ATOM 920 NH2 ARG A 58 -0.746 2.577 -2.221 1.00 0.00 N ATOM 0 H ARG A 58 0.327 -2.709 3.291 1.00 0.00 H new ATOM 0 HA ARG A 58 0.045 0.076 3.240 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -0.825 -2.243 1.529 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -1.505 -0.663 1.192 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.486 -1.117 1.403 1.00 0.00 H new ATOM 0 HG3 ARG A 58 0.611 -1.338 -0.100 1.00 0.00 H new ATOM 0 HD2 ARG A 58 0.215 1.230 1.420 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.717 1.006 0.545 1.00 0.00 H new ATOM 0 HE ARG A 58 -0.388 0.322 -1.234 1.00 0.00 H new ATOM 0 HH11 ARG A 58 0.852 3.123 0.520 1.00 0.00 H new ATOM 0 HH12 ARG A 58 0.273 4.279 -0.685 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -1.128 1.812 -2.778 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -0.843 3.540 -2.543 1.00 0.00 H new ATOM 934 N ARG A 59 -2.790 -1.569 3.728 1.00 0.00 N ATOM 935 CA ARG A 59 -4.153 -1.427 4.226 1.00 0.00 C ATOM 936 C ARG A 59 -4.179 -0.610 5.514 1.00 0.00 C ATOM 937 O ARG A 59 -5.049 0.240 5.705 1.00 0.00 O ATOM 938 CB ARG A 59 -4.775 -2.804 4.470 1.00 0.00 C ATOM 939 CG ARG A 59 -4.878 -3.657 3.216 1.00 0.00 C ATOM 940 CD ARG A 59 -5.022 -5.132 3.556 1.00 0.00 C ATOM 941 NE ARG A 59 -5.128 -5.962 2.360 1.00 0.00 N ATOM 942 CZ ARG A 59 -4.859 -7.262 2.341 1.00 0.00 C ATOM 943 NH1 ARG A 59 -4.469 -7.878 3.449 1.00 0.00 N ATOM 944 NH2 ARG A 59 -4.979 -7.950 1.212 1.00 0.00 N ATOM 0 H ARG A 59 -2.541 -2.517 3.445 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.736 -0.901 3.471 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.180 -3.335 5.213 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.771 -2.674 4.893 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.734 -3.334 2.624 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.991 -3.509 2.600 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -4.163 -5.454 4.145 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.906 -5.276 4.177 1.00 0.00 H new ATOM 0 HE ARG A 59 -5.425 -5.519 1.491 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.375 -7.353 4.318 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -4.263 -8.877 3.432 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -5.278 -7.480 0.358 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -4.772 -8.949 1.199 1.00 0.00 H new ATOM 958 N ALA A 60 -3.219 -0.873 6.395 1.00 0.00 N ATOM 959 CA ALA A 60 -3.131 -0.161 7.663 1.00 0.00 C ATOM 960 C ALA A 60 -2.727 1.294 7.450 1.00 0.00 C ATOM 961 O ALA A 60 -3.280 2.200 8.074 1.00 0.00 O ATOM 962 CB ALA A 60 -2.142 -0.854 8.590 1.00 0.00 C ATOM 0 H ALA A 60 -2.492 -1.574 6.253 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.118 -0.173 8.126 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.086 -0.311 9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.473 -1.875 8.778 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -1.157 -0.872 8.123 1.00 0.00 H new ATOM 968 N LYS A 61 -1.759 1.511 6.565 1.00 0.00 N ATOM 969 CA LYS A 61 -1.281 2.855 6.268 1.00 0.00 C ATOM 970 C LYS A 61 -2.321 3.639 5.473 1.00 0.00 C ATOM 971 O LYS A 61 -2.277 4.869 5.419 1.00 0.00 O ATOM 972 CB LYS A 61 0.033 2.791 5.486 1.00 0.00 C ATOM 973 CG LYS A 61 0.463 4.129 4.908 1.00 0.00 C ATOM 974 CD LYS A 61 1.806 4.025 4.205 1.00 0.00 C ATOM 975 CE LYS A 61 2.959 4.263 5.167 1.00 0.00 C ATOM 976 NZ LYS A 61 3.224 5.713 5.370 1.00 0.00 N ATOM 0 H LYS A 61 -1.290 0.772 6.041 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.109 3.369 7.213 1.00 0.00 H new ATOM 0 HB2 LYS A 61 0.819 2.419 6.143 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.072 2.071 4.674 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.291 4.482 4.204 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.525 4.869 5.706 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.906 3.038 3.753 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.851 4.753 3.395 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.733 3.798 6.126 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.858 3.780 4.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.017 5.832 6.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.465 6.153 4.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.375 6.170 5.761 1.00 0.00 H new ATOM 990 N TRP A 62 -3.253 2.921 4.858 1.00 0.00 N ATOM 991 CA TRP A 62 -4.306 3.551 4.067 1.00 0.00 C ATOM 992 C TRP A 62 -5.531 3.842 4.925 1.00 0.00 C ATOM 993 O TRP A 62 -6.071 4.948 4.897 1.00 0.00 O ATOM 994 CB TRP A 62 -4.692 2.653 2.890 1.00 0.00 C ATOM 995 CG TRP A 62 -5.680 3.288 1.959 1.00 0.00 C ATOM 996 CD1 TRP A 62 -5.410 4.185 0.966 1.00 0.00 C ATOM 997 CD2 TRP A 62 -7.096 3.076 1.938 1.00 0.00 C ATOM 998 NE1 TRP A 62 -6.572 4.543 0.326 1.00 0.00 N ATOM 999 CE2 TRP A 62 -7.621 3.876 0.903 1.00 0.00 C ATOM 1000 CE3 TRP A 62 -7.971 2.287 2.689 1.00 0.00 C ATOM 1001 CZ2 TRP A 62 -8.980 3.908 0.606 1.00 0.00 C ATOM 1002 CZ3 TRP A 62 -9.320 2.321 2.391 1.00 0.00 C ATOM 1003 CH2 TRP A 62 -9.814 3.126 1.358 1.00 0.00 C ATOM 0 H TRP A 62 -3.302 1.903 4.891 1.00 0.00 H new ATOM 0 HA TRP A 62 -3.923 4.497 3.683 1.00 0.00 H new ATOM 0 HB2 TRP A 62 -3.793 2.391 2.332 1.00 0.00 H new ATOM 0 HB3 TRP A 62 -5.111 1.723 3.274 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -4.427 4.559 0.720 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -6.642 5.199 -0.452 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -7.600 1.662 3.488 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -9.363 4.529 -0.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -10.005 1.716 2.965 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -10.874 3.130 1.150 1.00 0.00 H new ATOM 1014 N ARG A 63 -5.966 2.843 5.687 1.00 0.00 N ATOM 1015 CA ARG A 63 -7.130 2.993 6.552 1.00 0.00 C ATOM 1016 C ARG A 63 -6.884 4.060 7.615 1.00 0.00 C ATOM 1017 O ARG A 63 -7.815 4.720 8.074 1.00 0.00 O ATOM 1018 CB ARG A 63 -7.471 1.660 7.221 1.00 0.00 C ATOM 1019 CG ARG A 63 -7.857 0.567 6.238 1.00 0.00 C ATOM 1020 CD ARG A 63 -7.753 -0.813 6.869 1.00 0.00 C ATOM 1021 NE ARG A 63 -8.336 -1.849 6.020 1.00 0.00 N ATOM 1022 CZ ARG A 63 -9.644 -2.037 5.885 1.00 0.00 C ATOM 1023 NH1 ARG A 63 -10.500 -1.263 6.538 1.00 0.00 N ATOM 1024 NH2 ARG A 63 -10.098 -3.001 5.095 1.00 0.00 N ATOM 0 H ARG A 63 -5.530 1.922 5.723 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.972 3.307 5.935 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.613 1.326 7.804 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.292 1.814 7.921 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.876 0.733 5.890 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.209 0.618 5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.705 -1.047 7.058 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.258 -0.809 7.835 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.705 -2.461 5.503 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -10.155 -0.521 7.146 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -11.504 -1.410 6.432 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -9.443 -3.598 4.591 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.102 -3.145 4.992 1.00 0.00 H new ATOM 1038 N ARG A 64 -5.622 4.220 8.003 1.00 0.00 N ATOM 1039 CA ARG A 64 -5.253 5.205 9.014 1.00 0.00 C ATOM 1040 C ARG A 64 -5.163 6.601 8.404 1.00 0.00 C ATOM 1041 O ARG A 64 -5.553 7.587 9.029 1.00 0.00 O ATOM 1042 CB ARG A 64 -3.918 4.829 9.657 1.00 0.00 C ATOM 1043 CG ARG A 64 -2.709 5.389 8.923 1.00 0.00 C ATOM 1044 CD ARG A 64 -1.414 5.049 9.643 1.00 0.00 C ATOM 1045 NE ARG A 64 -1.245 3.608 9.815 1.00 0.00 N ATOM 1046 CZ ARG A 64 -0.488 3.065 10.761 1.00 0.00 C ATOM 1047 NH1 ARG A 64 0.165 3.838 11.617 1.00 0.00 N ATOM 1048 NH2 ARG A 64 -0.385 1.744 10.854 1.00 0.00 N ATOM 0 H ARG A 64 -4.839 3.681 7.633 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.028 5.212 9.781 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -3.906 5.188 10.686 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.837 3.743 9.697 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.679 4.988 7.910 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.804 6.471 8.835 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -0.571 5.448 9.080 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -1.404 5.534 10.619 1.00 0.00 H new ATOM 0 HE ARG A 64 -1.735 2.985 9.173 1.00 0.00 H new ATOM 0 HH11 ARG A 64 0.087 4.853 11.550 1.00 0.00 H new ATOM 0 HH12 ARG A 64 0.746 3.418 12.343 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.888 1.146 10.198 1.00 0.00 H new ATOM 0 HH22 ARG A 64 0.197 1.328 11.581 1.00 0.00 H new ATOM 1062 N GLU A 65 -4.646 6.675 7.182 1.00 0.00 N ATOM 1063 CA GLU A 65 -4.503 7.951 6.491 1.00 0.00 C ATOM 1064 C GLU A 65 -5.858 8.467 6.016 1.00 0.00 C ATOM 1065 O GLU A 65 -6.236 9.603 6.302 1.00 0.00 O ATOM 1066 CB GLU A 65 -3.553 7.807 5.299 1.00 0.00 C ATOM 1067 CG GLU A 65 -2.095 8.041 5.652 1.00 0.00 C ATOM 1068 CD GLU A 65 -1.294 8.595 4.489 1.00 0.00 C ATOM 1069 OE1 GLU A 65 -1.846 9.419 3.729 1.00 0.00 O ATOM 1070 OE2 GLU A 65 -0.117 8.205 4.338 1.00 0.00 O ATOM 0 H GLU A 65 -4.320 5.868 6.651 1.00 0.00 H new ATOM 0 HA GLU A 65 -4.085 8.671 7.194 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.660 6.807 4.878 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.848 8.513 4.523 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.035 8.733 6.492 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.649 7.102 5.980 1.00 0.00 H new ATOM 1077 N GLU A 66 -6.584 7.625 5.287 1.00 0.00 N ATOM 1078 CA GLU A 66 -7.896 7.995 4.771 1.00 0.00 C ATOM 1079 C GLU A 66 -8.703 8.745 5.827 1.00 0.00 C ATOM 1080 O GLU A 66 -9.342 9.757 5.535 1.00 0.00 O ATOM 1081 CB GLU A 66 -8.662 6.751 4.317 1.00 0.00 C ATOM 1082 CG GLU A 66 -9.630 7.013 3.177 1.00 0.00 C ATOM 1083 CD GLU A 66 -10.890 7.722 3.633 1.00 0.00 C ATOM 1084 OE1 GLU A 66 -10.847 8.958 3.804 1.00 0.00 O ATOM 1085 OE2 GLU A 66 -11.919 7.041 3.820 1.00 0.00 O ATOM 0 H GLU A 66 -6.285 6.681 5.041 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.748 8.653 3.915 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.948 5.988 4.007 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -9.214 6.345 5.165 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.134 7.615 2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -9.899 6.066 2.709 1.00 0.00 H new ATOM 1092 N LYS A 67 -8.670 8.242 7.056 1.00 0.00 N ATOM 1093 CA LYS A 67 -9.398 8.863 8.157 1.00 0.00 C ATOM 1094 C LYS A 67 -8.929 10.297 8.379 1.00 0.00 C ATOM 1095 O LYS A 67 -9.741 11.218 8.482 1.00 0.00 O ATOM 1096 CB LYS A 67 -9.211 8.051 9.441 1.00 0.00 C ATOM 1097 CG LYS A 67 -10.247 8.354 10.508 1.00 0.00 C ATOM 1098 CD LYS A 67 -11.599 7.756 10.160 1.00 0.00 C ATOM 1099 CE LYS A 67 -11.717 6.320 10.650 1.00 0.00 C ATOM 1100 NZ LYS A 67 -12.614 5.510 9.781 1.00 0.00 N ATOM 0 H LYS A 67 -8.147 7.406 7.315 1.00 0.00 H new ATOM 0 HA LYS A 67 -10.456 8.881 7.895 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -9.251 6.989 9.198 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -8.218 8.248 9.844 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -9.910 7.959 11.466 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.345 9.433 10.625 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -12.390 8.359 10.605 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.744 7.786 9.080 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.728 5.863 10.677 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.099 6.315 11.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.668 4.538 10.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -13.565 5.931 9.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.237 5.494 8.812 1.00 0.00 H new ATOM 1114 N LEU A 68 -7.615 10.482 8.448 1.00 0.00 N ATOM 1115 CA LEU A 68 -7.038 11.805 8.655 1.00 0.00 C ATOM 1116 C LEU A 68 -7.770 12.855 7.823 1.00 0.00 C ATOM 1117 O LEU A 68 -8.144 13.913 8.330 1.00 0.00 O ATOM 1118 CB LEU A 68 -5.552 11.798 8.295 1.00 0.00 C ATOM 1119 CG LEU A 68 -4.667 10.859 9.116 1.00 0.00 C ATOM 1120 CD1 LEU A 68 -3.256 10.827 8.551 1.00 0.00 C ATOM 1121 CD2 LEU A 68 -4.650 11.284 10.577 1.00 0.00 C ATOM 0 H LEU A 68 -6.929 9.732 8.364 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.148 12.061 9.709 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.455 11.529 7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.168 12.813 8.402 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.083 9.853 9.056 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.640 10.154 9.148 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.285 10.474 7.520 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.830 11.830 8.580 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.015 10.605 11.146 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.259 12.298 10.656 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.664 11.254 10.976 1.00 0.00 H new ATOM 1133 N ARG A 69 -7.972 12.553 6.545 1.00 0.00 N ATOM 1134 CA ARG A 69 -8.660 13.469 5.644 1.00 0.00 C ATOM 1135 C ARG A 69 -9.962 13.967 6.264 1.00 0.00 C ATOM 1136 O ARG A 69 -10.221 15.169 6.303 1.00 0.00 O ATOM 1137 CB ARG A 69 -8.949 12.782 4.308 1.00 0.00 C ATOM 1138 CG ARG A 69 -9.096 13.750 3.144 1.00 0.00 C ATOM 1139 CD ARG A 69 -8.750 13.086 1.821 1.00 0.00 C ATOM 1140 NE ARG A 69 -9.794 12.164 1.382 1.00 0.00 N ATOM 1141 CZ ARG A 69 -10.903 12.551 0.760 1.00 0.00 C ATOM 1142 NH1 ARG A 69 -11.111 13.836 0.508 1.00 0.00 N ATOM 1143 NH2 ARG A 69 -11.806 11.652 0.391 1.00 0.00 N ATOM 0 H ARG A 69 -7.669 11.681 6.110 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.009 14.326 5.471 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -8.143 12.082 4.088 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.864 12.197 4.401 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -10.119 14.125 3.108 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.446 14.611 3.301 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.599 13.851 1.060 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -7.808 12.546 1.922 1.00 0.00 H new ATOM 0 HE ARG A 69 -9.665 11.168 1.563 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -10.419 14.530 0.792 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -11.963 14.131 0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -11.650 10.663 0.585 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -12.657 11.950 -0.086 1.00 0.00 H new ATOM 1157 N ASN A 70 -10.777 13.035 6.747 1.00 0.00 N ATOM 1158 CA ASN A 70 -12.052 13.380 7.364 1.00 0.00 C ATOM 1159 C ASN A 70 -11.853 14.369 8.509 1.00 0.00 C ATOM 1160 O ASN A 70 -12.698 15.229 8.752 1.00 0.00 O ATOM 1161 CB ASN A 70 -12.750 12.119 7.880 1.00 0.00 C ATOM 1162 CG ASN A 70 -14.163 12.395 8.356 1.00 0.00 C ATOM 1163 OD1 ASN A 70 -14.944 13.056 7.670 1.00 0.00 O ATOM 1164 ND2 ASN A 70 -14.499 11.887 9.535 1.00 0.00 N ATOM 0 H ASN A 70 -10.577 12.035 6.723 1.00 0.00 H new ATOM 0 HA ASN A 70 -12.678 13.850 6.606 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -12.776 11.371 7.087 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -12.170 11.695 8.699 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.437 12.038 9.907 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -13.820 11.345 10.069 1.00 0.00 H new ATOM 1171 N GLN A 71 -10.729 14.238 9.207 1.00 0.00 N ATOM 1172 CA GLN A 71 -10.419 15.121 10.325 1.00 0.00 C ATOM 1173 C GLN A 71 -10.150 16.541 9.841 1.00 0.00 C ATOM 1174 O GLN A 71 -10.013 17.466 10.642 1.00 0.00 O ATOM 1175 CB GLN A 71 -9.208 14.594 11.097 1.00 0.00 C ATOM 1176 CG GLN A 71 -9.328 13.132 11.494 1.00 0.00 C ATOM 1177 CD GLN A 71 -10.233 12.926 12.693 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -10.801 13.879 13.228 1.00 0.00 O ATOM 1179 NE2 GLN A 71 -10.371 11.677 13.123 1.00 0.00 N ATOM 0 H GLN A 71 -10.019 13.530 9.018 1.00 0.00 H new ATOM 0 HA GLN A 71 -11.284 15.142 10.988 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -8.314 14.724 10.487 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -9.071 15.196 11.996 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.714 12.561 10.650 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -8.337 12.738 11.719 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -9.882 10.918 12.649 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -10.966 11.477 13.927 1.00 0.00 H new ATOM 1188 N ARG A 72 -10.074 16.707 8.524 1.00 0.00 N ATOM 1189 CA ARG A 72 -9.819 18.015 7.932 1.00 0.00 C ATOM 1190 C ARG A 72 -11.084 18.578 7.293 1.00 0.00 C ATOM 1191 O ARG A 72 -11.035 19.568 6.562 1.00 0.00 O ATOM 1192 CB ARG A 72 -8.707 17.917 6.886 1.00 0.00 C ATOM 1193 CG ARG A 72 -7.309 18.038 7.470 1.00 0.00 C ATOM 1194 CD ARG A 72 -6.845 19.487 7.508 1.00 0.00 C ATOM 1195 NE ARG A 72 -5.534 19.624 8.138 1.00 0.00 N ATOM 1196 CZ ARG A 72 -4.976 20.795 8.422 1.00 0.00 C ATOM 1197 NH1 ARG A 72 -5.610 21.924 8.136 1.00 0.00 N ATOM 1198 NH2 ARG A 72 -3.780 20.839 8.995 1.00 0.00 N ATOM 0 H ARG A 72 -10.185 15.952 7.847 1.00 0.00 H new ATOM 0 HA ARG A 72 -9.502 18.690 8.727 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -8.793 16.963 6.365 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -8.850 18.701 6.142 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -7.298 17.624 8.478 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -6.612 17.447 6.875 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -6.803 19.881 6.493 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -7.574 20.087 8.053 1.00 0.00 H new ATOM 0 HE ARG A 72 -5.020 18.775 8.372 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -6.530 21.895 7.696 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -5.178 22.821 8.356 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -3.289 19.973 9.217 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -3.352 21.739 9.213 1.00 0.00 H new ATOM 1212 N ARG A 73 -12.217 17.942 7.574 1.00 0.00 N ATOM 1213 CA ARG A 73 -13.495 18.379 7.026 1.00 0.00 C ATOM 1214 C ARG A 73 -13.707 19.871 7.262 1.00 0.00 C ATOM 1215 O ARG A 73 -14.123 20.284 8.343 1.00 0.00 O ATOM 1216 CB ARG A 73 -14.642 17.584 7.654 1.00 0.00 C ATOM 1217 CG ARG A 73 -16.020 18.110 7.287 1.00 0.00 C ATOM 1218 CD ARG A 73 -16.483 17.570 5.943 1.00 0.00 C ATOM 1219 NE ARG A 73 -15.780 18.200 4.828 1.00 0.00 N ATOM 1220 CZ ARG A 73 -16.059 17.958 3.552 1.00 0.00 C ATOM 1221 NH1 ARG A 73 -17.022 17.105 3.231 1.00 0.00 N ATOM 1222 NH2 ARG A 73 -15.376 18.571 2.594 1.00 0.00 N ATOM 0 H ARG A 73 -12.275 17.122 8.178 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.482 18.198 5.951 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -14.565 16.543 7.341 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.533 17.600 8.738 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -16.736 17.828 8.059 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -15.998 19.199 7.255 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.322 16.492 5.910 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -17.555 17.736 5.836 1.00 0.00 H new ATOM 0 HE ARG A 73 -15.034 18.862 5.041 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -17.551 16.633 3.965 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -17.234 16.921 2.250 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -14.636 19.229 2.837 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -15.591 18.384 1.615 1.00 0.00 H new ATOM 1236 N GLN A 74 -13.417 20.674 6.243 1.00 0.00 N ATOM 1237 CA GLN A 74 -13.574 22.119 6.341 1.00 0.00 C ATOM 1238 C GLN A 74 -12.896 22.657 7.597 1.00 0.00 C ATOM 1239 O GLN A 74 -13.464 23.477 8.318 1.00 0.00 O ATOM 1240 CB GLN A 74 -15.058 22.493 6.349 1.00 0.00 C ATOM 1241 CG GLN A 74 -15.742 22.292 5.006 1.00 0.00 C ATOM 1242 CD GLN A 74 -17.074 23.010 4.917 1.00 0.00 C ATOM 1243 OE1 GLN A 74 -17.257 24.078 5.503 1.00 0.00 O ATOM 1244 NE2 GLN A 74 -18.013 22.428 4.181 1.00 0.00 N ATOM 0 H GLN A 74 -13.072 20.347 5.340 1.00 0.00 H new ATOM 0 HA GLN A 74 -13.097 22.570 5.471 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -15.571 21.895 7.102 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -15.160 23.537 6.647 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -15.087 22.650 4.212 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -15.896 21.226 4.837 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -17.818 21.543 3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -18.929 22.866 4.084 1.00 0.00 H new ATOM 1253 N SER A 75 -11.679 22.190 7.852 1.00 0.00 N ATOM 1254 CA SER A 75 -10.924 22.620 9.023 1.00 0.00 C ATOM 1255 C SER A 75 -10.278 23.982 8.784 1.00 0.00 C ATOM 1256 O SER A 75 -9.216 24.078 8.171 1.00 0.00 O ATOM 1257 CB SER A 75 -9.850 21.588 9.372 1.00 0.00 C ATOM 1258 OG SER A 75 -9.116 21.984 10.518 1.00 0.00 O ATOM 0 H SER A 75 -11.194 21.513 7.263 1.00 0.00 H new ATOM 0 HA SER A 75 -11.618 22.708 9.859 1.00 0.00 H new ATOM 0 HB2 SER A 75 -10.317 20.619 9.552 1.00 0.00 H new ATOM 0 HB3 SER A 75 -9.172 21.464 8.527 1.00 0.00 H new ATOM 0 HG SER A 75 -8.437 21.307 10.721 1.00 0.00 H new ATOM 1264 N GLY A 76 -10.930 25.033 9.272 1.00 0.00 N ATOM 1265 CA GLY A 76 -10.405 26.375 9.101 1.00 0.00 C ATOM 1266 C GLY A 76 -11.333 27.261 8.292 1.00 0.00 C ATOM 1267 O GLY A 76 -12.529 26.998 8.173 1.00 0.00 O ATOM 0 H GLY A 76 -11.812 24.979 9.782 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.240 26.825 10.080 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.435 26.322 8.607 1.00 0.00 H new ATOM 1271 N PRO A 77 -10.777 28.339 7.719 1.00 0.00 N ATOM 1272 CA PRO A 77 -11.544 29.289 6.909 1.00 0.00 C ATOM 1273 C PRO A 77 -11.988 28.690 5.578 1.00 0.00 C ATOM 1274 O PRO A 77 -13.056 29.021 5.063 1.00 0.00 O ATOM 1275 CB PRO A 77 -10.557 30.435 6.675 1.00 0.00 C ATOM 1276 CG PRO A 77 -9.212 29.807 6.797 1.00 0.00 C ATOM 1277 CD PRO A 77 -9.356 28.713 7.818 1.00 0.00 C ATOM 0 HA PRO A 77 -12.465 29.596 7.405 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -10.697 30.883 5.691 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -10.691 31.229 7.409 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -8.881 29.406 5.839 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -8.467 30.538 7.111 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -8.702 27.869 7.598 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -9.101 29.061 8.819 1.00 0.00 H new ATOM 1285 N SER A 78 -11.162 27.806 5.028 1.00 0.00 N ATOM 1286 CA SER A 78 -11.469 27.162 3.756 1.00 0.00 C ATOM 1287 C SER A 78 -12.962 26.873 3.640 1.00 0.00 C ATOM 1288 O SER A 78 -13.472 25.928 4.243 1.00 0.00 O ATOM 1289 CB SER A 78 -10.672 25.863 3.612 1.00 0.00 C ATOM 1290 OG SER A 78 -11.107 24.893 4.548 1.00 0.00 O ATOM 0 H SER A 78 -10.275 27.519 5.443 1.00 0.00 H new ATOM 0 HA SER A 78 -11.186 27.844 2.954 1.00 0.00 H new ATOM 0 HB2 SER A 78 -10.785 25.473 2.600 1.00 0.00 H new ATOM 0 HB3 SER A 78 -9.611 26.065 3.759 1.00 0.00 H new ATOM 0 HG SER A 78 -12.086 24.853 4.546 1.00 0.00 H new ATOM 1296 N SER A 79 -13.658 27.693 2.857 1.00 0.00 N ATOM 1297 CA SER A 79 -15.094 27.528 2.664 1.00 0.00 C ATOM 1298 C SER A 79 -15.792 27.246 3.991 1.00 0.00 C ATOM 1299 O SER A 79 -16.597 26.322 4.098 1.00 0.00 O ATOM 1300 CB SER A 79 -15.370 26.391 1.678 1.00 0.00 C ATOM 1301 OG SER A 79 -16.586 26.603 0.982 1.00 0.00 O ATOM 0 H SER A 79 -13.251 28.477 2.347 1.00 0.00 H new ATOM 0 HA SER A 79 -15.490 28.458 2.256 1.00 0.00 H new ATOM 0 HB2 SER A 79 -14.548 26.316 0.966 1.00 0.00 H new ATOM 0 HB3 SER A 79 -15.415 25.443 2.214 1.00 0.00 H new ATOM 0 HG SER A 79 -16.739 25.864 0.357 1.00 0.00 H new ATOM 1307 N GLY A 80 -15.478 28.053 5.001 1.00 0.00 N ATOM 1308 CA GLY A 80 -16.084 27.875 6.307 1.00 0.00 C ATOM 1309 C GLY A 80 -17.343 28.701 6.480 1.00 0.00 C ATOM 1310 O GLY A 80 -17.931 29.161 5.502 1.00 0.00 O ATOM 0 H GLY A 80 -14.815 28.826 4.937 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -16.322 26.821 6.453 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -15.364 28.149 7.078 1.00 0.00 H new TER 1314 GLY A 80