USER MOD reduce.3.24.130724 H: found=0, std=0, add=534, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 532 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 175:sc=-0.00405 (180deg=-0.0513) USER MOD Single : A 2 LYS NZ :NH3+ -161:sc= -0.0767 (180deg=-0.404) USER MOD Single : A 4 MET CE :methyl 166:sc= -0.454 (180deg=-0.949) USER MOD Single : A 7 LYS NZ :NH3+ -132:sc= 2.2 (180deg=-1.88!) USER MOD Single : A 8 THR OG1 : rot 27:sc= 0.76 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -1.01 X(o=-1,f=-0.64) USER MOD Single : A 13 SER OG : rot 180:sc= -0.0246 USER MOD Single : A 15 TYR OH : rot -7:sc= 0.0369 USER MOD Single : A 18 LYS NZ :NH3+ -138:sc= -0.683! (180deg=-4.66!) USER MOD Single : A 19 LYS NZ :NH3+ -170:sc= -0.0183 (180deg=-0.165) USER MOD Single : A 28 MET CE :methyl 172:sc= -0.481 (180deg=-0.522) USER MOD Single : A 30 ASN : amide:sc= -1.5! C(o=-1.5!,f=-6.5!) USER MOD Single : A 37 LYS NZ :NH3+ 170:sc= 1.2 (180deg=1.04) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.304 X(o=-0.3,f=-0.12) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 MET CE :methyl 149:sc= 0 (180deg=-0.24) USER MOD Single : A 55 THR OG1 : rot -174:sc= -0.0817 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -176:sc= 0.671 (180deg=0.648) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.103 0.673 -0.811 1.00 0.00 N ATOM 2 CA MET A 1 2.748 0.242 -1.239 1.00 0.00 C ATOM 3 C MET A 1 2.702 -1.279 -1.375 1.00 0.00 C ATOM 4 O MET A 1 2.192 -1.819 -2.360 1.00 0.00 O ATOM 5 CB MET A 1 2.369 0.919 -2.569 1.00 0.00 C ATOM 6 CG MET A 1 3.327 0.626 -3.717 1.00 0.00 C ATOM 7 SD MET A 1 2.786 1.359 -5.274 1.00 0.00 S ATOM 8 CE MET A 1 4.081 0.803 -6.384 1.00 0.00 C ATOM 0 H1 MET A 1 4.150 1.712 -0.803 1.00 0.00 H new ATOM 0 H2 MET A 1 4.297 0.310 0.144 1.00 0.00 H new ATOM 0 H3 MET A 1 4.812 0.299 -1.474 1.00 0.00 H new ATOM 0 HA MET A 1 2.024 0.544 -0.483 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.368 0.596 -2.855 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.324 1.997 -2.415 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.317 1.006 -3.465 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.421 -0.453 -3.841 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.885 1.178 -7.389 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.044 1.180 -6.038 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.103 -0.287 -6.401 1.00 0.00 H new ATOM 18 N LYS A 2 3.190 -1.965 -0.350 1.00 0.00 N ATOM 19 CA LYS A 2 3.427 -3.401 -0.416 1.00 0.00 C ATOM 20 C LYS A 2 2.229 -4.188 0.127 1.00 0.00 C ATOM 21 O LYS A 2 1.942 -4.155 1.328 1.00 0.00 O ATOM 22 CB LYS A 2 4.694 -3.732 0.389 1.00 0.00 C ATOM 23 CG LYS A 2 5.164 -5.178 0.280 1.00 0.00 C ATOM 24 CD LYS A 2 5.619 -5.538 -1.129 1.00 0.00 C ATOM 25 CE LYS A 2 6.305 -6.899 -1.158 1.00 0.00 C ATOM 26 NZ LYS A 2 7.566 -6.899 -0.365 1.00 0.00 N ATOM 0 H LYS A 2 3.432 -1.544 0.547 1.00 0.00 H new ATOM 0 HA LYS A 2 3.562 -3.691 -1.458 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.500 -3.077 0.056 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.510 -3.503 1.439 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.985 -5.343 0.977 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.354 -5.844 0.578 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.760 -5.547 -1.800 1.00 0.00 H new ATOM 0 HD3 LYS A 2 6.304 -4.775 -1.498 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.627 -7.656 -0.764 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.524 -7.174 -2.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 8.159 -7.702 -0.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 8.081 -6.011 -0.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 7.340 -6.984 0.647 1.00 0.00 H new ATOM 40 N VAL A 3 1.524 -4.878 -0.767 1.00 0.00 N ATOM 41 CA VAL A 3 0.431 -5.766 -0.378 1.00 0.00 C ATOM 42 C VAL A 3 0.357 -6.957 -1.335 1.00 0.00 C ATOM 43 O VAL A 3 0.576 -6.811 -2.540 1.00 0.00 O ATOM 44 CB VAL A 3 -0.935 -5.028 -0.344 1.00 0.00 C ATOM 45 CG1 VAL A 3 -1.364 -4.587 -1.742 1.00 0.00 C ATOM 46 CG2 VAL A 3 -2.007 -5.896 0.311 1.00 0.00 C ATOM 0 H VAL A 3 1.692 -4.838 -1.772 1.00 0.00 H new ATOM 0 HA VAL A 3 0.640 -6.119 0.632 1.00 0.00 H new ATOM 0 HB VAL A 3 -0.812 -4.130 0.261 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.324 -4.074 -1.683 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -0.616 -3.911 -2.156 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -1.459 -5.461 -2.386 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -2.954 -5.357 0.323 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -2.122 -6.820 -0.255 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -1.710 -6.131 1.333 1.00 0.00 H new ATOM 56 N MET A 4 0.063 -8.132 -0.790 1.00 0.00 N ATOM 57 CA MET A 4 0.004 -9.365 -1.576 1.00 0.00 C ATOM 58 C MET A 4 -1.346 -10.049 -1.395 1.00 0.00 C ATOM 59 O MET A 4 -1.792 -10.264 -0.271 1.00 0.00 O ATOM 60 CB MET A 4 1.136 -10.315 -1.157 1.00 0.00 C ATOM 61 CG MET A 4 1.048 -11.706 -1.779 1.00 0.00 C ATOM 62 SD MET A 4 2.426 -12.771 -1.302 1.00 0.00 S ATOM 63 CE MET A 4 2.265 -12.772 0.484 1.00 0.00 C ATOM 0 H MET A 4 -0.140 -8.260 0.201 1.00 0.00 H new ATOM 0 HA MET A 4 0.127 -9.110 -2.629 1.00 0.00 H new ATOM 0 HB2 MET A 4 2.091 -9.867 -1.430 1.00 0.00 H new ATOM 0 HB3 MET A 4 1.129 -10.414 -0.071 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.111 -12.175 -1.479 1.00 0.00 H new ATOM 0 HG3 MET A 4 1.025 -11.613 -2.865 1.00 0.00 H new ATOM 0 HE1 MET A 4 2.877 -13.570 0.904 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.598 -11.813 0.880 1.00 0.00 H new ATOM 0 HE3 MET A 4 1.222 -12.934 0.755 1.00 0.00 H new ATOM 73 N ILE A 5 -1.992 -10.389 -2.505 1.00 0.00 N ATOM 74 CA ILE A 5 -3.287 -11.064 -2.470 1.00 0.00 C ATOM 75 C ILE A 5 -3.096 -12.571 -2.627 1.00 0.00 C ATOM 76 O ILE A 5 -2.494 -13.028 -3.598 1.00 0.00 O ATOM 77 CB ILE A 5 -4.231 -10.540 -3.583 1.00 0.00 C ATOM 78 CG1 ILE A 5 -4.304 -9.000 -3.542 1.00 0.00 C ATOM 79 CG2 ILE A 5 -5.626 -11.156 -3.442 1.00 0.00 C ATOM 80 CD1 ILE A 5 -4.764 -8.431 -2.211 1.00 0.00 C ATOM 0 H ILE A 5 -1.639 -10.208 -3.445 1.00 0.00 H new ATOM 0 HA ILE A 5 -3.747 -10.851 -1.505 1.00 0.00 H new ATOM 0 HB ILE A 5 -3.827 -10.839 -4.550 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.320 -8.595 -3.776 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -4.983 -8.659 -4.324 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.273 -10.776 -4.232 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -5.555 -12.241 -3.522 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.044 -10.891 -2.471 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -4.787 -7.343 -2.269 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.762 -8.803 -1.982 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.073 -8.738 -1.426 1.00 0.00 H new ATOM 92 N ARG A 6 -3.603 -13.335 -1.663 1.00 0.00 N ATOM 93 CA ARG A 6 -3.442 -14.786 -1.648 1.00 0.00 C ATOM 94 C ARG A 6 -4.688 -15.492 -2.187 1.00 0.00 C ATOM 95 O ARG A 6 -5.817 -15.188 -1.791 1.00 0.00 O ATOM 96 CB ARG A 6 -3.128 -15.262 -0.220 1.00 0.00 C ATOM 97 CG ARG A 6 -1.668 -15.067 0.189 1.00 0.00 C ATOM 98 CD ARG A 6 -0.765 -16.116 -0.453 1.00 0.00 C ATOM 99 NE ARG A 6 0.654 -15.903 -0.148 1.00 0.00 N ATOM 100 CZ ARG A 6 1.254 -16.313 0.971 1.00 0.00 C ATOM 101 NH1 ARG A 6 0.562 -16.926 1.923 1.00 0.00 N ATOM 102 NH2 ARG A 6 2.555 -16.120 1.125 1.00 0.00 N ATOM 0 H ARG A 6 -4.135 -12.968 -0.874 1.00 0.00 H new ATOM 0 HA ARG A 6 -2.609 -15.044 -2.302 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.767 -14.724 0.481 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -3.381 -16.319 -0.136 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -1.336 -14.071 -0.104 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -1.582 -15.125 1.274 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -1.062 -17.106 -0.107 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.907 -16.100 -1.534 1.00 0.00 H new ATOM 0 HE ARG A 6 1.220 -15.408 -0.838 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.438 -17.088 1.803 1.00 0.00 H new ATOM 0 HH12 ARG A 6 1.030 -17.236 2.775 1.00 0.00 H new ATOM 0 HH21 ARG A 6 3.093 -15.660 0.390 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.019 -16.431 1.978 1.00 0.00 H new ATOM 116 N LYS A 7 -4.462 -16.431 -3.099 1.00 0.00 N ATOM 117 CA LYS A 7 -5.524 -17.252 -3.669 1.00 0.00 C ATOM 118 C LYS A 7 -5.656 -18.554 -2.882 1.00 0.00 C ATOM 119 O LYS A 7 -4.701 -19.328 -2.792 1.00 0.00 O ATOM 120 CB LYS A 7 -5.213 -17.568 -5.141 1.00 0.00 C ATOM 121 CG LYS A 7 -5.443 -16.402 -6.102 1.00 0.00 C ATOM 122 CD LYS A 7 -6.931 -16.115 -6.309 1.00 0.00 C ATOM 123 CE LYS A 7 -7.679 -17.348 -6.821 1.00 0.00 C ATOM 124 NZ LYS A 7 -7.129 -17.852 -8.111 1.00 0.00 N ATOM 0 H LYS A 7 -3.534 -16.645 -3.465 1.00 0.00 H new ATOM 0 HA LYS A 7 -6.463 -16.701 -3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -4.174 -17.887 -5.219 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -5.829 -18.410 -5.457 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.952 -15.510 -5.713 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -4.980 -16.627 -7.063 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -7.373 -15.786 -5.368 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -7.048 -15.297 -7.020 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -7.625 -18.139 -6.073 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.733 -17.102 -6.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -7.908 -18.019 -8.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -6.476 -17.147 -8.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -6.618 -18.743 -7.946 1.00 0.00 H new ATOM 138 N THR A 8 -6.830 -18.789 -2.312 1.00 0.00 N ATOM 139 CA THR A 8 -7.096 -20.017 -1.579 1.00 0.00 C ATOM 140 C THR A 8 -8.308 -20.723 -2.175 1.00 0.00 C ATOM 141 O THR A 8 -9.230 -20.068 -2.668 1.00 0.00 O ATOM 142 CB THR A 8 -7.338 -19.725 -0.078 1.00 0.00 C ATOM 143 OG1 THR A 8 -8.295 -18.668 0.061 1.00 0.00 O ATOM 144 CG2 THR A 8 -6.043 -19.335 0.628 1.00 0.00 C ATOM 0 H THR A 8 -7.617 -18.141 -2.344 1.00 0.00 H new ATOM 0 HA THR A 8 -6.223 -20.664 -1.664 1.00 0.00 H new ATOM 0 HB THR A 8 -7.719 -20.635 0.385 1.00 0.00 H new ATOM 0 HG1 THR A 8 -8.881 -18.652 -0.724 1.00 0.00 H new ATOM 0 HG21 THR A 8 -6.248 -19.137 1.680 1.00 0.00 H new ATOM 0 HG22 THR A 8 -5.324 -20.150 0.546 1.00 0.00 H new ATOM 0 HG23 THR A 8 -5.631 -18.439 0.163 1.00 0.00 H new ATOM 152 N ALA A 9 -8.293 -22.051 -2.146 1.00 0.00 N ATOM 153 CA ALA A 9 -9.399 -22.846 -2.667 1.00 0.00 C ATOM 154 C ALA A 9 -10.685 -22.534 -1.909 1.00 0.00 C ATOM 155 O ALA A 9 -11.772 -22.480 -2.494 1.00 0.00 O ATOM 156 CB ALA A 9 -9.072 -24.332 -2.573 1.00 0.00 C ATOM 0 H ALA A 9 -7.523 -22.602 -1.765 1.00 0.00 H new ATOM 0 HA ALA A 9 -9.547 -22.588 -3.716 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -9.906 -24.914 -2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -8.176 -24.545 -3.155 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -8.900 -24.602 -1.531 1.00 0.00 H new ATOM 162 N THR A 10 -10.552 -22.321 -0.604 1.00 0.00 N ATOM 163 CA THR A 10 -11.692 -22.021 0.248 1.00 0.00 C ATOM 164 C THR A 10 -11.651 -20.567 0.732 1.00 0.00 C ATOM 165 O THR A 10 -11.263 -20.283 1.869 1.00 0.00 O ATOM 166 CB THR A 10 -11.744 -22.987 1.459 1.00 0.00 C ATOM 167 OG1 THR A 10 -11.613 -24.342 1.001 1.00 0.00 O ATOM 168 CG2 THR A 10 -13.054 -22.841 2.233 1.00 0.00 C ATOM 0 H THR A 10 -9.659 -22.351 -0.113 1.00 0.00 H new ATOM 0 HA THR A 10 -12.595 -22.159 -0.346 1.00 0.00 H new ATOM 0 HB THR A 10 -10.920 -22.734 2.127 1.00 0.00 H new ATOM 0 HG1 THR A 10 -11.644 -24.951 1.768 1.00 0.00 H new ATOM 0 HG21 THR A 10 -13.058 -23.533 3.076 1.00 0.00 H new ATOM 0 HG22 THR A 10 -13.147 -21.819 2.602 1.00 0.00 H new ATOM 0 HG23 THR A 10 -13.893 -23.067 1.575 1.00 0.00 H new ATOM 176 N GLY A 11 -12.005 -19.643 -0.160 1.00 0.00 N ATOM 177 CA GLY A 11 -12.137 -18.246 0.216 1.00 0.00 C ATOM 178 C GLY A 11 -11.053 -17.379 -0.391 1.00 0.00 C ATOM 179 O GLY A 11 -10.427 -17.757 -1.384 1.00 0.00 O ATOM 0 H GLY A 11 -12.203 -19.840 -1.141 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -13.113 -17.878 -0.101 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -12.101 -18.160 1.302 1.00 0.00 H new ATOM 183 N HIS A 12 -10.840 -16.208 0.199 1.00 0.00 N ATOM 184 CA HIS A 12 -9.804 -15.284 -0.250 1.00 0.00 C ATOM 185 C HIS A 12 -9.104 -14.670 0.959 1.00 0.00 C ATOM 186 O HIS A 12 -9.727 -14.456 2.001 1.00 0.00 O ATOM 187 CB HIS A 12 -10.421 -14.175 -1.115 1.00 0.00 C ATOM 188 CG HIS A 12 -11.188 -14.683 -2.304 1.00 0.00 C ATOM 189 ND1 HIS A 12 -12.560 -14.819 -2.317 1.00 0.00 N ATOM 190 CD2 HIS A 12 -10.765 -15.085 -3.527 1.00 0.00 C ATOM 191 CE1 HIS A 12 -12.945 -15.281 -3.493 1.00 0.00 C ATOM 192 NE2 HIS A 12 -11.877 -15.452 -4.247 1.00 0.00 N ATOM 0 H HIS A 12 -11.378 -15.873 0.998 1.00 0.00 H new ATOM 0 HA HIS A 12 -9.076 -15.832 -0.848 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -11.087 -13.573 -0.496 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -9.626 -13.515 -1.463 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -9.742 -15.112 -3.873 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -13.964 -15.485 -3.788 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -11.876 -15.799 -5.206 1.00 0.00 H new ATOM 201 N SER A 13 -7.811 -14.400 0.830 1.00 0.00 N ATOM 202 CA SER A 13 -7.042 -13.775 1.901 1.00 0.00 C ATOM 203 C SER A 13 -6.130 -12.696 1.328 1.00 0.00 C ATOM 204 O SER A 13 -5.612 -12.837 0.218 1.00 0.00 O ATOM 205 CB SER A 13 -6.213 -14.830 2.649 1.00 0.00 C ATOM 206 OG SER A 13 -7.044 -15.829 3.218 1.00 0.00 O ATOM 0 H SER A 13 -7.270 -14.605 -0.010 1.00 0.00 H new ATOM 0 HA SER A 13 -7.733 -13.314 2.606 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.503 -15.292 1.963 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.630 -14.348 3.434 1.00 0.00 H new ATOM 0 HG SER A 13 -6.490 -16.488 3.686 1.00 0.00 H new ATOM 212 N ALA A 14 -5.954 -11.611 2.072 1.00 0.00 N ATOM 213 CA ALA A 14 -5.062 -10.532 1.660 1.00 0.00 C ATOM 214 C ALA A 14 -4.019 -10.275 2.736 1.00 0.00 C ATOM 215 O ALA A 14 -4.346 -10.180 3.923 1.00 0.00 O ATOM 216 CB ALA A 14 -5.845 -9.258 1.361 1.00 0.00 C ATOM 0 H ALA A 14 -6.418 -11.454 2.967 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.556 -10.838 0.744 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.156 -8.470 1.056 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.557 -9.448 0.557 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -6.383 -8.943 2.255 1.00 0.00 H new ATOM 222 N TYR A 15 -2.767 -10.183 2.316 1.00 0.00 N ATOM 223 CA TYR A 15 -1.666 -9.915 3.221 1.00 0.00 C ATOM 224 C TYR A 15 -1.197 -8.469 3.066 1.00 0.00 C ATOM 225 O TYR A 15 -0.506 -8.120 2.102 1.00 0.00 O ATOM 226 CB TYR A 15 -0.514 -10.897 2.954 1.00 0.00 C ATOM 227 CG TYR A 15 0.748 -10.606 3.749 1.00 0.00 C ATOM 228 CD1 TYR A 15 0.775 -10.749 5.132 1.00 0.00 C ATOM 229 CD2 TYR A 15 1.908 -10.178 3.113 1.00 0.00 C ATOM 230 CE1 TYR A 15 1.921 -10.475 5.854 1.00 0.00 C ATOM 231 CE2 TYR A 15 3.053 -9.901 3.829 1.00 0.00 C ATOM 232 CZ TYR A 15 3.057 -10.052 5.197 1.00 0.00 C ATOM 233 OH TYR A 15 4.199 -9.772 5.911 1.00 0.00 O ATOM 0 H TYR A 15 -2.488 -10.292 1.341 1.00 0.00 H new ATOM 0 HA TYR A 15 -2.005 -10.055 4.247 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -0.851 -11.907 3.186 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -0.273 -10.877 1.891 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -0.113 -11.079 5.650 1.00 0.00 H new ATOM 0 HD2 TYR A 15 1.912 -10.061 2.039 1.00 0.00 H new ATOM 0 HE1 TYR A 15 1.927 -10.592 6.928 1.00 0.00 H new ATOM 0 HE2 TYR A 15 3.944 -9.567 3.318 1.00 0.00 H new ATOM 0 HH TYR A 15 4.004 -9.815 6.870 1.00 0.00 H new ATOM 243 N VAL A 16 -1.601 -7.631 4.012 1.00 0.00 N ATOM 244 CA VAL A 16 -1.157 -6.248 4.075 1.00 0.00 C ATOM 245 C VAL A 16 0.269 -6.200 4.621 1.00 0.00 C ATOM 246 O VAL A 16 0.484 -6.142 5.836 1.00 0.00 O ATOM 247 CB VAL A 16 -2.100 -5.395 4.964 1.00 0.00 C ATOM 248 CG1 VAL A 16 -1.671 -3.931 4.968 1.00 0.00 C ATOM 249 CG2 VAL A 16 -3.551 -5.537 4.503 1.00 0.00 C ATOM 0 H VAL A 16 -2.246 -7.893 4.757 1.00 0.00 H new ATOM 0 HA VAL A 16 -1.180 -5.828 3.069 1.00 0.00 H new ATOM 0 HB VAL A 16 -2.030 -5.767 5.986 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -2.348 -3.355 5.598 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.656 -3.850 5.357 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -1.702 -3.540 3.951 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -4.196 -4.931 5.139 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.639 -5.199 3.470 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -3.853 -6.582 4.570 1.00 0.00 H new ATOM 259 N ALA A 17 1.239 -6.253 3.717 1.00 0.00 N ATOM 260 CA ALA A 17 2.646 -6.372 4.089 1.00 0.00 C ATOM 261 C ALA A 17 3.131 -5.171 4.899 1.00 0.00 C ATOM 262 O ALA A 17 3.973 -5.317 5.786 1.00 0.00 O ATOM 263 CB ALA A 17 3.500 -6.562 2.845 1.00 0.00 C ATOM 0 H ALA A 17 1.076 -6.215 2.711 1.00 0.00 H new ATOM 0 HA ALA A 17 2.746 -7.249 4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 17 4.548 -6.650 3.133 1.00 0.00 H new ATOM 0 HB2 ALA A 17 3.189 -7.468 2.325 1.00 0.00 H new ATOM 0 HB3 ALA A 17 3.376 -5.704 2.184 1.00 0.00 H new ATOM 269 N LYS A 18 2.582 -3.993 4.612 1.00 0.00 N ATOM 270 CA LYS A 18 2.975 -2.772 5.320 1.00 0.00 C ATOM 271 C LYS A 18 2.508 -2.794 6.777 1.00 0.00 C ATOM 272 O LYS A 18 2.748 -1.845 7.524 1.00 0.00 O ATOM 273 CB LYS A 18 2.447 -1.522 4.587 1.00 0.00 C ATOM 274 CG LYS A 18 0.926 -1.452 4.408 1.00 0.00 C ATOM 275 CD LYS A 18 0.175 -0.990 5.669 1.00 0.00 C ATOM 276 CE LYS A 18 0.490 0.458 6.058 1.00 0.00 C ATOM 277 NZ LYS A 18 1.809 0.608 6.736 1.00 0.00 N ATOM 0 H LYS A 18 1.867 -3.856 3.898 1.00 0.00 H new ATOM 0 HA LYS A 18 4.064 -2.728 5.328 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.771 -0.637 5.135 1.00 0.00 H new ATOM 0 HB3 LYS A 18 2.913 -1.476 3.603 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.697 -0.770 3.589 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.558 -2.436 4.117 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.898 -1.091 5.503 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.432 -1.647 6.499 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.476 1.080 5.163 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.295 0.830 6.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.716 1.267 7.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.127 -0.318 7.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.506 0.980 6.060 1.00 0.00 H new ATOM 291 N LYS A 19 1.811 -3.863 7.162 1.00 0.00 N ATOM 292 CA LYS A 19 1.376 -4.053 8.547 1.00 0.00 C ATOM 293 C LYS A 19 1.604 -5.506 8.983 1.00 0.00 C ATOM 294 O LYS A 19 1.344 -5.866 10.134 1.00 0.00 O ATOM 295 CB LYS A 19 -0.111 -3.679 8.695 1.00 0.00 C ATOM 296 CG LYS A 19 -0.602 -3.649 10.143 1.00 0.00 C ATOM 297 CD LYS A 19 -2.111 -3.444 10.239 1.00 0.00 C ATOM 298 CE LYS A 19 -2.582 -3.366 11.690 1.00 0.00 C ATOM 299 NZ LYS A 19 -2.241 -4.595 12.461 1.00 0.00 N ATOM 0 H LYS A 19 1.534 -4.615 6.531 1.00 0.00 H new ATOM 0 HA LYS A 19 1.966 -3.400 9.190 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.276 -2.700 8.246 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.713 -4.393 8.132 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -0.333 -4.584 10.635 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -0.094 -2.848 10.680 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.387 -2.528 9.718 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.622 -4.264 9.735 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.128 -2.500 12.171 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -3.661 -3.213 11.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.723 -4.572 13.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.550 -5.435 11.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.212 -4.638 12.609 1.00 0.00 H new ATOM 313 N ASP A 20 2.105 -6.332 8.056 1.00 0.00 N ATOM 314 CA ASP A 20 2.276 -7.772 8.296 1.00 0.00 C ATOM 315 C ASP A 20 0.948 -8.416 8.697 1.00 0.00 C ATOM 316 O ASP A 20 0.918 -9.414 9.419 1.00 0.00 O ATOM 317 CB ASP A 20 3.352 -8.034 9.368 1.00 0.00 C ATOM 318 CG ASP A 20 4.766 -7.944 8.813 1.00 0.00 C ATOM 319 OD1 ASP A 20 5.289 -6.816 8.664 1.00 0.00 O ATOM 320 OD2 ASP A 20 5.366 -9.006 8.527 1.00 0.00 O ATOM 0 H ASP A 20 2.400 -6.027 7.129 1.00 0.00 H new ATOM 0 HA ASP A 20 2.612 -8.228 7.365 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.237 -7.313 10.177 1.00 0.00 H new ATOM 0 HB3 ASP A 20 3.197 -9.023 9.799 1.00 0.00 H new ATOM 325 N LEU A 21 -0.146 -7.850 8.198 1.00 0.00 N ATOM 326 CA LEU A 21 -1.487 -8.334 8.511 1.00 0.00 C ATOM 327 C LEU A 21 -2.010 -9.241 7.402 1.00 0.00 C ATOM 328 O LEU A 21 -2.179 -8.799 6.272 1.00 0.00 O ATOM 329 CB LEU A 21 -2.451 -7.150 8.695 1.00 0.00 C ATOM 330 CG LEU A 21 -3.944 -7.520 8.781 1.00 0.00 C ATOM 331 CD1 LEU A 21 -4.240 -8.322 10.044 1.00 0.00 C ATOM 332 CD2 LEU A 21 -4.821 -6.269 8.703 1.00 0.00 C ATOM 0 H LEU A 21 -0.129 -7.047 7.569 1.00 0.00 H new ATOM 0 HA LEU A 21 -1.429 -8.905 9.438 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.174 -6.616 9.604 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -2.313 -6.459 7.864 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.183 -8.151 7.925 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.301 -8.569 10.078 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.654 -9.241 10.037 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.977 -7.730 10.921 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -5.871 -6.556 8.766 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.577 -5.602 9.530 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.641 -5.757 7.758 1.00 0.00 H new ATOM 344 N GLU A 22 -2.262 -10.502 7.726 1.00 0.00 N ATOM 345 CA GLU A 22 -2.972 -11.395 6.815 1.00 0.00 C ATOM 346 C GLU A 22 -4.355 -11.666 7.383 1.00 0.00 C ATOM 347 O GLU A 22 -4.485 -12.097 8.535 1.00 0.00 O ATOM 348 CB GLU A 22 -2.229 -12.722 6.613 1.00 0.00 C ATOM 349 CG GLU A 22 -2.891 -13.619 5.567 1.00 0.00 C ATOM 350 CD GLU A 22 -2.313 -15.025 5.525 1.00 0.00 C ATOM 351 OE1 GLU A 22 -1.256 -15.221 4.893 1.00 0.00 O ATOM 352 OE2 GLU A 22 -2.925 -15.939 6.120 1.00 0.00 O ATOM 0 H GLU A 22 -1.987 -10.931 8.610 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.040 -10.910 5.841 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.202 -12.516 6.311 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.181 -13.254 7.563 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.959 -13.679 5.775 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.783 -13.160 4.584 1.00 0.00 H new ATOM 359 N GLU A 23 -5.387 -11.405 6.594 1.00 0.00 N ATOM 360 CA GLU A 23 -6.754 -11.587 7.054 1.00 0.00 C ATOM 361 C GLU A 23 -7.642 -12.094 5.923 1.00 0.00 C ATOM 362 O GLU A 23 -7.300 -11.969 4.742 1.00 0.00 O ATOM 363 CB GLU A 23 -7.300 -10.267 7.624 1.00 0.00 C ATOM 364 CG GLU A 23 -8.613 -10.414 8.386 1.00 0.00 C ATOM 365 CD GLU A 23 -8.533 -11.424 9.519 1.00 0.00 C ATOM 366 OE1 GLU A 23 -8.749 -12.628 9.262 1.00 0.00 O ATOM 367 OE2 GLU A 23 -8.263 -11.019 10.666 1.00 0.00 O ATOM 0 H GLU A 23 -5.303 -11.068 5.635 1.00 0.00 H new ATOM 0 HA GLU A 23 -6.757 -12.336 7.846 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.553 -9.834 8.289 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.444 -9.562 6.805 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -8.902 -9.444 8.791 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -9.397 -10.716 7.692 1.00 0.00 H new ATOM 374 N LEU A 24 -8.777 -12.668 6.300 1.00 0.00 N ATOM 375 CA LEU A 24 -9.735 -13.201 5.345 1.00 0.00 C ATOM 376 C LEU A 24 -10.523 -12.066 4.699 1.00 0.00 C ATOM 377 O LEU A 24 -10.971 -11.138 5.383 1.00 0.00 O ATOM 378 CB LEU A 24 -10.692 -14.177 6.047 1.00 0.00 C ATOM 379 CG LEU A 24 -10.019 -15.370 6.749 1.00 0.00 C ATOM 380 CD1 LEU A 24 -11.056 -16.240 7.454 1.00 0.00 C ATOM 381 CD2 LEU A 24 -9.206 -16.198 5.753 1.00 0.00 C ATOM 0 H LEU A 24 -9.058 -12.776 7.275 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.193 -13.738 4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -11.272 -13.623 6.785 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.397 -14.561 5.310 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.336 -14.977 7.502 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.557 -17.077 7.943 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.583 -15.645 8.200 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.770 -16.620 6.723 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.739 -17.036 6.272 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -9.865 -16.577 4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.434 -15.573 5.305 1.00 0.00 H new ATOM 393 N ILE A 25 -10.676 -12.132 3.383 1.00 0.00 N ATOM 394 CA ILE A 25 -11.448 -11.143 2.645 1.00 0.00 C ATOM 395 C ILE A 25 -12.934 -11.470 2.753 1.00 0.00 C ATOM 396 O ILE A 25 -13.469 -12.260 1.970 1.00 0.00 O ATOM 397 CB ILE A 25 -11.019 -11.084 1.155 1.00 0.00 C ATOM 398 CG1 ILE A 25 -9.525 -10.731 1.049 1.00 0.00 C ATOM 399 CG2 ILE A 25 -11.874 -10.077 0.380 1.00 0.00 C ATOM 400 CD1 ILE A 25 -8.997 -10.671 -0.370 1.00 0.00 C ATOM 0 H ILE A 25 -10.272 -12.866 2.802 1.00 0.00 H new ATOM 0 HA ILE A 25 -11.256 -10.163 3.083 1.00 0.00 H new ATOM 0 HB ILE A 25 -11.177 -12.066 0.709 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -9.357 -9.766 1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.949 -11.469 1.608 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -11.554 -10.054 -0.662 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -12.922 -10.374 0.431 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -11.756 -9.086 0.818 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -7.937 -10.416 -0.353 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -9.130 -11.641 -0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -9.544 -9.912 -0.930 1.00 0.00 H new ATOM 412 N VAL A 26 -13.580 -10.892 3.760 1.00 0.00 N ATOM 413 CA VAL A 26 -15.000 -11.130 4.004 1.00 0.00 C ATOM 414 C VAL A 26 -15.858 -10.310 3.048 1.00 0.00 C ATOM 415 O VAL A 26 -16.936 -10.746 2.629 1.00 0.00 O ATOM 416 CB VAL A 26 -15.390 -10.801 5.469 1.00 0.00 C ATOM 417 CG1 VAL A 26 -14.663 -11.728 6.442 1.00 0.00 C ATOM 418 CG2 VAL A 26 -15.101 -9.335 5.800 1.00 0.00 C ATOM 0 H VAL A 26 -13.142 -10.253 4.423 1.00 0.00 H new ATOM 0 HA VAL A 26 -15.183 -12.190 3.830 1.00 0.00 H new ATOM 0 HB VAL A 26 -16.462 -10.964 5.576 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -14.950 -11.481 7.464 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -14.933 -12.762 6.229 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -13.586 -11.603 6.328 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -15.384 -9.133 6.833 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -14.037 -9.135 5.669 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -15.675 -8.691 5.134 1.00 0.00 H new ATOM 428 N GLU A 27 -15.370 -9.131 2.687 1.00 0.00 N ATOM 429 CA GLU A 27 -16.112 -8.238 1.812 1.00 0.00 C ATOM 430 C GLU A 27 -15.230 -7.778 0.660 1.00 0.00 C ATOM 431 O GLU A 27 -14.036 -7.538 0.840 1.00 0.00 O ATOM 432 CB GLU A 27 -16.641 -7.033 2.603 1.00 0.00 C ATOM 433 CG GLU A 27 -17.690 -6.225 1.849 1.00 0.00 C ATOM 434 CD GLU A 27 -18.870 -7.082 1.423 1.00 0.00 C ATOM 435 OE1 GLU A 27 -19.809 -7.260 2.230 1.00 0.00 O ATOM 436 OE2 GLU A 27 -18.851 -7.607 0.290 1.00 0.00 O ATOM 0 H GLU A 27 -14.464 -8.772 2.987 1.00 0.00 H new ATOM 0 HA GLU A 27 -16.964 -8.779 1.400 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -17.070 -7.384 3.542 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -15.806 -6.381 2.858 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -18.043 -5.410 2.481 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -17.235 -5.771 0.969 1.00 0.00 H new ATOM 443 N MET A 28 -15.819 -7.679 -0.523 1.00 0.00 N ATOM 444 CA MET A 28 -15.103 -7.260 -1.722 1.00 0.00 C ATOM 445 C MET A 28 -16.058 -6.592 -2.701 1.00 0.00 C ATOM 446 O MET A 28 -17.269 -6.794 -2.631 1.00 0.00 O ATOM 447 CB MET A 28 -14.385 -8.455 -2.381 1.00 0.00 C ATOM 448 CG MET A 28 -15.195 -9.748 -2.394 1.00 0.00 C ATOM 449 SD MET A 28 -16.793 -9.581 -3.213 1.00 0.00 S ATOM 450 CE MET A 28 -17.465 -11.224 -2.968 1.00 0.00 C ATOM 0 H MET A 28 -16.805 -7.886 -0.680 1.00 0.00 H new ATOM 0 HA MET A 28 -14.343 -6.534 -1.433 1.00 0.00 H new ATOM 0 HB2 MET A 28 -14.131 -8.190 -3.407 1.00 0.00 H new ATOM 0 HB3 MET A 28 -13.447 -8.634 -1.856 1.00 0.00 H new ATOM 0 HG2 MET A 28 -14.618 -10.525 -2.895 1.00 0.00 H new ATOM 0 HG3 MET A 28 -15.353 -10.080 -1.368 1.00 0.00 H new ATOM 0 HE1 MET A 28 -18.506 -11.243 -3.291 1.00 0.00 H new ATOM 0 HE2 MET A 28 -16.890 -11.943 -3.552 1.00 0.00 H new ATOM 0 HE3 MET A 28 -17.408 -11.486 -1.912 1.00 0.00 H new ATOM 460 N GLU A 29 -15.505 -5.778 -3.591 1.00 0.00 N ATOM 461 CA GLU A 29 -16.294 -5.073 -4.602 1.00 0.00 C ATOM 462 C GLU A 29 -16.931 -6.060 -5.577 1.00 0.00 C ATOM 463 O GLU A 29 -18.151 -6.228 -5.608 1.00 0.00 O ATOM 464 CB GLU A 29 -15.394 -4.095 -5.370 1.00 0.00 C ATOM 465 CG GLU A 29 -16.100 -3.311 -6.472 1.00 0.00 C ATOM 466 CD GLU A 29 -16.963 -2.181 -5.933 1.00 0.00 C ATOM 467 OE1 GLU A 29 -18.128 -2.430 -5.568 1.00 0.00 O ATOM 468 OE2 GLU A 29 -16.468 -1.035 -5.866 1.00 0.00 O ATOM 0 H GLU A 29 -14.504 -5.586 -3.636 1.00 0.00 H new ATOM 0 HA GLU A 29 -17.089 -4.522 -4.099 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.960 -3.389 -4.662 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.568 -4.653 -5.811 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -15.355 -2.900 -7.153 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -16.722 -3.991 -7.054 1.00 0.00 H new ATOM 475 N ASN A 30 -16.087 -6.719 -6.358 1.00 0.00 N ATOM 476 CA ASN A 30 -16.540 -7.632 -7.401 1.00 0.00 C ATOM 477 C ASN A 30 -16.669 -9.043 -6.834 1.00 0.00 C ATOM 478 O ASN A 30 -15.744 -9.529 -6.182 1.00 0.00 O ATOM 479 CB ASN A 30 -15.540 -7.605 -8.564 1.00 0.00 C ATOM 480 CG ASN A 30 -15.948 -8.429 -9.776 1.00 0.00 C ATOM 481 OD1 ASN A 30 -17.130 -8.584 -10.084 1.00 0.00 O ATOM 482 ND2 ASN A 30 -14.958 -8.946 -10.489 1.00 0.00 N ATOM 0 H ASN A 30 -15.073 -6.637 -6.288 1.00 0.00 H new ATOM 0 HA ASN A 30 -17.518 -7.319 -7.767 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -15.396 -6.571 -8.877 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -14.576 -7.966 -8.205 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -15.163 -9.494 -11.325 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -13.991 -8.796 -10.202 1.00 0.00 H new ATOM 489 N PRO A 31 -17.817 -9.711 -7.080 1.00 0.00 N ATOM 490 CA PRO A 31 -18.118 -11.066 -6.580 1.00 0.00 C ATOM 491 C PRO A 31 -16.922 -12.021 -6.641 1.00 0.00 C ATOM 492 O PRO A 31 -16.766 -12.887 -5.778 1.00 0.00 O ATOM 493 CB PRO A 31 -19.251 -11.548 -7.519 1.00 0.00 C ATOM 494 CG PRO A 31 -19.406 -10.463 -8.543 1.00 0.00 C ATOM 495 CD PRO A 31 -18.938 -9.207 -7.876 1.00 0.00 C ATOM 0 HA PRO A 31 -18.389 -11.049 -5.524 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -18.995 -12.498 -7.988 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -20.178 -11.704 -6.968 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -18.815 -10.677 -9.433 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -20.444 -10.373 -8.864 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -18.625 -8.451 -8.596 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -19.713 -8.756 -7.256 1.00 0.00 H new ATOM 503 N ALA A 32 -16.093 -11.871 -7.672 1.00 0.00 N ATOM 504 CA ALA A 32 -14.879 -12.669 -7.797 1.00 0.00 C ATOM 505 C ALA A 32 -13.881 -12.296 -6.711 1.00 0.00 C ATOM 506 O ALA A 32 -13.576 -13.103 -5.830 1.00 0.00 O ATOM 507 CB ALA A 32 -14.243 -12.472 -9.165 1.00 0.00 C ATOM 0 H ALA A 32 -16.241 -11.205 -8.431 1.00 0.00 H new ATOM 0 HA ALA A 32 -15.154 -13.718 -7.684 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -13.339 -13.077 -9.236 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -14.946 -12.777 -9.940 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -13.988 -11.421 -9.300 1.00 0.00 H new ATOM 513 N LEU A 33 -13.390 -11.058 -6.786 1.00 0.00 N ATOM 514 CA LEU A 33 -12.358 -10.568 -5.878 1.00 0.00 C ATOM 515 C LEU A 33 -11.909 -9.168 -6.297 1.00 0.00 C ATOM 516 O LEU A 33 -12.187 -8.175 -5.621 1.00 0.00 O ATOM 517 CB LEU A 33 -11.149 -11.518 -5.884 1.00 0.00 C ATOM 518 CG LEU A 33 -10.078 -11.223 -4.820 1.00 0.00 C ATOM 519 CD1 LEU A 33 -10.688 -11.240 -3.421 1.00 0.00 C ATOM 520 CD2 LEU A 33 -8.923 -12.222 -4.922 1.00 0.00 C ATOM 0 H LEU A 33 -13.696 -10.371 -7.475 1.00 0.00 H new ATOM 0 HA LEU A 33 -12.775 -10.526 -4.872 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.508 -12.537 -5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.681 -11.479 -6.868 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.680 -10.225 -5.005 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -9.913 -11.029 -2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.468 -10.482 -3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -11.119 -12.222 -3.224 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -8.177 -11.995 -4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.302 -13.233 -4.769 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.467 -12.151 -5.909 1.00 0.00 H new ATOM 532 N TRP A 34 -11.226 -9.110 -7.435 1.00 0.00 N ATOM 533 CA TRP A 34 -10.672 -7.867 -7.958 1.00 0.00 C ATOM 534 C TRP A 34 -11.777 -7.002 -8.555 1.00 0.00 C ATOM 535 O TRP A 34 -12.587 -7.489 -9.349 1.00 0.00 O ATOM 536 CB TRP A 34 -9.611 -8.183 -9.022 1.00 0.00 C ATOM 537 CG TRP A 34 -8.479 -9.019 -8.501 1.00 0.00 C ATOM 538 CD1 TRP A 34 -8.508 -10.352 -8.192 1.00 0.00 C ATOM 539 CD2 TRP A 34 -7.147 -8.581 -8.226 1.00 0.00 C ATOM 540 NE1 TRP A 34 -7.278 -10.758 -7.739 1.00 0.00 N ATOM 541 CE2 TRP A 34 -6.427 -9.691 -7.753 1.00 0.00 C ATOM 542 CE3 TRP A 34 -6.493 -7.355 -8.337 1.00 0.00 C ATOM 543 CZ2 TRP A 34 -5.092 -9.609 -7.389 1.00 0.00 C ATOM 544 CZ3 TRP A 34 -5.164 -7.274 -7.976 1.00 0.00 C ATOM 545 CH2 TRP A 34 -4.476 -8.395 -7.508 1.00 0.00 C ATOM 0 H TRP A 34 -11.041 -9.924 -8.021 1.00 0.00 H new ATOM 0 HA TRP A 34 -10.207 -7.314 -7.142 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -10.085 -8.703 -9.854 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -9.212 -7.248 -9.416 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -9.373 -10.991 -8.290 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -7.039 -11.703 -7.440 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -7.018 -6.483 -8.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -4.558 -10.474 -7.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -4.648 -6.329 -8.057 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -3.435 -8.301 -7.234 1.00 0.00 H new ATOM 556 N GLY A 35 -11.806 -5.728 -8.172 1.00 0.00 N ATOM 557 CA GLY A 35 -12.837 -4.826 -8.654 1.00 0.00 C ATOM 558 C GLY A 35 -12.528 -3.378 -8.336 1.00 0.00 C ATOM 559 O GLY A 35 -12.435 -2.545 -9.236 1.00 0.00 O ATOM 0 H GLY A 35 -11.132 -5.304 -7.535 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -12.945 -4.944 -9.732 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -13.793 -5.098 -8.206 1.00 0.00 H new ATOM 563 N GLY A 36 -12.349 -3.086 -7.054 1.00 0.00 N ATOM 564 CA GLY A 36 -12.094 -1.723 -6.621 1.00 0.00 C ATOM 565 C GLY A 36 -11.909 -1.641 -5.123 1.00 0.00 C ATOM 566 O GLY A 36 -10.815 -1.377 -4.640 1.00 0.00 O ATOM 0 H GLY A 36 -12.376 -3.773 -6.301 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -11.202 -1.343 -7.120 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -12.924 -1.084 -6.921 1.00 0.00 H new ATOM 570 N LYS A 37 -12.984 -1.886 -4.386 1.00 0.00 N ATOM 571 CA LYS A 37 -12.946 -1.870 -2.925 1.00 0.00 C ATOM 572 C LYS A 37 -12.889 -3.299 -2.379 1.00 0.00 C ATOM 573 O LYS A 37 -13.443 -4.221 -2.976 1.00 0.00 O ATOM 574 CB LYS A 37 -14.191 -1.157 -2.371 1.00 0.00 C ATOM 575 CG LYS A 37 -15.494 -1.911 -2.647 1.00 0.00 C ATOM 576 CD LYS A 37 -16.683 -1.358 -1.870 1.00 0.00 C ATOM 577 CE LYS A 37 -17.083 0.046 -2.319 1.00 0.00 C ATOM 578 NZ LYS A 37 -17.701 0.048 -3.673 1.00 0.00 N ATOM 0 H LYS A 37 -13.901 -2.100 -4.777 1.00 0.00 H new ATOM 0 HA LYS A 37 -12.053 -1.332 -2.609 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.077 -1.025 -1.295 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.256 -0.161 -2.809 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -15.713 -1.867 -3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.359 -2.962 -2.393 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.534 -2.029 -1.990 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.440 -1.339 -0.808 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -17.785 0.469 -1.600 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -16.203 0.689 -2.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -18.108 0.985 -3.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.976 -0.169 -4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.451 -0.671 -3.713 1.00 0.00 H new ATOM 592 N VAL A 38 -12.199 -3.475 -1.260 1.00 0.00 N ATOM 593 CA VAL A 38 -12.135 -4.756 -0.555 1.00 0.00 C ATOM 594 C VAL A 38 -12.025 -4.491 0.948 1.00 0.00 C ATOM 595 O VAL A 38 -11.556 -3.429 1.358 1.00 0.00 O ATOM 596 CB VAL A 38 -10.933 -5.621 -1.051 1.00 0.00 C ATOM 597 CG1 VAL A 38 -10.584 -6.733 -0.061 1.00 0.00 C ATOM 598 CG2 VAL A 38 -11.223 -6.220 -2.429 1.00 0.00 C ATOM 0 H VAL A 38 -11.664 -2.732 -0.811 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.044 -5.320 -0.764 1.00 0.00 H new ATOM 0 HB VAL A 38 -10.073 -4.956 -1.127 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -9.743 -7.311 -0.444 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -10.315 -6.294 0.900 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -11.445 -7.388 0.069 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -10.371 -6.818 -2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -12.109 -6.852 -2.372 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -11.396 -5.417 -3.146 1.00 0.00 H new ATOM 608 N THR A 39 -12.490 -5.426 1.768 1.00 0.00 N ATOM 609 CA THR A 39 -12.429 -5.272 3.215 1.00 0.00 C ATOM 610 C THR A 39 -12.127 -6.610 3.898 1.00 0.00 C ATOM 611 O THR A 39 -12.750 -7.634 3.598 1.00 0.00 O ATOM 612 CB THR A 39 -13.747 -4.681 3.763 1.00 0.00 C ATOM 613 OG1 THR A 39 -14.044 -3.451 3.079 1.00 0.00 O ATOM 614 CG2 THR A 39 -13.656 -4.421 5.263 1.00 0.00 C ATOM 0 H THR A 39 -12.914 -6.299 1.454 1.00 0.00 H new ATOM 0 HA THR A 39 -11.618 -4.579 3.439 1.00 0.00 H new ATOM 0 HB THR A 39 -14.543 -5.406 3.590 1.00 0.00 H new ATOM 0 HG1 THR A 39 -14.881 -3.078 3.426 1.00 0.00 H new ATOM 0 HG21 THR A 39 -14.599 -4.005 5.618 1.00 0.00 H new ATOM 0 HG22 THR A 39 -13.453 -5.357 5.783 1.00 0.00 H new ATOM 0 HG23 THR A 39 -12.850 -3.714 5.462 1.00 0.00 H new ATOM 622 N LEU A 40 -11.154 -6.588 4.805 1.00 0.00 N ATOM 623 CA LEU A 40 -10.752 -7.775 5.555 1.00 0.00 C ATOM 624 C LEU A 40 -11.621 -7.945 6.799 1.00 0.00 C ATOM 625 O LEU A 40 -12.306 -7.012 7.217 1.00 0.00 O ATOM 626 CB LEU A 40 -9.272 -7.679 5.972 1.00 0.00 C ATOM 627 CG LEU A 40 -8.241 -7.785 4.833 1.00 0.00 C ATOM 628 CD1 LEU A 40 -8.524 -9.010 3.971 1.00 0.00 C ATOM 629 CD2 LEU A 40 -8.211 -6.513 3.989 1.00 0.00 C ATOM 0 H LEU A 40 -10.623 -5.749 5.040 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.884 -8.641 4.906 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.121 -6.729 6.485 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.067 -8.468 6.695 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.254 -7.901 5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.786 -9.070 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.467 -9.908 4.586 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.522 -8.929 3.539 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.473 -6.621 3.194 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.194 -6.344 3.550 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.944 -5.665 4.619 1.00 0.00 H new ATOM 641 N ALA A 41 -11.564 -9.133 7.399 1.00 0.00 N ATOM 642 CA ALA A 41 -12.321 -9.428 8.620 1.00 0.00 C ATOM 643 C ALA A 41 -11.860 -8.538 9.777 1.00 0.00 C ATOM 644 O ALA A 41 -12.584 -8.336 10.753 1.00 0.00 O ATOM 645 CB ALA A 41 -12.177 -10.902 8.985 1.00 0.00 C ATOM 0 H ALA A 41 -10.999 -9.912 7.059 1.00 0.00 H new ATOM 0 HA ALA A 41 -13.374 -9.216 8.432 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -12.743 -11.109 9.893 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.559 -11.518 8.171 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.125 -11.134 9.152 1.00 0.00 H new ATOM 651 N ASN A 42 -10.649 -8.002 9.650 1.00 0.00 N ATOM 652 CA ASN A 42 -10.077 -7.114 10.663 1.00 0.00 C ATOM 653 C ASN A 42 -10.686 -5.714 10.553 1.00 0.00 C ATOM 654 O ASN A 42 -10.480 -4.864 11.417 1.00 0.00 O ATOM 655 CB ASN A 42 -8.545 -7.050 10.503 1.00 0.00 C ATOM 656 CG ASN A 42 -7.867 -6.170 11.548 1.00 0.00 C ATOM 657 OD1 ASN A 42 -7.511 -6.633 12.632 1.00 0.00 O ATOM 658 ND2 ASN A 42 -7.676 -4.897 11.227 1.00 0.00 N ATOM 0 H ASN A 42 -10.039 -8.168 8.849 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.310 -7.512 11.651 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.137 -8.059 10.567 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -8.306 -6.672 9.509 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -7.221 -4.267 11.888 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.984 -4.548 10.319 1.00 0.00 H new ATOM 665 N GLY A 43 -11.447 -5.485 9.484 1.00 0.00 N ATOM 666 CA GLY A 43 -12.044 -4.179 9.248 1.00 0.00 C ATOM 667 C GLY A 43 -11.202 -3.330 8.317 1.00 0.00 C ATOM 668 O GLY A 43 -11.648 -2.283 7.843 1.00 0.00 O ATOM 0 H GLY A 43 -11.662 -6.185 8.773 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -13.039 -4.307 8.822 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -12.169 -3.660 10.198 1.00 0.00 H new ATOM 672 N TRP A 44 -9.983 -3.794 8.045 1.00 0.00 N ATOM 673 CA TRP A 44 -9.054 -3.088 7.168 1.00 0.00 C ATOM 674 C TRP A 44 -9.613 -3.038 5.747 1.00 0.00 C ATOM 675 O TRP A 44 -9.920 -4.075 5.160 1.00 0.00 O ATOM 676 CB TRP A 44 -7.687 -3.793 7.178 1.00 0.00 C ATOM 677 CG TRP A 44 -6.615 -3.068 6.408 1.00 0.00 C ATOM 678 CD1 TRP A 44 -6.427 -3.068 5.052 1.00 0.00 C ATOM 679 CD2 TRP A 44 -5.573 -2.249 6.954 1.00 0.00 C ATOM 680 NE1 TRP A 44 -5.343 -2.294 4.725 1.00 0.00 N ATOM 681 CE2 TRP A 44 -4.800 -1.782 5.874 1.00 0.00 C ATOM 682 CE3 TRP A 44 -5.221 -1.863 8.251 1.00 0.00 C ATOM 683 CZ2 TRP A 44 -3.698 -0.950 6.053 1.00 0.00 C ATOM 684 CZ3 TRP A 44 -4.127 -1.038 8.426 1.00 0.00 C ATOM 685 CH2 TRP A 44 -3.377 -0.588 7.333 1.00 0.00 C ATOM 0 H TRP A 44 -9.614 -4.666 8.425 1.00 0.00 H new ATOM 0 HA TRP A 44 -8.927 -2.068 7.530 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.360 -3.913 8.211 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.804 -4.794 6.763 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -7.043 -3.600 4.342 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -4.997 -2.127 3.780 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -5.794 -2.204 9.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -3.117 -0.603 5.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -3.845 -0.735 9.424 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -2.528 0.058 7.503 1.00 0.00 H new ATOM 696 N GLN A 45 -9.754 -1.835 5.209 1.00 0.00 N ATOM 697 CA GLN A 45 -10.265 -1.649 3.856 1.00 0.00 C ATOM 698 C GLN A 45 -9.111 -1.441 2.875 1.00 0.00 C ATOM 699 O GLN A 45 -8.260 -0.568 3.073 1.00 0.00 O ATOM 700 CB GLN A 45 -11.229 -0.458 3.806 1.00 0.00 C ATOM 701 CG GLN A 45 -12.423 -0.594 4.745 1.00 0.00 C ATOM 702 CD GLN A 45 -13.420 0.541 4.591 1.00 0.00 C ATOM 703 OE1 GLN A 45 -14.360 0.454 3.799 1.00 0.00 O ATOM 704 NE2 GLN A 45 -13.221 1.615 5.337 1.00 0.00 N ATOM 0 H GLN A 45 -9.520 -0.967 5.691 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.810 -2.547 3.566 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -10.682 0.451 4.057 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -11.593 -0.339 2.785 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -12.925 -1.542 4.553 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -12.069 -0.624 5.775 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -12.431 1.649 5.981 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -13.858 2.409 5.268 1.00 0.00 H new ATOM 713 N LEU A 46 -9.101 -2.245 1.817 1.00 0.00 N ATOM 714 CA LEU A 46 -8.048 -2.213 0.812 1.00 0.00 C ATOM 715 C LEU A 46 -8.662 -1.974 -0.562 1.00 0.00 C ATOM 716 O LEU A 46 -9.715 -2.527 -0.879 1.00 0.00 O ATOM 717 CB LEU A 46 -7.268 -3.538 0.821 1.00 0.00 C ATOM 718 CG LEU A 46 -6.126 -3.646 -0.208 1.00 0.00 C ATOM 719 CD1 LEU A 46 -5.024 -2.629 0.086 1.00 0.00 C ATOM 720 CD2 LEU A 46 -5.564 -5.066 -0.240 1.00 0.00 C ATOM 0 H LEU A 46 -9.826 -2.939 1.633 1.00 0.00 H new ATOM 0 HA LEU A 46 -7.357 -1.402 1.041 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.851 -3.686 1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.970 -4.353 0.645 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.534 -3.418 -1.193 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.231 -2.727 -0.655 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.438 -1.622 0.043 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.616 -2.812 1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.759 -5.122 -0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.177 -5.326 0.745 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.355 -5.764 -0.516 1.00 0.00 H new ATOM 732 N GLU A 47 -8.015 -1.144 -1.365 1.00 0.00 N ATOM 733 CA GLU A 47 -8.522 -0.810 -2.687 1.00 0.00 C ATOM 734 C GLU A 47 -7.862 -1.712 -3.725 1.00 0.00 C ATOM 735 O GLU A 47 -6.704 -1.504 -4.099 1.00 0.00 O ATOM 736 CB GLU A 47 -8.257 0.670 -2.994 1.00 0.00 C ATOM 737 CG GLU A 47 -9.156 1.251 -4.075 1.00 0.00 C ATOM 738 CD GLU A 47 -8.812 2.699 -4.390 1.00 0.00 C ATOM 739 OE1 GLU A 47 -9.224 3.600 -3.626 1.00 0.00 O ATOM 740 OE2 GLU A 47 -8.113 2.940 -5.395 1.00 0.00 O ATOM 0 H GLU A 47 -7.135 -0.688 -1.124 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.599 -0.972 -2.719 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.386 1.248 -2.079 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.217 0.786 -3.300 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.065 0.652 -4.981 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.196 1.188 -3.754 1.00 0.00 H new ATOM 747 N LEU A 48 -8.601 -2.724 -4.166 1.00 0.00 N ATOM 748 CA LEU A 48 -8.072 -3.753 -5.053 1.00 0.00 C ATOM 749 C LEU A 48 -8.514 -3.497 -6.497 1.00 0.00 C ATOM 750 O LEU A 48 -9.667 -3.762 -6.851 1.00 0.00 O ATOM 751 CB LEU A 48 -8.561 -5.133 -4.590 1.00 0.00 C ATOM 752 CG LEU A 48 -7.819 -6.334 -5.195 1.00 0.00 C ATOM 753 CD1 LEU A 48 -6.334 -6.285 -4.836 1.00 0.00 C ATOM 754 CD2 LEU A 48 -8.444 -7.647 -4.729 1.00 0.00 C ATOM 0 H LEU A 48 -9.582 -2.854 -3.919 1.00 0.00 H new ATOM 0 HA LEU A 48 -6.983 -3.724 -5.016 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.475 -5.184 -3.505 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.620 -5.224 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.911 -6.281 -6.280 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.825 -7.144 -5.274 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -5.896 -5.366 -5.226 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.221 -6.310 -3.752 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -7.903 -8.484 -5.170 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.389 -7.711 -3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -9.487 -7.685 -5.042 1.00 0.00 H new ATOM 766 N PRO A 49 -7.603 -2.994 -7.355 1.00 0.00 N ATOM 767 CA PRO A 49 -7.940 -2.629 -8.738 1.00 0.00 C ATOM 768 C PRO A 49 -8.209 -3.865 -9.598 1.00 0.00 C ATOM 769 O PRO A 49 -7.469 -4.845 -9.526 1.00 0.00 O ATOM 770 CB PRO A 49 -6.691 -1.883 -9.223 1.00 0.00 C ATOM 771 CG PRO A 49 -5.575 -2.440 -8.404 1.00 0.00 C ATOM 772 CD PRO A 49 -6.170 -2.776 -7.059 1.00 0.00 C ATOM 0 HA PRO A 49 -8.849 -2.032 -8.804 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.521 -2.046 -10.287 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.791 -0.807 -9.077 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -5.151 -3.327 -8.875 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.767 -1.716 -8.303 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.710 -3.665 -6.628 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -6.027 -1.966 -6.344 1.00 0.00 H new ATOM 780 N ALA A 50 -9.261 -3.813 -10.410 1.00 0.00 N ATOM 781 CA ALA A 50 -9.662 -4.952 -11.238 1.00 0.00 C ATOM 782 C ALA A 50 -8.596 -5.290 -12.286 1.00 0.00 C ATOM 783 O ALA A 50 -8.700 -4.891 -13.448 1.00 0.00 O ATOM 784 CB ALA A 50 -11.010 -4.676 -11.900 1.00 0.00 C ATOM 0 H ALA A 50 -9.856 -2.991 -10.514 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.764 -5.821 -10.588 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -11.296 -5.531 -12.513 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -11.766 -4.511 -11.132 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -10.932 -3.789 -12.529 1.00 0.00 H new ATOM 790 N MET A 51 -7.561 -6.006 -11.855 1.00 0.00 N ATOM 791 CA MET A 51 -6.478 -6.425 -12.744 1.00 0.00 C ATOM 792 C MET A 51 -6.834 -7.744 -13.427 1.00 0.00 C ATOM 793 O MET A 51 -6.913 -7.819 -14.655 1.00 0.00 O ATOM 794 CB MET A 51 -5.166 -6.568 -11.954 1.00 0.00 C ATOM 795 CG MET A 51 -4.650 -5.254 -11.376 1.00 0.00 C ATOM 796 SD MET A 51 -4.175 -4.070 -12.654 1.00 0.00 S ATOM 797 CE MET A 51 -3.671 -2.666 -11.660 1.00 0.00 C ATOM 0 H MET A 51 -7.448 -6.311 -10.888 1.00 0.00 H new ATOM 0 HA MET A 51 -6.341 -5.663 -13.511 1.00 0.00 H new ATOM 0 HB2 MET A 51 -5.318 -7.277 -11.140 1.00 0.00 H new ATOM 0 HB3 MET A 51 -4.403 -6.991 -12.608 1.00 0.00 H new ATOM 0 HG2 MET A 51 -5.421 -4.812 -10.745 1.00 0.00 H new ATOM 0 HG3 MET A 51 -3.791 -5.456 -10.736 1.00 0.00 H new ATOM 0 HE1 MET A 51 -2.886 -2.115 -12.179 1.00 0.00 H new ATOM 0 HE2 MET A 51 -4.526 -2.011 -11.496 1.00 0.00 H new ATOM 0 HE3 MET A 51 -3.293 -3.017 -10.700 1.00 0.00 H new ATOM 807 N ALA A 52 -7.057 -8.773 -12.619 1.00 0.00 N ATOM 808 CA ALA A 52 -7.429 -10.093 -13.117 1.00 0.00 C ATOM 809 C ALA A 52 -8.290 -10.810 -12.084 1.00 0.00 C ATOM 810 O ALA A 52 -7.826 -11.085 -10.978 1.00 0.00 O ATOM 811 CB ALA A 52 -6.181 -10.912 -13.439 1.00 0.00 C ATOM 0 H ALA A 52 -6.986 -8.717 -11.603 1.00 0.00 H new ATOM 0 HA ALA A 52 -8.005 -9.977 -14.035 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -6.476 -11.894 -13.809 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -5.595 -10.398 -14.201 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -5.580 -11.030 -12.537 1.00 0.00 H new ATOM 817 N ALA A 53 -9.536 -11.103 -12.455 1.00 0.00 N ATOM 818 CA ALA A 53 -10.515 -11.692 -11.538 1.00 0.00 C ATOM 819 C ALA A 53 -9.976 -12.964 -10.884 1.00 0.00 C ATOM 820 O ALA A 53 -9.957 -13.082 -9.656 1.00 0.00 O ATOM 821 CB ALA A 53 -11.821 -11.982 -12.275 1.00 0.00 C ATOM 0 H ALA A 53 -9.896 -10.940 -13.396 1.00 0.00 H new ATOM 0 HA ALA A 53 -10.708 -10.970 -10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.540 -12.419 -11.583 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.225 -11.054 -12.679 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.631 -12.680 -13.090 1.00 0.00 H new ATOM 827 N ASP A 54 -9.543 -13.915 -11.705 1.00 0.00 N ATOM 828 CA ASP A 54 -8.957 -15.155 -11.204 1.00 0.00 C ATOM 829 C ASP A 54 -7.442 -15.126 -11.364 1.00 0.00 C ATOM 830 O ASP A 54 -6.907 -15.486 -12.417 1.00 0.00 O ATOM 831 CB ASP A 54 -9.545 -16.378 -11.925 1.00 0.00 C ATOM 832 CG ASP A 54 -8.891 -17.687 -11.488 1.00 0.00 C ATOM 833 OD1 ASP A 54 -8.605 -17.847 -10.283 1.00 0.00 O ATOM 834 OD2 ASP A 54 -8.672 -18.570 -12.348 1.00 0.00 O ATOM 0 H ASP A 54 -9.587 -13.851 -12.722 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.200 -15.239 -10.145 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -10.616 -16.429 -11.731 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -9.421 -16.255 -13.001 1.00 0.00 H new ATOM 839 N THR A 55 -6.764 -14.654 -10.327 1.00 0.00 N ATOM 840 CA THR A 55 -5.309 -14.605 -10.309 1.00 0.00 C ATOM 841 C THR A 55 -4.734 -16.016 -10.132 1.00 0.00 C ATOM 842 O THR A 55 -5.144 -16.738 -9.221 1.00 0.00 O ATOM 843 CB THR A 55 -4.821 -13.699 -9.155 1.00 0.00 C ATOM 844 OG1 THR A 55 -5.712 -12.583 -9.010 1.00 0.00 O ATOM 845 CG2 THR A 55 -3.407 -13.192 -9.413 1.00 0.00 C ATOM 0 H THR A 55 -7.204 -14.296 -9.479 1.00 0.00 H new ATOM 0 HA THR A 55 -4.964 -14.194 -11.258 1.00 0.00 H new ATOM 0 HB THR A 55 -4.811 -14.289 -8.238 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.349 -11.958 -8.348 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.091 -12.558 -8.585 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.727 -14.039 -9.501 1.00 0.00 H new ATOM 0 HG23 THR A 55 -3.390 -12.616 -10.338 1.00 0.00 H new ATOM 853 N PRO A 56 -3.793 -16.437 -11.000 1.00 0.00 N ATOM 854 CA PRO A 56 -3.207 -17.785 -10.935 1.00 0.00 C ATOM 855 C PRO A 56 -2.408 -18.016 -9.647 1.00 0.00 C ATOM 856 O PRO A 56 -2.544 -19.060 -9.002 1.00 0.00 O ATOM 857 CB PRO A 56 -2.295 -17.847 -12.173 1.00 0.00 C ATOM 858 CG PRO A 56 -2.008 -16.422 -12.514 1.00 0.00 C ATOM 859 CD PRO A 56 -3.233 -15.645 -12.116 1.00 0.00 C ATOM 0 HA PRO A 56 -3.972 -18.561 -10.926 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -1.377 -18.394 -11.960 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -2.787 -18.359 -13.000 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.128 -16.063 -11.981 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -1.803 -16.309 -13.579 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -2.982 -14.631 -11.803 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.940 -15.558 -12.941 1.00 0.00 H new ATOM 867 N LEU A 57 -1.599 -17.031 -9.267 1.00 0.00 N ATOM 868 CA LEU A 57 -0.742 -17.136 -8.086 1.00 0.00 C ATOM 869 C LEU A 57 -0.863 -15.876 -7.225 1.00 0.00 C ATOM 870 O LEU A 57 -1.415 -14.872 -7.675 1.00 0.00 O ATOM 871 CB LEU A 57 0.725 -17.396 -8.515 1.00 0.00 C ATOM 872 CG LEU A 57 1.327 -16.444 -9.576 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.567 -15.042 -9.016 1.00 0.00 C ATOM 874 CD2 LEU A 57 2.628 -17.024 -10.133 1.00 0.00 C ATOM 0 H LEU A 57 -1.518 -16.144 -9.763 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.069 -17.981 -7.480 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.351 -17.350 -7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.790 -18.414 -8.898 1.00 0.00 H new ATOM 0 HG LEU A 57 0.601 -16.353 -10.384 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.990 -14.407 -9.794 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.622 -14.619 -8.677 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.261 -15.099 -8.177 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.040 -16.344 -10.878 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.346 -17.152 -9.323 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.427 -17.990 -10.596 1.00 0.00 H new ATOM 886 N PRO A 58 -0.373 -15.917 -5.966 1.00 0.00 N ATOM 887 CA PRO A 58 -0.388 -14.748 -5.078 1.00 0.00 C ATOM 888 C PRO A 58 0.420 -13.584 -5.659 1.00 0.00 C ATOM 889 O PRO A 58 1.649 -13.645 -5.750 1.00 0.00 O ATOM 890 CB PRO A 58 0.246 -15.271 -3.777 1.00 0.00 C ATOM 891 CG PRO A 58 1.020 -16.477 -4.186 1.00 0.00 C ATOM 892 CD PRO A 58 0.227 -17.094 -5.303 1.00 0.00 C ATOM 0 HA PRO A 58 -1.392 -14.350 -4.931 1.00 0.00 H new ATOM 0 HB2 PRO A 58 0.894 -14.521 -3.324 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -0.516 -15.522 -3.039 1.00 0.00 H new ATOM 0 HG2 PRO A 58 2.023 -16.208 -4.517 1.00 0.00 H new ATOM 0 HG3 PRO A 58 1.135 -17.172 -3.354 1.00 0.00 H new ATOM 0 HD2 PRO A 58 0.861 -17.662 -5.984 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -0.534 -17.779 -4.929 1.00 0.00 H new ATOM 900 N ILE A 59 -0.283 -12.534 -6.064 1.00 0.00 N ATOM 901 CA ILE A 59 0.338 -11.383 -6.715 1.00 0.00 C ATOM 902 C ILE A 59 0.499 -10.219 -5.735 1.00 0.00 C ATOM 903 O ILE A 59 -0.311 -10.049 -4.817 1.00 0.00 O ATOM 904 CB ILE A 59 -0.507 -10.929 -7.934 1.00 0.00 C ATOM 905 CG1 ILE A 59 0.138 -9.728 -8.649 1.00 0.00 C ATOM 906 CG2 ILE A 59 -1.927 -10.591 -7.493 1.00 0.00 C ATOM 907 CD1 ILE A 59 -0.635 -9.248 -9.862 1.00 0.00 C ATOM 0 H ILE A 59 -1.294 -12.454 -5.952 1.00 0.00 H new ATOM 0 HA ILE A 59 1.327 -11.687 -7.058 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.545 -11.755 -8.645 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.233 -8.904 -7.941 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.147 -10.001 -8.958 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -2.511 -10.274 -8.357 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.389 -11.472 -7.047 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.898 -9.786 -6.759 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.118 -8.400 -10.311 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.708 -10.056 -10.590 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.636 -8.943 -9.558 1.00 0.00 H new ATOM 919 N THR A 60 1.555 -9.434 -5.928 1.00 0.00 N ATOM 920 CA THR A 60 1.801 -8.242 -5.126 1.00 0.00 C ATOM 921 C THR A 60 1.394 -6.989 -5.905 1.00 0.00 C ATOM 922 O THR A 60 1.925 -6.722 -6.987 1.00 0.00 O ATOM 923 CB THR A 60 3.291 -8.144 -4.726 1.00 0.00 C ATOM 924 OG1 THR A 60 3.681 -9.324 -4.012 1.00 0.00 O ATOM 925 CG2 THR A 60 3.554 -6.914 -3.862 1.00 0.00 C ATOM 0 H THR A 60 2.262 -9.606 -6.643 1.00 0.00 H new ATOM 0 HA THR A 60 1.201 -8.315 -4.219 1.00 0.00 H new ATOM 0 HB THR A 60 3.880 -8.053 -5.639 1.00 0.00 H new ATOM 0 HG1 THR A 60 4.626 -9.258 -3.762 1.00 0.00 H new ATOM 0 HG21 THR A 60 4.611 -6.874 -3.598 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.285 -6.015 -4.417 1.00 0.00 H new ATOM 0 HG23 THR A 60 2.955 -6.973 -2.953 1.00 0.00 H new ATOM 933 N VAL A 61 0.451 -6.229 -5.354 1.00 0.00 N ATOM 934 CA VAL A 61 -0.069 -5.027 -6.005 1.00 0.00 C ATOM 935 C VAL A 61 0.159 -3.789 -5.140 1.00 0.00 C ATOM 936 O VAL A 61 0.721 -3.878 -4.044 1.00 0.00 O ATOM 937 CB VAL A 61 -1.579 -5.150 -6.332 1.00 0.00 C ATOM 938 CG1 VAL A 61 -1.816 -6.191 -7.422 1.00 0.00 C ATOM 939 CG2 VAL A 61 -2.386 -5.487 -5.077 1.00 0.00 C ATOM 0 H VAL A 61 0.027 -6.427 -4.448 1.00 0.00 H new ATOM 0 HA VAL A 61 0.480 -4.921 -6.941 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.921 -4.184 -6.704 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.883 -6.259 -7.634 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -1.284 -5.898 -8.327 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.450 -7.161 -7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.442 -5.568 -5.334 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.039 -6.435 -4.665 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.252 -4.699 -4.336 1.00 0.00 H new ATOM 949 N GLU A 62 -0.254 -2.637 -5.661 1.00 0.00 N ATOM 950 CA GLU A 62 -0.139 -1.371 -4.948 1.00 0.00 C ATOM 951 C GLU A 62 -1.124 -1.324 -3.774 1.00 0.00 C ATOM 952 O GLU A 62 -2.331 -1.503 -3.950 1.00 0.00 O ATOM 953 CB GLU A 62 -0.388 -0.201 -5.917 1.00 0.00 C ATOM 954 CG GLU A 62 -1.768 -0.220 -6.569 1.00 0.00 C ATOM 955 CD GLU A 62 -1.907 0.794 -7.692 1.00 0.00 C ATOM 956 OE1 GLU A 62 -2.083 1.997 -7.402 1.00 0.00 O ATOM 957 OE2 GLU A 62 -1.834 0.392 -8.871 1.00 0.00 O ATOM 0 H GLU A 62 -0.676 -2.556 -6.586 1.00 0.00 H new ATOM 0 HA GLU A 62 0.870 -1.282 -4.545 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.265 0.738 -5.377 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.372 -0.221 -6.698 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.965 -1.218 -6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.525 -0.020 -5.811 1.00 0.00 H new ATOM 964 N ALA A 63 -0.599 -1.108 -2.574 1.00 0.00 N ATOM 965 CA ALA A 63 -1.428 -1.005 -1.379 1.00 0.00 C ATOM 966 C ALA A 63 -2.064 0.378 -1.279 1.00 0.00 C ATOM 967 O ALA A 63 -1.379 1.380 -1.048 1.00 0.00 O ATOM 968 CB ALA A 63 -0.609 -1.310 -0.131 1.00 0.00 C ATOM 0 H ALA A 63 0.401 -1.000 -2.402 1.00 0.00 H new ATOM 0 HA ALA A 63 -2.227 -1.742 -1.454 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -1.245 -1.228 0.751 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -0.209 -2.322 -0.197 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.213 -0.599 -0.053 1.00 0.00 H new ATOM 974 N ARG A 64 -3.372 0.419 -1.473 1.00 0.00 N ATOM 975 CA ARG A 64 -4.153 1.641 -1.346 1.00 0.00 C ATOM 976 C ARG A 64 -5.242 1.434 -0.297 1.00 0.00 C ATOM 977 O ARG A 64 -6.218 0.730 -0.544 1.00 0.00 O ATOM 978 CB ARG A 64 -4.776 2.008 -2.702 1.00 0.00 C ATOM 979 CG ARG A 64 -5.670 3.250 -2.680 1.00 0.00 C ATOM 980 CD ARG A 64 -4.876 4.553 -2.626 1.00 0.00 C ATOM 981 NE ARG A 64 -4.047 4.672 -1.421 1.00 0.00 N ATOM 982 CZ ARG A 64 -4.439 5.276 -0.298 1.00 0.00 C ATOM 983 NH1 ARG A 64 -5.665 5.769 -0.195 1.00 0.00 N ATOM 984 NH2 ARG A 64 -3.599 5.379 0.723 1.00 0.00 N ATOM 0 H ARG A 64 -3.926 -0.399 -1.725 1.00 0.00 H new ATOM 0 HA ARG A 64 -3.505 2.460 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -3.975 2.167 -3.424 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.363 1.161 -3.058 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.302 3.252 -3.568 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.333 3.199 -1.817 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -4.238 4.619 -3.507 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -5.567 5.395 -2.669 1.00 0.00 H new ATOM 0 HE ARG A 64 -3.111 4.267 -1.444 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -6.315 5.688 -0.977 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.959 6.230 0.666 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -2.656 4.997 0.648 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -3.896 5.840 1.583 1.00 0.00 H new ATOM 998 N LYS A 65 -5.058 2.013 0.884 1.00 0.00 N ATOM 999 CA LYS A 65 -6.026 1.854 1.968 1.00 0.00 C ATOM 1000 C LYS A 65 -7.173 2.852 1.821 1.00 0.00 C ATOM 1001 O LYS A 65 -7.002 3.933 1.257 1.00 0.00 O ATOM 1002 CB LYS A 65 -5.350 2.043 3.336 1.00 0.00 C ATOM 1003 CG LYS A 65 -6.300 1.828 4.515 1.00 0.00 C ATOM 1004 CD LYS A 65 -5.644 2.135 5.856 1.00 0.00 C ATOM 1005 CE LYS A 65 -6.611 1.909 7.014 1.00 0.00 C ATOM 1006 NZ LYS A 65 -7.819 2.775 6.913 1.00 0.00 N ATOM 0 H LYS A 65 -4.253 2.594 1.117 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.427 0.842 1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.515 1.348 3.420 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -4.934 3.049 3.392 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.178 2.462 4.390 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.649 0.795 4.513 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.765 1.504 5.986 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.298 3.169 5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.916 0.863 7.032 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.100 2.108 7.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.416 2.638 7.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.528 3.772 6.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.358 2.521 6.061 1.00 0.00 H new ATOM 1020 N LEU A 66 -8.345 2.473 2.317 1.00 0.00 N ATOM 1021 CA LEU A 66 -9.496 3.369 2.362 1.00 0.00 C ATOM 1022 C LEU A 66 -9.560 4.042 3.732 1.00 0.00 C ATOM 1023 O LEU A 66 -9.462 3.324 4.751 1.00 0.00 O ATOM 1024 CB LEU A 66 -10.806 2.610 2.078 1.00 0.00 C ATOM 1025 CG LEU A 66 -11.016 2.149 0.623 1.00 0.00 C ATOM 1026 CD1 LEU A 66 -9.932 1.169 0.191 1.00 0.00 C ATOM 1027 CD2 LEU A 66 -12.399 1.524 0.450 1.00 0.00 C ATOM 1028 OXT LEU A 66 -9.707 5.281 3.787 1.00 0.00 O ATOM 0 H LEU A 66 -8.524 1.543 2.697 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.378 4.126 1.587 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.843 1.734 2.725 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.642 3.250 2.360 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.949 3.029 -0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -10.108 0.863 -0.840 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.957 1.650 0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -9.955 0.293 0.839 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.527 1.205 -0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.494 0.662 1.110 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -13.164 2.259 0.701 1.00 0.00 H new TER 1040 LEU A 66