USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 836 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 8:sc= 1.23 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 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.217 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 12 ASN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot -170:sc= -0.0948 USER MOD Single : A 22 ASN : amide:sc= -0.16 X(o=-0.16,f=0) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.212 X(o=-0.21,f=-0.21) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 170:sc= -0.0161 USER MOD Single : A 43 HIS : no HD1:sc= -0.151 X(o=-0.15,f=-0.44) USER MOD Single : A 46 THR OG1 : rot -49:sc= 0.88 USER MOD Single : A 48 SER OG : rot -170:sc= 0.149 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -164:sc= -1.03 (180deg=-1.53) USER MOD Single : A 61 SER OG : rot -82:sc= -0.043 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -153:sc= -0.0325 (180deg=-0.482) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 93 GLN : amide:sc= -0.1 X(o=-0.1,f=-0.54) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.363 2.039 3.264 1.00 0.00 N ATOM 2 CA GLY A 1 3.324 0.617 3.553 1.00 0.00 C ATOM 3 C GLY A 1 3.914 -0.218 2.433 1.00 0.00 C ATOM 4 O GLY A 1 5.117 -0.166 2.178 1.00 0.00 O ATOM 0 H1 GLY A 1 2.949 2.566 4.059 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.349 2.338 3.126 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.819 2.233 2.399 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.871 0.421 4.475 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.292 0.312 3.724 1.00 0.00 H new ATOM 8 N SER A 2 3.065 -0.991 1.764 1.00 0.00 N ATOM 9 CA SER A 2 3.510 -1.846 0.669 1.00 0.00 C ATOM 10 C SER A 2 2.320 -2.359 -0.138 1.00 0.00 C ATOM 11 O SER A 2 1.955 -3.531 -0.049 1.00 0.00 O ATOM 12 CB SER A 2 4.320 -3.025 1.210 1.00 0.00 C ATOM 13 OG SER A 2 5.648 -2.634 1.514 1.00 0.00 O ATOM 0 H SER A 2 2.065 -1.043 1.961 1.00 0.00 H new ATOM 0 HA SER A 2 4.144 -1.251 0.011 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.840 -3.420 2.105 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.334 -3.829 0.474 1.00 0.00 H new ATOM 0 HG SER A 2 5.729 -1.661 1.435 1.00 0.00 H new ATOM 19 N SER A 3 1.720 -1.471 -0.924 1.00 0.00 N ATOM 20 CA SER A 3 0.569 -1.832 -1.744 1.00 0.00 C ATOM 21 C SER A 3 1.016 -2.393 -3.091 1.00 0.00 C ATOM 22 O SER A 3 0.658 -3.511 -3.460 1.00 0.00 O ATOM 23 CB SER A 3 -0.332 -0.615 -1.960 1.00 0.00 C ATOM 24 OG SER A 3 -1.431 -0.628 -1.065 1.00 0.00 O ATOM 0 H SER A 3 2.011 -0.497 -1.010 1.00 0.00 H new ATOM 0 HA SER A 3 0.007 -2.603 -1.217 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.245 0.299 -1.818 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.696 -0.606 -2.987 1.00 0.00 H new ATOM 0 HG SER A 3 -1.990 0.161 -1.222 1.00 0.00 H new ATOM 30 N GLY A 4 1.802 -1.608 -3.821 1.00 0.00 N ATOM 31 CA GLY A 4 2.285 -2.042 -5.118 1.00 0.00 C ATOM 32 C GLY A 4 3.082 -0.967 -5.830 1.00 0.00 C ATOM 33 O GLY A 4 3.850 -0.236 -5.204 1.00 0.00 O ATOM 0 H GLY A 4 2.113 -0.679 -3.537 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.907 -2.928 -4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.438 -2.333 -5.739 1.00 0.00 H new ATOM 37 N SER A 5 2.901 -0.870 -7.143 1.00 0.00 N ATOM 38 CA SER A 5 3.613 0.121 -7.942 1.00 0.00 C ATOM 39 C SER A 5 2.659 1.200 -8.446 1.00 0.00 C ATOM 40 O SER A 5 2.672 1.554 -9.625 1.00 0.00 O ATOM 41 CB SER A 5 4.310 -0.553 -9.126 1.00 0.00 C ATOM 42 OG SER A 5 3.438 -1.454 -9.785 1.00 0.00 O ATOM 0 H SER A 5 2.267 -1.465 -7.676 1.00 0.00 H new ATOM 0 HA SER A 5 4.364 0.592 -7.307 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.654 0.205 -9.829 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.193 -1.087 -8.776 1.00 0.00 H new ATOM 0 HG SER A 5 3.906 -1.870 -10.539 1.00 0.00 H new ATOM 48 N SER A 6 1.834 1.720 -7.543 1.00 0.00 N ATOM 49 CA SER A 6 0.870 2.756 -7.895 1.00 0.00 C ATOM 50 C SER A 6 0.019 2.325 -9.086 1.00 0.00 C ATOM 51 O SER A 6 0.331 2.642 -10.233 1.00 0.00 O ATOM 52 CB SER A 6 1.592 4.065 -8.217 1.00 0.00 C ATOM 53 OG SER A 6 2.396 4.486 -7.128 1.00 0.00 O ATOM 0 H SER A 6 1.814 1.441 -6.562 1.00 0.00 H new ATOM 0 HA SER A 6 0.213 2.912 -7.039 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.214 3.933 -9.102 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.861 4.838 -8.454 1.00 0.00 H new ATOM 0 HG SER A 6 2.848 5.324 -7.360 1.00 0.00 H new ATOM 59 N GLY A 7 -1.058 1.598 -8.803 1.00 0.00 N ATOM 60 CA GLY A 7 -1.938 1.135 -9.860 1.00 0.00 C ATOM 61 C GLY A 7 -1.712 -0.324 -10.204 1.00 0.00 C ATOM 62 O GLY A 7 -0.980 -1.028 -9.508 1.00 0.00 O ATOM 0 H GLY A 7 -1.336 1.322 -7.861 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.975 1.277 -9.554 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.783 1.744 -10.751 1.00 0.00 H new ATOM 66 N LYS A 8 -2.342 -0.781 -11.281 1.00 0.00 N ATOM 67 CA LYS A 8 -2.207 -2.165 -11.718 1.00 0.00 C ATOM 68 C LYS A 8 -1.311 -2.263 -12.949 1.00 0.00 C ATOM 69 O LYS A 8 -0.347 -3.028 -12.967 1.00 0.00 O ATOM 70 CB LYS A 8 -3.583 -2.761 -12.026 1.00 0.00 C ATOM 71 CG LYS A 8 -4.563 -2.658 -10.871 1.00 0.00 C ATOM 72 CD LYS A 8 -5.444 -3.892 -10.775 1.00 0.00 C ATOM 73 CE LYS A 8 -4.874 -4.909 -9.798 1.00 0.00 C ATOM 74 NZ LYS A 8 -5.858 -5.273 -8.741 1.00 0.00 N ATOM 0 H LYS A 8 -2.952 -0.212 -11.868 1.00 0.00 H new ATOM 0 HA LYS A 8 -1.745 -2.731 -10.909 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.003 -2.254 -12.894 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -3.463 -3.810 -12.297 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -4.015 -2.528 -9.938 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.187 -1.774 -11.000 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.445 -3.602 -10.457 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -5.542 -4.348 -11.760 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -4.575 -5.806 -10.340 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -3.975 -4.503 -9.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -5.432 -5.968 -8.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -6.125 -4.421 -8.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -6.705 -5.684 -9.182 1.00 0.00 H new ATOM 88 N TYR A 9 -1.635 -1.483 -13.974 1.00 0.00 N ATOM 89 CA TYR A 9 -0.861 -1.482 -15.209 1.00 0.00 C ATOM 90 C TYR A 9 -0.904 -0.112 -15.879 1.00 0.00 C ATOM 91 O TYR A 9 -1.599 0.795 -15.420 1.00 0.00 O ATOM 92 CB TYR A 9 -1.391 -2.549 -16.168 1.00 0.00 C ATOM 93 CG TYR A 9 -2.890 -2.503 -16.356 1.00 0.00 C ATOM 94 CD1 TYR A 9 -3.473 -1.607 -17.244 1.00 0.00 C ATOM 95 CD2 TYR A 9 -3.725 -3.357 -15.645 1.00 0.00 C ATOM 96 CE1 TYR A 9 -4.842 -1.562 -17.417 1.00 0.00 C ATOM 97 CE2 TYR A 9 -5.096 -3.319 -15.813 1.00 0.00 C ATOM 98 CZ TYR A 9 -5.650 -2.420 -16.700 1.00 0.00 C ATOM 99 OH TYR A 9 -7.014 -2.378 -16.871 1.00 0.00 O ATOM 0 H TYR A 9 -2.429 -0.843 -13.974 1.00 0.00 H new ATOM 0 HA TYR A 9 0.175 -1.710 -14.959 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -0.908 -2.427 -17.137 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -1.110 -3.534 -15.794 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -2.844 -0.934 -17.808 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -3.295 -4.062 -14.949 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.278 -0.858 -18.110 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.730 -3.990 -15.253 1.00 0.00 H new ATOM 0 HH TYR A 9 -7.437 -3.047 -16.293 1.00 0.00 H new ATOM 109 N THR A 10 -0.156 0.031 -16.968 1.00 0.00 N ATOM 110 CA THR A 10 -0.107 1.288 -17.702 1.00 0.00 C ATOM 111 C THR A 10 0.697 1.143 -18.990 1.00 0.00 C ATOM 112 O THR A 10 1.273 0.089 -19.256 1.00 0.00 O ATOM 113 CB THR A 10 0.510 2.413 -16.850 1.00 0.00 C ATOM 114 OG1 THR A 10 1.213 1.853 -15.735 1.00 0.00 O ATOM 115 CG2 THR A 10 -0.566 3.366 -16.350 1.00 0.00 C ATOM 0 H THR A 10 0.425 -0.710 -17.361 1.00 0.00 H new ATOM 0 HA THR A 10 -1.136 1.550 -17.947 1.00 0.00 H new ATOM 0 HB THR A 10 1.206 2.972 -17.475 1.00 0.00 H new ATOM 0 HG1 THR A 10 1.604 2.574 -15.199 1.00 0.00 H new ATOM 0 HG21 THR A 10 -0.106 4.152 -15.751 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.081 3.813 -17.201 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.283 2.817 -15.740 1.00 0.00 H new ATOM 123 N GLN A 11 0.731 2.208 -19.784 1.00 0.00 N ATOM 124 CA GLN A 11 1.465 2.198 -21.043 1.00 0.00 C ATOM 125 C GLN A 11 2.753 3.008 -20.930 1.00 0.00 C ATOM 126 O GLN A 11 2.725 4.238 -20.932 1.00 0.00 O ATOM 127 CB GLN A 11 0.595 2.756 -22.170 1.00 0.00 C ATOM 128 CG GLN A 11 -0.440 1.769 -22.686 1.00 0.00 C ATOM 129 CD GLN A 11 -1.851 2.321 -22.634 1.00 0.00 C ATOM 130 OE1 GLN A 11 -2.113 3.431 -23.097 1.00 0.00 O ATOM 131 NE2 GLN A 11 -2.769 1.546 -22.068 1.00 0.00 N ATOM 0 H GLN A 11 0.259 3.088 -19.578 1.00 0.00 H new ATOM 0 HA GLN A 11 1.726 1.165 -21.273 1.00 0.00 H new ATOM 0 HB2 GLN A 11 0.085 3.652 -21.815 1.00 0.00 H new ATOM 0 HB3 GLN A 11 1.237 3.061 -22.996 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -0.198 1.499 -23.714 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -0.390 0.854 -22.095 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -2.507 0.633 -21.697 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -3.736 1.864 -22.004 1.00 0.00 H new ATOM 140 N ASN A 12 3.879 2.309 -20.832 1.00 0.00 N ATOM 141 CA ASN A 12 5.177 2.964 -20.717 1.00 0.00 C ATOM 142 C ASN A 12 6.197 2.319 -21.651 1.00 0.00 C ATOM 143 O ASN A 12 5.929 1.283 -22.258 1.00 0.00 O ATOM 144 CB ASN A 12 5.678 2.900 -19.273 1.00 0.00 C ATOM 145 CG ASN A 12 5.464 4.203 -18.528 1.00 0.00 C ATOM 146 OD1 ASN A 12 6.419 4.843 -18.088 1.00 0.00 O ATOM 147 ND2 ASN A 12 4.205 4.601 -18.383 1.00 0.00 N ATOM 0 H ASN A 12 3.919 1.290 -20.830 1.00 0.00 H new ATOM 0 HA ASN A 12 5.056 4.008 -21.006 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.163 2.096 -18.748 1.00 0.00 H new ATOM 0 HB3 ASN A 12 6.740 2.653 -19.270 1.00 0.00 H new ATOM 0 HD21 ASN A 12 3.998 5.470 -17.890 1.00 0.00 H new ATOM 0 HD22 ASN A 12 3.445 4.038 -18.765 1.00 0.00 H new ATOM 154 N ASN A 13 7.367 2.938 -21.758 1.00 0.00 N ATOM 155 CA ASN A 13 8.428 2.424 -22.618 1.00 0.00 C ATOM 156 C ASN A 13 9.129 1.237 -21.965 1.00 0.00 C ATOM 157 O ASN A 13 9.650 0.356 -22.650 1.00 0.00 O ATOM 158 CB ASN A 13 9.445 3.526 -22.923 1.00 0.00 C ATOM 159 CG ASN A 13 9.677 3.702 -24.411 1.00 0.00 C ATOM 160 OD1 ASN A 13 9.015 4.511 -25.063 1.00 0.00 O ATOM 161 ND2 ASN A 13 10.620 2.943 -24.956 1.00 0.00 N ATOM 0 H ASN A 13 7.606 3.796 -21.261 1.00 0.00 H new ATOM 0 HA ASN A 13 7.975 2.088 -23.551 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.095 4.467 -22.499 1.00 0.00 H new ATOM 0 HB3 ASN A 13 10.391 3.289 -22.436 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.821 3.017 -25.953 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.144 2.286 -24.377 1.00 0.00 H new ATOM 168 N PHE A 14 9.138 1.219 -20.636 1.00 0.00 N ATOM 169 CA PHE A 14 9.775 0.141 -19.890 1.00 0.00 C ATOM 170 C PHE A 14 8.731 -0.755 -19.230 1.00 0.00 C ATOM 171 O PHE A 14 7.546 -0.424 -19.197 1.00 0.00 O ATOM 172 CB PHE A 14 10.717 0.713 -18.828 1.00 0.00 C ATOM 173 CG PHE A 14 11.659 1.755 -19.361 1.00 0.00 C ATOM 174 CD1 PHE A 14 12.481 1.477 -20.442 1.00 0.00 C ATOM 175 CD2 PHE A 14 11.723 3.011 -18.781 1.00 0.00 C ATOM 176 CE1 PHE A 14 13.348 2.433 -20.935 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.588 3.972 -19.270 1.00 0.00 C ATOM 178 CZ PHE A 14 13.403 3.682 -20.348 1.00 0.00 C ATOM 0 H PHE A 14 8.711 1.939 -20.054 1.00 0.00 H new ATOM 0 HA PHE A 14 10.353 -0.460 -20.592 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.124 1.148 -18.024 1.00 0.00 H new ATOM 0 HB3 PHE A 14 11.297 -0.100 -18.392 1.00 0.00 H new ATOM 0 HD1 PHE A 14 12.443 0.502 -20.904 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.090 3.242 -17.937 1.00 0.00 H new ATOM 0 HE1 PHE A 14 13.982 2.204 -21.779 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.627 4.948 -18.810 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.081 4.430 -20.730 1.00 0.00 H new ATOM 188 N ILE A 15 9.180 -1.891 -18.707 1.00 0.00 N ATOM 189 CA ILE A 15 8.286 -2.834 -18.048 1.00 0.00 C ATOM 190 C ILE A 15 8.701 -3.065 -16.599 1.00 0.00 C ATOM 191 O ILE A 15 9.884 -3.225 -16.298 1.00 0.00 O ATOM 192 CB ILE A 15 8.254 -4.187 -18.783 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.274 -5.142 -18.097 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.647 -4.796 -18.833 1.00 0.00 C ATOM 195 CD1 ILE A 15 7.066 -6.438 -18.849 1.00 0.00 C ATOM 0 H ILE A 15 10.158 -2.180 -18.727 1.00 0.00 H new ATOM 0 HA ILE A 15 7.289 -2.393 -18.072 1.00 0.00 H new ATOM 0 HB ILE A 15 7.915 -4.020 -19.805 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.640 -5.367 -17.095 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.313 -4.641 -17.980 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.608 -5.752 -19.356 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.320 -4.121 -19.361 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.012 -4.952 -17.818 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.360 -7.065 -18.305 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.670 -6.223 -19.842 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.018 -6.961 -18.943 1.00 0.00 H new ATOM 207 N THR A 16 7.719 -3.083 -15.703 1.00 0.00 N ATOM 208 CA THR A 16 7.981 -3.295 -14.285 1.00 0.00 C ATOM 209 C THR A 16 8.649 -4.644 -14.045 1.00 0.00 C ATOM 210 O THR A 16 8.449 -5.591 -14.806 1.00 0.00 O ATOM 211 CB THR A 16 6.685 -3.222 -13.457 1.00 0.00 C ATOM 212 OG1 THR A 16 5.600 -2.783 -14.282 1.00 0.00 O ATOM 213 CG2 THR A 16 6.848 -2.272 -12.279 1.00 0.00 C ATOM 0 H THR A 16 6.734 -2.953 -15.935 1.00 0.00 H new ATOM 0 HA THR A 16 8.653 -2.498 -13.965 1.00 0.00 H new ATOM 0 HB THR A 16 6.469 -4.219 -13.073 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.821 -2.588 -13.721 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.920 -2.237 -11.709 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.655 -2.624 -11.637 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.086 -1.274 -12.647 1.00 0.00 H new ATOM 221 N GLY A 17 9.442 -4.726 -12.982 1.00 0.00 N ATOM 222 CA GLY A 17 10.127 -5.965 -12.661 1.00 0.00 C ATOM 223 C GLY A 17 9.167 -7.117 -12.439 1.00 0.00 C ATOM 224 O GLY A 17 9.123 -8.059 -13.230 1.00 0.00 O ATOM 0 H GLY A 17 9.623 -3.957 -12.337 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.812 -6.218 -13.470 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.731 -5.821 -11.765 1.00 0.00 H new ATOM 228 N VAL A 18 8.396 -7.044 -11.359 1.00 0.00 N ATOM 229 CA VAL A 18 7.432 -8.089 -11.035 1.00 0.00 C ATOM 230 C VAL A 18 6.524 -8.386 -12.223 1.00 0.00 C ATOM 231 O VAL A 18 6.048 -9.510 -12.387 1.00 0.00 O ATOM 232 CB VAL A 18 6.564 -7.696 -9.825 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.730 -6.464 -10.143 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.675 -8.858 -9.408 1.00 0.00 C ATOM 0 H VAL A 18 8.420 -6.272 -10.693 1.00 0.00 H new ATOM 0 HA VAL A 18 8.005 -8.983 -10.787 1.00 0.00 H new ATOM 0 HB VAL A 18 7.223 -7.454 -8.991 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.123 -6.202 -9.276 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.389 -5.632 -10.390 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.079 -6.675 -10.991 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.068 -8.563 -8.552 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.023 -9.133 -10.237 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.296 -9.712 -9.136 1.00 0.00 H new ATOM 244 N ARG A 19 6.288 -7.373 -13.049 1.00 0.00 N ATOM 245 CA ARG A 19 5.436 -7.525 -14.222 1.00 0.00 C ATOM 246 C ARG A 19 6.065 -8.483 -15.230 1.00 0.00 C ATOM 247 O ARG A 19 5.371 -9.279 -15.861 1.00 0.00 O ATOM 248 CB ARG A 19 5.189 -6.166 -14.880 1.00 0.00 C ATOM 249 CG ARG A 19 3.861 -5.535 -14.494 1.00 0.00 C ATOM 250 CD ARG A 19 2.713 -6.110 -15.309 1.00 0.00 C ATOM 251 NE ARG A 19 1.749 -6.820 -14.473 1.00 0.00 N ATOM 252 CZ ARG A 19 0.869 -7.695 -14.948 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.832 -7.966 -16.245 1.00 0.00 N ATOM 254 NH2 ARG A 19 0.024 -8.301 -14.123 1.00 0.00 N ATOM 0 H ARG A 19 6.675 -6.437 -12.928 1.00 0.00 H new ATOM 0 HA ARG A 19 4.483 -7.941 -13.896 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.997 -5.487 -14.607 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.224 -6.284 -15.963 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.674 -5.700 -13.433 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.912 -4.457 -14.645 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.207 -5.304 -15.841 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.109 -6.790 -16.063 1.00 0.00 H new ATOM 0 HE ARG A 19 1.751 -6.634 -13.470 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.480 -7.502 -16.882 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.155 -8.638 -16.606 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.050 -8.095 -13.124 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -0.651 -8.973 -14.488 1.00 0.00 H new ATOM 268 N ALA A 20 7.383 -8.398 -15.376 1.00 0.00 N ATOM 269 CA ALA A 20 8.106 -9.257 -16.306 1.00 0.00 C ATOM 270 C ALA A 20 8.335 -10.641 -15.709 1.00 0.00 C ATOM 271 O ALA A 20 8.435 -11.631 -16.434 1.00 0.00 O ATOM 272 CB ALA A 20 9.433 -8.620 -16.690 1.00 0.00 C ATOM 0 H ALA A 20 7.972 -7.743 -14.862 1.00 0.00 H new ATOM 0 HA ALA A 20 7.498 -9.373 -17.203 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.962 -9.272 -17.385 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.250 -7.656 -17.165 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.039 -8.475 -15.796 1.00 0.00 H new ATOM 278 N ILE A 21 8.417 -10.703 -14.384 1.00 0.00 N ATOM 279 CA ILE A 21 8.633 -11.967 -13.691 1.00 0.00 C ATOM 280 C ILE A 21 7.393 -12.851 -13.759 1.00 0.00 C ATOM 281 O ILE A 21 7.484 -14.074 -13.668 1.00 0.00 O ATOM 282 CB ILE A 21 9.009 -11.742 -12.214 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.265 -10.875 -12.111 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.220 -13.075 -11.512 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.482 -10.286 -10.735 1.00 0.00 C ATOM 0 H ILE A 21 8.337 -9.893 -13.769 1.00 0.00 H new ATOM 0 HA ILE A 21 9.460 -12.466 -14.196 1.00 0.00 H new ATOM 0 HB ILE A 21 8.189 -11.220 -11.721 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.134 -11.475 -12.382 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.198 -10.065 -12.837 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.485 -12.899 -10.469 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.302 -13.660 -11.559 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.025 -13.622 -12.004 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.390 -9.684 -10.736 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.631 -9.659 -10.469 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.581 -11.091 -10.006 1.00 0.00 H new ATOM 297 N ASN A 22 6.233 -12.223 -13.922 1.00 0.00 N ATOM 298 CA ASN A 22 4.973 -12.952 -14.005 1.00 0.00 C ATOM 299 C ASN A 22 4.633 -13.288 -15.453 1.00 0.00 C ATOM 300 O ASN A 22 3.962 -14.283 -15.729 1.00 0.00 O ATOM 301 CB ASN A 22 3.843 -12.132 -13.380 1.00 0.00 C ATOM 302 CG ASN A 22 3.656 -12.433 -11.906 1.00 0.00 C ATOM 303 OD1 ASN A 22 3.198 -13.514 -11.535 1.00 0.00 O ATOM 304 ND2 ASN A 22 4.011 -11.476 -11.057 1.00 0.00 N ATOM 0 H ASN A 22 6.140 -11.210 -13.999 1.00 0.00 H new ATOM 0 HA ASN A 22 5.084 -13.884 -13.452 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.055 -11.070 -13.507 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.913 -12.337 -13.910 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.908 -11.621 -10.053 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.386 -10.595 -11.409 1.00 0.00 H new ATOM 311 N GLU A 23 5.100 -12.451 -16.375 1.00 0.00 N ATOM 312 CA GLU A 23 4.844 -12.660 -17.795 1.00 0.00 C ATOM 313 C GLU A 23 5.886 -13.594 -18.404 1.00 0.00 C ATOM 314 O GLU A 23 5.553 -14.660 -18.922 1.00 0.00 O ATOM 315 CB GLU A 23 4.846 -11.322 -18.538 1.00 0.00 C ATOM 316 CG GLU A 23 3.532 -10.567 -18.436 1.00 0.00 C ATOM 317 CD GLU A 23 3.243 -9.729 -19.666 1.00 0.00 C ATOM 318 OE1 GLU A 23 3.536 -10.197 -20.786 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.723 -8.605 -19.508 1.00 0.00 O ATOM 0 H GLU A 23 5.657 -11.623 -16.164 1.00 0.00 H new ATOM 0 HA GLU A 23 3.863 -13.123 -17.897 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.646 -10.697 -18.141 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.072 -11.500 -19.589 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.720 -11.278 -18.286 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.556 -9.921 -17.558 1.00 0.00 H new ATOM 326 N PHE A 24 7.149 -13.185 -18.338 1.00 0.00 N ATOM 327 CA PHE A 24 8.240 -13.984 -18.884 1.00 0.00 C ATOM 328 C PHE A 24 8.520 -15.198 -18.003 1.00 0.00 C ATOM 329 O PHE A 24 9.183 -16.145 -18.425 1.00 0.00 O ATOM 330 CB PHE A 24 9.505 -13.134 -19.017 1.00 0.00 C ATOM 331 CG PHE A 24 9.363 -11.994 -19.985 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.842 -10.779 -19.573 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.750 -12.139 -21.308 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.710 -9.728 -20.461 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.620 -11.092 -22.201 1.00 0.00 C ATOM 336 CZ PHE A 24 9.099 -9.885 -21.777 1.00 0.00 C ATOM 0 H PHE A 24 7.442 -12.306 -17.912 1.00 0.00 H new ATOM 0 HA PHE A 24 7.941 -14.336 -19.871 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.771 -12.737 -18.037 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.329 -13.771 -19.337 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.535 -10.651 -18.545 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.158 -13.081 -21.645 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.303 -8.785 -20.126 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.925 -11.218 -23.229 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.996 -9.066 -22.473 1.00 0.00 H new ATOM 346 N CYS A 25 8.009 -15.161 -16.777 1.00 0.00 N ATOM 347 CA CYS A 25 8.204 -16.257 -15.834 1.00 0.00 C ATOM 348 C CYS A 25 9.682 -16.427 -15.496 1.00 0.00 C ATOM 349 O CYS A 25 10.233 -17.523 -15.607 1.00 0.00 O ATOM 350 CB CYS A 25 7.648 -17.559 -16.411 1.00 0.00 C ATOM 351 SG CYS A 25 6.966 -18.684 -15.171 1.00 0.00 S ATOM 0 H CYS A 25 7.457 -14.384 -16.413 1.00 0.00 H new ATOM 0 HA CYS A 25 7.666 -16.015 -14.918 1.00 0.00 H new ATOM 0 HB2 CYS A 25 6.870 -17.320 -17.136 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.442 -18.072 -16.954 1.00 0.00 H new ATOM 0 HG CYS A 25 6.519 -19.755 -15.756 1.00 0.00 H new ATOM 357 N LEU A 26 10.319 -15.335 -15.087 1.00 0.00 N ATOM 358 CA LEU A 26 11.734 -15.363 -14.734 1.00 0.00 C ATOM 359 C LEU A 26 11.918 -15.434 -13.222 1.00 0.00 C ATOM 360 O LEU A 26 10.951 -15.585 -12.474 1.00 0.00 O ATOM 361 CB LEU A 26 12.442 -14.124 -15.288 1.00 0.00 C ATOM 362 CG LEU A 26 12.156 -13.786 -16.751 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.440 -12.317 -17.024 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.980 -14.671 -17.674 1.00 0.00 C ATOM 0 H LEU A 26 9.878 -14.420 -14.992 1.00 0.00 H new ATOM 0 HA LEU A 26 12.176 -16.256 -15.177 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.162 -13.266 -14.676 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.517 -14.262 -15.171 1.00 0.00 H new ATOM 0 HG LEU A 26 11.101 -13.974 -16.948 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.231 -12.094 -18.070 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.806 -11.699 -16.388 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.487 -12.103 -16.810 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.763 -14.416 -18.711 1.00 0.00 H new ATOM 0 HD22 LEU A 26 14.041 -14.515 -17.476 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.727 -15.716 -17.497 1.00 0.00 H new ATOM 376 N LYS A 27 13.164 -15.321 -12.776 1.00 0.00 N ATOM 377 CA LYS A 27 13.476 -15.369 -11.352 1.00 0.00 C ATOM 378 C LYS A 27 13.820 -13.980 -10.824 1.00 0.00 C ATOM 379 O LYS A 27 13.968 -13.031 -11.594 1.00 0.00 O ATOM 380 CB LYS A 27 14.641 -16.327 -11.096 1.00 0.00 C ATOM 381 CG LYS A 27 14.297 -17.784 -11.351 1.00 0.00 C ATOM 382 CD LYS A 27 14.722 -18.222 -12.743 1.00 0.00 C ATOM 383 CE LYS A 27 16.126 -18.808 -12.739 1.00 0.00 C ATOM 384 NZ LYS A 27 16.137 -20.225 -13.195 1.00 0.00 N ATOM 0 H LYS A 27 13.976 -15.195 -13.381 1.00 0.00 H new ATOM 0 HA LYS A 27 12.594 -15.731 -10.824 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.480 -16.044 -11.732 1.00 0.00 H new ATOM 0 HB3 LYS A 27 14.972 -16.216 -10.063 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.787 -18.410 -10.606 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.223 -17.931 -11.234 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.019 -18.963 -13.123 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.684 -17.369 -13.421 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.770 -18.213 -13.387 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.542 -18.747 -11.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.112 -20.588 -13.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.543 -20.798 -12.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.764 -20.281 -14.164 1.00 0.00 H new ATOM 398 N SER A 28 13.948 -13.868 -9.506 1.00 0.00 N ATOM 399 CA SER A 28 14.274 -12.594 -8.875 1.00 0.00 C ATOM 400 C SER A 28 15.675 -12.136 -9.266 1.00 0.00 C ATOM 401 O SER A 28 15.869 -11.003 -9.706 1.00 0.00 O ATOM 402 CB SER A 28 14.171 -12.714 -7.353 1.00 0.00 C ATOM 403 OG SER A 28 13.001 -12.077 -6.869 1.00 0.00 O ATOM 0 H SER A 28 13.831 -14.644 -8.854 1.00 0.00 H new ATOM 0 HA SER A 28 13.557 -11.850 -9.224 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.160 -13.766 -7.068 1.00 0.00 H new ATOM 0 HB3 SER A 28 15.050 -12.267 -6.889 1.00 0.00 H new ATOM 0 HG SER A 28 12.958 -12.169 -5.894 1.00 0.00 H new ATOM 409 N SER A 29 16.649 -13.026 -9.103 1.00 0.00 N ATOM 410 CA SER A 29 18.034 -12.713 -9.435 1.00 0.00 C ATOM 411 C SER A 29 18.198 -12.501 -10.937 1.00 0.00 C ATOM 412 O SER A 29 19.095 -11.784 -11.380 1.00 0.00 O ATOM 413 CB SER A 29 18.960 -13.835 -8.963 1.00 0.00 C ATOM 414 OG SER A 29 18.807 -14.073 -7.574 1.00 0.00 O ATOM 0 H SER A 29 16.504 -13.969 -8.743 1.00 0.00 H new ATOM 0 HA SER A 29 18.304 -11.789 -8.923 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.742 -14.748 -9.518 1.00 0.00 H new ATOM 0 HB3 SER A 29 19.995 -13.571 -9.178 1.00 0.00 H new ATOM 0 HG SER A 29 19.409 -14.796 -7.298 1.00 0.00 H new ATOM 420 N ASP A 30 17.324 -13.130 -11.715 1.00 0.00 N ATOM 421 CA ASP A 30 17.370 -13.011 -13.168 1.00 0.00 C ATOM 422 C ASP A 30 17.179 -11.560 -13.600 1.00 0.00 C ATOM 423 O ASP A 30 18.047 -10.976 -14.250 1.00 0.00 O ATOM 424 CB ASP A 30 16.295 -13.892 -13.807 1.00 0.00 C ATOM 425 CG ASP A 30 16.677 -15.359 -13.812 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.477 -15.766 -12.945 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.177 -16.099 -14.685 1.00 0.00 O ATOM 0 H ASP A 30 16.575 -13.727 -11.364 1.00 0.00 H new ATOM 0 HA ASP A 30 18.351 -13.346 -13.505 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.357 -13.766 -13.266 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.120 -13.562 -14.831 1.00 0.00 H new ATOM 432 N LEU A 31 16.039 -10.985 -13.236 1.00 0.00 N ATOM 433 CA LEU A 31 15.733 -9.602 -13.587 1.00 0.00 C ATOM 434 C LEU A 31 16.871 -8.672 -13.178 1.00 0.00 C ATOM 435 O LEU A 31 17.349 -7.871 -13.980 1.00 0.00 O ATOM 436 CB LEU A 31 14.432 -9.160 -12.916 1.00 0.00 C ATOM 437 CG LEU A 31 13.145 -9.452 -13.689 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.053 -8.571 -14.925 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.076 -10.923 -14.074 1.00 0.00 C ATOM 0 H LEU A 31 15.311 -11.454 -12.698 1.00 0.00 H new ATOM 0 HA LEU A 31 15.613 -9.546 -14.669 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.366 -9.646 -11.942 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.487 -8.087 -12.734 1.00 0.00 H new ATOM 0 HG LEU A 31 12.297 -9.226 -13.043 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.131 -8.793 -15.462 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.055 -7.523 -14.626 1.00 0.00 H new ATOM 0 HD13 LEU A 31 13.907 -8.765 -15.574 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.154 -11.112 -14.623 1.00 0.00 H new ATOM 0 HD22 LEU A 31 13.931 -11.175 -14.702 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.094 -11.536 -13.173 1.00 0.00 H new ATOM 451 N GLU A 32 17.301 -8.787 -11.925 1.00 0.00 N ATOM 452 CA GLU A 32 18.384 -7.958 -11.411 1.00 0.00 C ATOM 453 C GLU A 32 19.614 -8.051 -12.309 1.00 0.00 C ATOM 454 O GLU A 32 20.359 -7.083 -12.460 1.00 0.00 O ATOM 455 CB GLU A 32 18.746 -8.379 -9.985 1.00 0.00 C ATOM 456 CG GLU A 32 17.572 -8.338 -9.022 1.00 0.00 C ATOM 457 CD GLU A 32 17.393 -6.977 -8.377 1.00 0.00 C ATOM 458 OE1 GLU A 32 17.009 -6.029 -9.093 1.00 0.00 O ATOM 459 OE2 GLU A 32 17.637 -6.861 -7.158 1.00 0.00 O ATOM 0 H GLU A 32 16.916 -9.446 -11.248 1.00 0.00 H new ATOM 0 HA GLU A 32 18.041 -6.923 -11.400 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.153 -9.390 -10.006 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.535 -7.726 -9.611 1.00 0.00 H new ATOM 0 HG2 GLU A 32 16.660 -8.606 -9.555 1.00 0.00 H new ATOM 0 HG3 GLU A 32 17.718 -9.088 -8.245 1.00 0.00 H new ATOM 466 N GLN A 33 19.821 -9.223 -12.900 1.00 0.00 N ATOM 467 CA GLN A 33 20.961 -9.443 -13.781 1.00 0.00 C ATOM 468 C GLN A 33 20.918 -8.494 -14.974 1.00 0.00 C ATOM 469 O GLN A 33 21.958 -8.078 -15.488 1.00 0.00 O ATOM 470 CB GLN A 33 20.984 -10.893 -14.268 1.00 0.00 C ATOM 471 CG GLN A 33 22.381 -11.416 -14.558 1.00 0.00 C ATOM 472 CD GLN A 33 23.242 -11.502 -13.312 1.00 0.00 C ATOM 473 OE1 GLN A 33 24.209 -10.755 -13.160 1.00 0.00 O ATOM 474 NE2 GLN A 33 22.894 -12.415 -12.414 1.00 0.00 N ATOM 0 H GLN A 33 19.214 -10.035 -12.785 1.00 0.00 H new ATOM 0 HA GLN A 33 21.870 -9.243 -13.214 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.517 -11.528 -13.515 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.380 -10.973 -15.172 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.308 -12.404 -15.014 1.00 0.00 H new ATOM 0 HG3 GLN A 33 22.865 -10.764 -15.285 1.00 0.00 H new ATOM 0 HE21 GLN A 33 22.085 -13.013 -12.582 1.00 0.00 H new ATOM 0 HE22 GLN A 33 23.436 -12.519 -11.556 1.00 0.00 H new ATOM 483 N LEU A 34 19.711 -8.156 -15.412 1.00 0.00 N ATOM 484 CA LEU A 34 19.532 -7.256 -16.546 1.00 0.00 C ATOM 485 C LEU A 34 19.978 -5.840 -16.193 1.00 0.00 C ATOM 486 O LEU A 34 20.506 -5.598 -15.107 1.00 0.00 O ATOM 487 CB LEU A 34 18.068 -7.246 -16.988 1.00 0.00 C ATOM 488 CG LEU A 34 17.491 -8.592 -17.429 1.00 0.00 C ATOM 489 CD1 LEU A 34 15.982 -8.615 -17.234 1.00 0.00 C ATOM 490 CD2 LEU A 34 17.848 -8.876 -18.880 1.00 0.00 C ATOM 0 H LEU A 34 18.841 -8.492 -14.999 1.00 0.00 H new ATOM 0 HA LEU A 34 20.151 -7.618 -17.367 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.463 -6.866 -16.164 1.00 0.00 H new ATOM 0 HB3 LEU A 34 17.963 -6.541 -17.812 1.00 0.00 H new ATOM 0 HG LEU A 34 17.929 -9.374 -16.809 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.589 -9.580 -17.553 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.749 -8.458 -16.181 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.526 -7.823 -17.828 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.429 -9.838 -19.176 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.439 -8.091 -19.516 1.00 0.00 H new ATOM 0 HD23 LEU A 34 18.932 -8.903 -18.989 1.00 0.00 H new ATOM 502 N ARG A 35 19.759 -4.909 -17.115 1.00 0.00 N ATOM 503 CA ARG A 35 20.137 -3.518 -16.901 1.00 0.00 C ATOM 504 C ARG A 35 19.188 -2.841 -15.917 1.00 0.00 C ATOM 505 O ARG A 35 18.029 -2.576 -16.238 1.00 0.00 O ATOM 506 CB ARG A 35 20.140 -2.758 -18.229 1.00 0.00 C ATOM 507 CG ARG A 35 21.078 -1.562 -18.244 1.00 0.00 C ATOM 508 CD ARG A 35 21.315 -1.058 -19.659 1.00 0.00 C ATOM 509 NE ARG A 35 22.013 0.224 -19.674 1.00 0.00 N ATOM 510 CZ ARG A 35 22.224 0.934 -20.777 1.00 0.00 C ATOM 511 NH1 ARG A 35 21.793 0.488 -21.949 1.00 0.00 N ATOM 512 NH2 ARG A 35 22.868 2.092 -20.710 1.00 0.00 N ATOM 0 H ARG A 35 19.321 -5.093 -18.018 1.00 0.00 H new ATOM 0 HA ARG A 35 21.142 -3.502 -16.479 1.00 0.00 H new ATOM 0 HB2 ARG A 35 20.424 -3.442 -19.029 1.00 0.00 H new ATOM 0 HB3 ARG A 35 19.127 -2.418 -18.445 1.00 0.00 H new ATOM 0 HG2 ARG A 35 20.657 -0.761 -17.637 1.00 0.00 H new ATOM 0 HG3 ARG A 35 22.030 -1.839 -17.791 1.00 0.00 H new ATOM 0 HD2 ARG A 35 21.897 -1.794 -20.213 1.00 0.00 H new ATOM 0 HD3 ARG A 35 20.359 -0.956 -20.172 1.00 0.00 H new ATOM 0 HE ARG A 35 22.358 0.595 -18.789 1.00 0.00 H new ATOM 0 HH11 ARG A 35 21.298 -0.402 -22.005 1.00 0.00 H new ATOM 0 HH12 ARG A 35 21.956 1.035 -22.794 1.00 0.00 H new ATOM 0 HH21 ARG A 35 23.202 2.439 -19.811 1.00 0.00 H new ATOM 0 HH22 ARG A 35 23.029 2.636 -21.558 1.00 0.00 H new ATOM 526 N LYS A 36 19.686 -2.565 -14.717 1.00 0.00 N ATOM 527 CA LYS A 36 18.883 -1.920 -13.685 1.00 0.00 C ATOM 528 C LYS A 36 18.599 -0.465 -14.047 1.00 0.00 C ATOM 529 O LYS A 36 19.444 0.409 -13.852 1.00 0.00 O ATOM 530 CB LYS A 36 19.600 -1.989 -12.334 1.00 0.00 C ATOM 531 CG LYS A 36 19.861 -3.407 -11.856 1.00 0.00 C ATOM 532 CD LYS A 36 19.485 -3.580 -10.394 1.00 0.00 C ATOM 533 CE LYS A 36 20.562 -4.334 -9.628 1.00 0.00 C ATOM 534 NZ LYS A 36 20.435 -4.139 -8.157 1.00 0.00 N ATOM 0 H LYS A 36 20.643 -2.778 -14.435 1.00 0.00 H new ATOM 0 HA LYS A 36 17.934 -2.451 -13.614 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.550 -1.459 -12.409 1.00 0.00 H new ATOM 0 HB3 LYS A 36 19.001 -1.467 -11.587 1.00 0.00 H new ATOM 0 HG2 LYS A 36 19.290 -4.108 -12.465 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.915 -3.650 -11.993 1.00 0.00 H new ATOM 0 HD2 LYS A 36 19.330 -2.602 -9.939 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.540 -4.119 -10.321 1.00 0.00 H new ATOM 0 HE2 LYS A 36 20.497 -5.397 -9.861 1.00 0.00 H new ATOM 0 HE3 LYS A 36 21.545 -3.996 -9.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 21.186 -4.668 -7.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.523 -3.127 -7.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 19.507 -4.485 -7.840 1.00 0.00 H new ATOM 548 N ILE A 37 17.405 -0.214 -14.574 1.00 0.00 N ATOM 549 CA ILE A 37 17.010 1.135 -14.960 1.00 0.00 C ATOM 550 C ILE A 37 16.713 1.993 -13.735 1.00 0.00 C ATOM 551 O ILE A 37 15.713 1.786 -13.047 1.00 0.00 O ATOM 552 CB ILE A 37 15.770 1.118 -15.874 1.00 0.00 C ATOM 553 CG1 ILE A 37 15.979 0.144 -17.036 1.00 0.00 C ATOM 554 CG2 ILE A 37 15.476 2.517 -16.394 1.00 0.00 C ATOM 555 CD1 ILE A 37 17.189 0.467 -17.884 1.00 0.00 C ATOM 0 H ILE A 37 16.695 -0.927 -14.743 1.00 0.00 H new ATOM 0 HA ILE A 37 17.849 1.565 -15.507 1.00 0.00 H new ATOM 0 HB ILE A 37 14.912 0.781 -15.292 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.083 -0.866 -16.639 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.091 0.149 -17.668 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.597 2.488 -17.038 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.288 3.186 -15.554 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.331 2.881 -16.963 1.00 0.00 H new ATOM 0 HD11 ILE A 37 17.275 -0.264 -18.688 1.00 0.00 H new ATOM 0 HD12 ILE A 37 17.079 1.464 -18.310 1.00 0.00 H new ATOM 0 HD13 ILE A 37 18.086 0.434 -17.266 1.00 0.00 H new ATOM 567 N ARG A 38 17.588 2.957 -13.469 1.00 0.00 N ATOM 568 CA ARG A 38 17.420 3.848 -12.327 1.00 0.00 C ATOM 569 C ARG A 38 16.349 4.898 -12.610 1.00 0.00 C ATOM 570 O ARG A 38 16.649 5.993 -13.085 1.00 0.00 O ATOM 571 CB ARG A 38 18.745 4.534 -11.989 1.00 0.00 C ATOM 572 CG ARG A 38 18.835 5.007 -10.548 1.00 0.00 C ATOM 573 CD ARG A 38 20.233 4.811 -9.983 1.00 0.00 C ATOM 574 NE ARG A 38 20.239 4.814 -8.523 1.00 0.00 N ATOM 575 CZ ARG A 38 20.104 5.914 -7.790 1.00 0.00 C ATOM 576 NH1 ARG A 38 19.952 7.092 -8.378 1.00 0.00 N ATOM 577 NH2 ARG A 38 20.119 5.836 -6.465 1.00 0.00 N ATOM 0 H ARG A 38 18.421 3.141 -14.029 1.00 0.00 H new ATOM 0 HA ARG A 38 17.101 3.249 -11.474 1.00 0.00 H new ATOM 0 HB2 ARG A 38 19.564 3.842 -12.187 1.00 0.00 H new ATOM 0 HB3 ARG A 38 18.882 5.388 -12.652 1.00 0.00 H new ATOM 0 HG2 ARG A 38 18.564 6.061 -10.492 1.00 0.00 H new ATOM 0 HG3 ARG A 38 18.115 4.460 -9.939 1.00 0.00 H new ATOM 0 HD2 ARG A 38 20.641 3.867 -10.345 1.00 0.00 H new ATOM 0 HD3 ARG A 38 20.886 5.603 -10.350 1.00 0.00 H new ATOM 0 HE ARG A 38 20.353 3.923 -8.039 1.00 0.00 H new ATOM 0 HH11 ARG A 38 19.938 7.156 -9.396 1.00 0.00 H new ATOM 0 HH12 ARG A 38 19.849 7.935 -7.813 1.00 0.00 H new ATOM 0 HH21 ARG A 38 20.234 4.931 -6.009 1.00 0.00 H new ATOM 0 HH22 ARG A 38 20.015 6.681 -5.903 1.00 0.00 H new ATOM 591 N ARG A 39 15.099 4.554 -12.315 1.00 0.00 N ATOM 592 CA ARG A 39 13.984 5.466 -12.539 1.00 0.00 C ATOM 593 C ARG A 39 13.783 6.385 -11.338 1.00 0.00 C ATOM 594 O ARG A 39 13.896 7.606 -11.452 1.00 0.00 O ATOM 595 CB ARG A 39 12.701 4.678 -12.811 1.00 0.00 C ATOM 596 CG ARG A 39 12.415 4.472 -14.290 1.00 0.00 C ATOM 597 CD ARG A 39 11.877 5.740 -14.935 1.00 0.00 C ATOM 598 NE ARG A 39 12.872 6.384 -15.788 1.00 0.00 N ATOM 599 CZ ARG A 39 12.579 7.328 -16.676 1.00 0.00 C ATOM 600 NH1 ARG A 39 11.326 7.735 -16.826 1.00 0.00 N ATOM 601 NH2 ARG A 39 13.540 7.867 -17.415 1.00 0.00 N ATOM 0 H ARG A 39 14.834 3.651 -11.921 1.00 0.00 H new ATOM 0 HA ARG A 39 14.218 6.080 -13.409 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.772 3.705 -12.324 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.860 5.201 -12.356 1.00 0.00 H new ATOM 0 HG2 ARG A 39 13.328 4.163 -14.799 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.693 3.665 -14.413 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.994 5.499 -15.526 1.00 0.00 H new ATOM 0 HD3 ARG A 39 11.560 6.436 -14.158 1.00 0.00 H new ATOM 0 HE ARG A 39 13.845 6.093 -15.697 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.585 7.323 -16.259 1.00 0.00 H new ATOM 0 HH12 ARG A 39 11.103 8.460 -17.508 1.00 0.00 H new ATOM 0 HH21 ARG A 39 14.505 7.557 -17.302 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.314 8.592 -18.096 1.00 0.00 H new ATOM 615 N ARG A 40 13.486 5.791 -10.187 1.00 0.00 N ATOM 616 CA ARG A 40 13.268 6.556 -8.965 1.00 0.00 C ATOM 617 C ARG A 40 13.980 5.906 -7.782 1.00 0.00 C ATOM 618 O ARG A 40 13.794 4.721 -7.508 1.00 0.00 O ATOM 619 CB ARG A 40 11.771 6.673 -8.672 1.00 0.00 C ATOM 620 CG ARG A 40 11.429 7.779 -7.687 1.00 0.00 C ATOM 621 CD ARG A 40 10.407 8.745 -8.266 1.00 0.00 C ATOM 622 NE ARG A 40 10.346 9.994 -7.513 1.00 0.00 N ATOM 623 CZ ARG A 40 9.510 10.986 -7.801 1.00 0.00 C ATOM 624 NH1 ARG A 40 8.671 10.874 -8.821 1.00 0.00 N ATOM 625 NH2 ARG A 40 9.514 12.092 -7.069 1.00 0.00 N ATOM 0 H ARG A 40 13.391 4.782 -10.075 1.00 0.00 H new ATOM 0 HA ARG A 40 13.682 7.554 -9.112 1.00 0.00 H new ATOM 0 HB2 ARG A 40 11.239 6.853 -9.606 1.00 0.00 H new ATOM 0 HB3 ARG A 40 11.411 5.723 -8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 40 11.038 7.341 -6.768 1.00 0.00 H new ATOM 0 HG3 ARG A 40 12.335 8.323 -7.420 1.00 0.00 H new ATOM 0 HD2 ARG A 40 10.659 8.960 -9.304 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.424 8.274 -8.268 1.00 0.00 H new ATOM 0 HE ARG A 40 10.980 10.112 -6.722 1.00 0.00 H new ATOM 0 HH11 ARG A 40 8.666 10.025 -9.387 1.00 0.00 H new ATOM 0 HH12 ARG A 40 8.030 11.637 -9.040 1.00 0.00 H new ATOM 0 HH21 ARG A 40 10.159 12.182 -6.284 1.00 0.00 H new ATOM 0 HH22 ARG A 40 8.872 12.853 -7.291 1.00 0.00 H new ATOM 639 N SER A 41 14.796 6.690 -7.086 1.00 0.00 N ATOM 640 CA SER A 41 15.540 6.190 -5.935 1.00 0.00 C ATOM 641 C SER A 41 16.213 7.335 -5.185 1.00 0.00 C ATOM 642 O SER A 41 17.431 7.513 -5.236 1.00 0.00 O ATOM 643 CB SER A 41 16.589 5.171 -6.383 1.00 0.00 C ATOM 644 OG SER A 41 16.887 4.256 -5.343 1.00 0.00 O ATOM 0 H SER A 41 14.959 7.674 -7.298 1.00 0.00 H new ATOM 0 HA SER A 41 14.836 5.702 -5.261 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.225 4.629 -7.256 1.00 0.00 H new ATOM 0 HB3 SER A 41 17.498 5.690 -6.687 1.00 0.00 H new ATOM 0 HG SER A 41 17.433 3.524 -5.698 1.00 0.00 H new ATOM 650 N PRO A 42 15.404 8.131 -4.470 1.00 0.00 N ATOM 651 CA PRO A 42 15.899 9.272 -3.695 1.00 0.00 C ATOM 652 C PRO A 42 16.708 8.838 -2.477 1.00 0.00 C ATOM 653 O PRO A 42 17.717 9.458 -2.138 1.00 0.00 O ATOM 654 CB PRO A 42 14.617 9.986 -3.257 1.00 0.00 C ATOM 655 CG PRO A 42 13.573 8.923 -3.255 1.00 0.00 C ATOM 656 CD PRO A 42 13.943 7.977 -4.364 1.00 0.00 C ATOM 0 HA PRO A 42 16.575 9.898 -4.278 1.00 0.00 H new ATOM 0 HB2 PRO A 42 14.730 10.432 -2.269 1.00 0.00 H new ATOM 0 HB3 PRO A 42 14.359 10.793 -3.943 1.00 0.00 H new ATOM 0 HG2 PRO A 42 13.543 8.407 -2.295 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.583 9.348 -3.419 1.00 0.00 H new ATOM 0 HD2 PRO A 42 13.663 6.951 -4.127 1.00 0.00 H new ATOM 0 HD3 PRO A 42 13.443 8.236 -5.297 1.00 0.00 H new ATOM 664 N HIS A 43 16.261 7.771 -1.824 1.00 0.00 N ATOM 665 CA HIS A 43 16.945 7.254 -0.644 1.00 0.00 C ATOM 666 C HIS A 43 17.749 6.003 -0.987 1.00 0.00 C ATOM 667 O HIS A 43 18.826 5.776 -0.436 1.00 0.00 O ATOM 668 CB HIS A 43 15.936 6.938 0.460 1.00 0.00 C ATOM 669 CG HIS A 43 16.535 6.919 1.832 1.00 0.00 C ATOM 670 ND1 HIS A 43 17.582 7.734 2.208 1.00 0.00 N ATOM 671 CD2 HIS A 43 16.229 6.177 2.922 1.00 0.00 C ATOM 672 CE1 HIS A 43 17.894 7.494 3.469 1.00 0.00 C ATOM 673 NE2 HIS A 43 17.087 6.553 3.925 1.00 0.00 N ATOM 0 H HIS A 43 15.428 7.247 -2.092 1.00 0.00 H new ATOM 0 HA HIS A 43 17.633 8.021 -0.288 1.00 0.00 H new ATOM 0 HB2 HIS A 43 15.136 7.678 0.432 1.00 0.00 H new ATOM 0 HB3 HIS A 43 15.481 5.968 0.258 1.00 0.00 H new ATOM 0 HD2 HIS A 43 15.454 5.428 2.990 1.00 0.00 H new ATOM 0 HE1 HIS A 43 18.675 7.984 4.031 1.00 0.00 H new ATOM 0 HE2 HIS A 43 17.099 6.168 4.870 1.00 0.00 H new ATOM 681 N GLU A 44 17.219 5.196 -1.901 1.00 0.00 N ATOM 682 CA GLU A 44 17.887 3.968 -2.315 1.00 0.00 C ATOM 683 C GLU A 44 18.201 3.086 -1.110 1.00 0.00 C ATOM 684 O GLU A 44 19.364 2.806 -0.818 1.00 0.00 O ATOM 685 CB GLU A 44 19.177 4.294 -3.072 1.00 0.00 C ATOM 686 CG GLU A 44 19.814 3.086 -3.737 1.00 0.00 C ATOM 687 CD GLU A 44 21.322 3.204 -3.839 1.00 0.00 C ATOM 688 OE1 GLU A 44 21.983 3.305 -2.784 1.00 0.00 O ATOM 689 OE2 GLU A 44 21.842 3.194 -4.975 1.00 0.00 O ATOM 0 H GLU A 44 16.329 5.371 -2.369 1.00 0.00 H new ATOM 0 HA GLU A 44 17.213 3.423 -2.976 1.00 0.00 H new ATOM 0 HB2 GLU A 44 18.962 5.045 -3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 44 19.893 4.737 -2.379 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.561 2.189 -3.172 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.395 2.962 -4.735 1.00 0.00 H new ATOM 696 N ASP A 45 17.156 2.653 -0.414 1.00 0.00 N ATOM 697 CA ASP A 45 17.318 1.802 0.759 1.00 0.00 C ATOM 698 C ASP A 45 16.592 0.473 0.571 1.00 0.00 C ATOM 699 O ASP A 45 17.202 -0.595 0.638 1.00 0.00 O ATOM 700 CB ASP A 45 16.792 2.513 2.007 1.00 0.00 C ATOM 701 CG ASP A 45 17.201 1.812 3.288 1.00 0.00 C ATOM 702 OD1 ASP A 45 17.658 0.653 3.209 1.00 0.00 O ATOM 703 OD2 ASP A 45 17.063 2.422 4.369 1.00 0.00 O ATOM 0 H ASP A 45 16.187 2.877 -0.642 1.00 0.00 H new ATOM 0 HA ASP A 45 18.381 1.599 0.887 1.00 0.00 H new ATOM 0 HB2 ASP A 45 17.164 3.537 2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 45 15.705 2.570 1.958 1.00 0.00 H new ATOM 708 N THR A 46 15.286 0.546 0.338 1.00 0.00 N ATOM 709 CA THR A 46 14.476 -0.650 0.143 1.00 0.00 C ATOM 710 C THR A 46 13.062 -0.292 -0.298 1.00 0.00 C ATOM 711 O THR A 46 12.087 -0.867 0.184 1.00 0.00 O ATOM 712 CB THR A 46 14.402 -1.494 1.430 1.00 0.00 C ATOM 713 OG1 THR A 46 13.656 -2.692 1.188 1.00 0.00 O ATOM 714 CG2 THR A 46 13.752 -0.705 2.557 1.00 0.00 C ATOM 0 H THR A 46 14.766 1.421 0.280 1.00 0.00 H new ATOM 0 HA THR A 46 14.960 -1.235 -0.639 1.00 0.00 H new ATOM 0 HB THR A 46 15.418 -1.753 1.728 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.815 -2.468 0.737 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.711 -1.321 3.455 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.338 0.192 2.758 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.741 -0.420 2.266 1.00 0.00 H new ATOM 722 N GLU A 47 12.958 0.663 -1.218 1.00 0.00 N ATOM 723 CA GLU A 47 11.662 1.097 -1.724 1.00 0.00 C ATOM 724 C GLU A 47 11.709 1.307 -3.235 1.00 0.00 C ATOM 725 O GLU A 47 12.694 0.963 -3.889 1.00 0.00 O ATOM 726 CB GLU A 47 11.227 2.391 -1.032 1.00 0.00 C ATOM 727 CG GLU A 47 11.244 2.305 0.485 1.00 0.00 C ATOM 728 CD GLU A 47 10.289 3.287 1.136 1.00 0.00 C ATOM 729 OE1 GLU A 47 10.516 4.508 1.007 1.00 0.00 O ATOM 730 OE2 GLU A 47 9.316 2.835 1.775 1.00 0.00 O ATOM 0 H GLU A 47 13.755 1.150 -1.627 1.00 0.00 H new ATOM 0 HA GLU A 47 10.936 0.314 -1.506 1.00 0.00 H new ATOM 0 HB2 GLU A 47 11.884 3.201 -1.349 1.00 0.00 H new ATOM 0 HB3 GLU A 47 10.221 2.649 -1.362 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.982 1.292 0.791 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.255 2.495 0.845 1.00 0.00 H new ATOM 737 N SER A 48 10.639 1.874 -3.782 1.00 0.00 N ATOM 738 CA SER A 48 10.556 2.126 -5.216 1.00 0.00 C ATOM 739 C SER A 48 10.607 0.819 -6.001 1.00 0.00 C ATOM 740 O SER A 48 10.780 -0.257 -5.427 1.00 0.00 O ATOM 741 CB SER A 48 11.694 3.046 -5.660 1.00 0.00 C ATOM 742 OG SER A 48 11.214 4.345 -5.959 1.00 0.00 O ATOM 0 H SER A 48 9.817 2.168 -3.254 1.00 0.00 H new ATOM 0 HA SER A 48 9.603 2.615 -5.420 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.446 3.105 -4.873 1.00 0.00 H new ATOM 0 HB3 SER A 48 12.184 2.625 -6.538 1.00 0.00 H new ATOM 0 HG SER A 48 11.925 4.866 -6.388 1.00 0.00 H new ATOM 748 N PHE A 49 10.455 0.920 -7.317 1.00 0.00 N ATOM 749 CA PHE A 49 10.482 -0.253 -8.183 1.00 0.00 C ATOM 750 C PHE A 49 11.415 -0.031 -9.370 1.00 0.00 C ATOM 751 O PHE A 49 11.338 0.990 -10.053 1.00 0.00 O ATOM 752 CB PHE A 49 9.073 -0.578 -8.681 1.00 0.00 C ATOM 753 CG PHE A 49 8.435 0.543 -9.449 1.00 0.00 C ATOM 754 CD1 PHE A 49 7.826 1.597 -8.786 1.00 0.00 C ATOM 755 CD2 PHE A 49 8.443 0.544 -10.835 1.00 0.00 C ATOM 756 CE1 PHE A 49 7.238 2.631 -9.490 1.00 0.00 C ATOM 757 CE2 PHE A 49 7.857 1.576 -11.544 1.00 0.00 C ATOM 758 CZ PHE A 49 7.253 2.620 -10.871 1.00 0.00 C ATOM 0 H PHE A 49 10.312 1.803 -7.808 1.00 0.00 H new ATOM 0 HA PHE A 49 10.857 -1.095 -7.601 1.00 0.00 H new ATOM 0 HB2 PHE A 49 9.116 -1.464 -9.315 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.443 -0.827 -7.827 1.00 0.00 H new ATOM 0 HD1 PHE A 49 7.811 1.610 -7.706 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.912 -0.270 -11.367 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.767 3.446 -8.961 1.00 0.00 H new ATOM 0 HE2 PHE A 49 7.871 1.566 -12.624 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.793 3.426 -11.424 1.00 0.00 H new ATOM 768 N THR A 50 12.298 -0.996 -9.610 1.00 0.00 N ATOM 769 CA THR A 50 13.247 -0.907 -10.712 1.00 0.00 C ATOM 770 C THR A 50 12.679 -1.536 -11.979 1.00 0.00 C ATOM 771 O THR A 50 12.386 -2.731 -12.013 1.00 0.00 O ATOM 772 CB THR A 50 14.579 -1.597 -10.363 1.00 0.00 C ATOM 773 OG1 THR A 50 15.118 -1.041 -9.158 1.00 0.00 O ATOM 774 CG2 THR A 50 15.584 -1.438 -11.494 1.00 0.00 C ATOM 0 H THR A 50 12.375 -1.848 -9.055 1.00 0.00 H new ATOM 0 HA THR A 50 13.430 0.153 -10.887 1.00 0.00 H new ATOM 0 HB THR A 50 14.385 -2.660 -10.218 1.00 0.00 H new ATOM 0 HG1 THR A 50 15.964 -1.486 -8.942 1.00 0.00 H new ATOM 0 HG21 THR A 50 16.517 -1.933 -11.224 1.00 0.00 H new ATOM 0 HG22 THR A 50 15.184 -1.888 -12.402 1.00 0.00 H new ATOM 0 HG23 THR A 50 15.773 -0.378 -11.667 1.00 0.00 H new ATOM 782 N VAL A 51 12.526 -0.724 -13.020 1.00 0.00 N ATOM 783 CA VAL A 51 11.994 -1.201 -14.291 1.00 0.00 C ATOM 784 C VAL A 51 13.103 -1.758 -15.176 1.00 0.00 C ATOM 785 O VAL A 51 14.287 -1.625 -14.864 1.00 0.00 O ATOM 786 CB VAL A 51 11.261 -0.079 -15.050 1.00 0.00 C ATOM 787 CG1 VAL A 51 10.109 0.464 -14.218 1.00 0.00 C ATOM 788 CG2 VAL A 51 12.230 1.032 -15.423 1.00 0.00 C ATOM 0 H VAL A 51 12.763 0.268 -13.008 1.00 0.00 H new ATOM 0 HA VAL A 51 11.285 -1.995 -14.059 1.00 0.00 H new ATOM 0 HB VAL A 51 10.849 -0.495 -15.970 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.603 1.256 -14.770 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.403 -0.339 -14.006 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.495 0.865 -13.281 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.695 1.816 -15.959 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.673 1.448 -14.518 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.017 0.629 -16.060 1.00 0.00 H new ATOM 798 N TYR A 52 12.713 -2.381 -16.282 1.00 0.00 N ATOM 799 CA TYR A 52 13.674 -2.961 -17.213 1.00 0.00 C ATOM 800 C TYR A 52 13.247 -2.719 -18.658 1.00 0.00 C ATOM 801 O TYR A 52 12.137 -2.256 -18.920 1.00 0.00 O ATOM 802 CB TYR A 52 13.823 -4.461 -16.957 1.00 0.00 C ATOM 803 CG TYR A 52 14.190 -4.799 -15.530 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.463 -4.537 -15.039 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.264 -5.381 -14.673 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.803 -4.845 -13.735 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.594 -5.690 -13.368 1.00 0.00 C ATOM 808 CZ TYR A 52 14.865 -5.420 -12.904 1.00 0.00 C ATOM 809 OH TYR A 52 15.199 -5.728 -11.605 1.00 0.00 O ATOM 0 H TYR A 52 11.737 -2.498 -16.556 1.00 0.00 H new ATOM 0 HA TYR A 52 14.636 -2.475 -17.052 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.887 -4.959 -17.210 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.587 -4.861 -17.624 1.00 0.00 H new ATOM 0 HD1 TYR A 52 16.199 -4.085 -15.687 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.269 -5.595 -15.034 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.798 -4.636 -13.369 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.861 -6.140 -12.715 1.00 0.00 H new ATOM 0 HH TYR A 52 14.425 -6.126 -11.154 1.00 0.00 H new ATOM 819 N LEU A 53 14.137 -3.037 -19.591 1.00 0.00 N ATOM 820 CA LEU A 53 13.854 -2.856 -21.011 1.00 0.00 C ATOM 821 C LEU A 53 13.064 -4.038 -21.564 1.00 0.00 C ATOM 822 O LEU A 53 13.473 -5.191 -21.424 1.00 0.00 O ATOM 823 CB LEU A 53 15.158 -2.689 -21.794 1.00 0.00 C ATOM 824 CG LEU A 53 15.391 -1.316 -22.424 1.00 0.00 C ATOM 825 CD1 LEU A 53 14.257 -0.966 -23.376 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.532 -0.251 -21.347 1.00 0.00 C ATOM 0 H LEU A 53 15.060 -3.421 -19.391 1.00 0.00 H new ATOM 0 HA LEU A 53 13.251 -1.955 -21.124 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.991 -2.905 -21.125 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.182 -3.438 -22.585 1.00 0.00 H new ATOM 0 HG LEU A 53 16.319 -1.353 -22.994 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.440 0.015 -23.815 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.203 -1.713 -24.168 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.315 -0.948 -22.828 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.697 0.720 -21.815 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.621 -0.215 -20.749 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.379 -0.493 -20.705 1.00 0.00 H new ATOM 838 N ARG A 54 11.931 -3.743 -22.193 1.00 0.00 N ATOM 839 CA ARG A 54 11.084 -4.782 -22.768 1.00 0.00 C ATOM 840 C ARG A 54 11.850 -5.593 -23.809 1.00 0.00 C ATOM 841 O ARG A 54 11.564 -6.771 -24.026 1.00 0.00 O ATOM 842 CB ARG A 54 9.840 -4.160 -23.405 1.00 0.00 C ATOM 843 CG ARG A 54 8.657 -5.110 -23.483 1.00 0.00 C ATOM 844 CD ARG A 54 7.337 -4.372 -23.323 1.00 0.00 C ATOM 845 NE ARG A 54 6.912 -3.734 -24.567 1.00 0.00 N ATOM 846 CZ ARG A 54 6.298 -4.381 -25.551 1.00 0.00 C ATOM 847 NH1 ARG A 54 6.037 -5.676 -25.437 1.00 0.00 N ATOM 848 NH2 ARG A 54 5.942 -3.731 -26.652 1.00 0.00 N ATOM 0 H ARG A 54 11.578 -2.794 -22.317 1.00 0.00 H new ATOM 0 HA ARG A 54 10.777 -5.452 -21.965 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.551 -3.279 -22.832 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.089 -3.819 -24.410 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.670 -5.631 -24.440 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.747 -5.869 -22.706 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.569 -5.071 -22.993 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.436 -3.616 -22.544 1.00 0.00 H new ATOM 0 HE ARG A 54 7.097 -2.738 -24.686 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.308 -6.178 -24.592 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.565 -6.170 -26.195 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.140 -2.734 -26.742 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.470 -4.228 -27.408 1.00 0.00 H new ATOM 862 N SER A 55 12.823 -4.955 -24.451 1.00 0.00 N ATOM 863 CA SER A 55 13.627 -5.616 -25.472 1.00 0.00 C ATOM 864 C SER A 55 14.645 -6.558 -24.837 1.00 0.00 C ATOM 865 O SER A 55 14.796 -7.704 -25.261 1.00 0.00 O ATOM 866 CB SER A 55 14.346 -4.578 -26.336 1.00 0.00 C ATOM 867 OG SER A 55 13.547 -4.194 -27.442 1.00 0.00 O ATOM 0 H SER A 55 13.074 -3.981 -24.282 1.00 0.00 H new ATOM 0 HA SER A 55 12.958 -6.203 -26.102 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.585 -3.701 -25.734 1.00 0.00 H new ATOM 0 HB3 SER A 55 15.292 -4.988 -26.691 1.00 0.00 H new ATOM 0 HG SER A 55 14.028 -3.529 -27.978 1.00 0.00 H new ATOM 873 N ASP A 56 15.341 -6.067 -23.817 1.00 0.00 N ATOM 874 CA ASP A 56 16.345 -6.864 -23.121 1.00 0.00 C ATOM 875 C ASP A 56 15.706 -8.076 -22.451 1.00 0.00 C ATOM 876 O ASP A 56 16.209 -9.195 -22.558 1.00 0.00 O ATOM 877 CB ASP A 56 17.070 -6.012 -22.079 1.00 0.00 C ATOM 878 CG ASP A 56 18.208 -5.209 -22.677 1.00 0.00 C ATOM 879 OD1 ASP A 56 19.023 -5.796 -23.419 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.283 -3.993 -22.404 1.00 0.00 O ATOM 0 H ASP A 56 15.228 -5.121 -23.454 1.00 0.00 H new ATOM 0 HA ASP A 56 17.068 -7.217 -23.856 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.358 -5.333 -21.610 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.460 -6.659 -21.293 1.00 0.00 H new ATOM 885 N VAL A 57 14.596 -7.846 -21.758 1.00 0.00 N ATOM 886 CA VAL A 57 13.888 -8.920 -21.069 1.00 0.00 C ATOM 887 C VAL A 57 13.499 -10.031 -22.038 1.00 0.00 C ATOM 888 O VAL A 57 13.393 -11.194 -21.652 1.00 0.00 O ATOM 889 CB VAL A 57 12.620 -8.397 -20.369 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.924 -9.521 -19.617 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.965 -7.250 -19.430 1.00 0.00 C ATOM 0 H VAL A 57 14.167 -6.926 -21.658 1.00 0.00 H new ATOM 0 HA VAL A 57 14.570 -9.319 -20.318 1.00 0.00 H new ATOM 0 HB VAL A 57 11.935 -8.021 -21.129 1.00 0.00 H new ATOM 0 HG11 VAL A 57 11.030 -9.133 -19.129 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.643 -10.307 -20.317 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.600 -9.929 -18.866 1.00 0.00 H new ATOM 0 HG21 VAL A 57 12.057 -6.892 -18.944 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.669 -7.598 -18.674 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.416 -6.437 -19.999 1.00 0.00 H new ATOM 901 N GLU A 58 13.288 -9.663 -23.298 1.00 0.00 N ATOM 902 CA GLU A 58 12.910 -10.630 -24.322 1.00 0.00 C ATOM 903 C GLU A 58 13.925 -11.767 -24.398 1.00 0.00 C ATOM 904 O GLU A 58 13.557 -12.941 -24.430 1.00 0.00 O ATOM 905 CB GLU A 58 12.793 -9.944 -25.685 1.00 0.00 C ATOM 906 CG GLU A 58 12.134 -10.807 -26.747 1.00 0.00 C ATOM 907 CD GLU A 58 11.564 -9.991 -27.891 1.00 0.00 C ATOM 908 OE1 GLU A 58 10.762 -9.073 -27.621 1.00 0.00 O ATOM 909 OE2 GLU A 58 11.919 -10.271 -29.055 1.00 0.00 O ATOM 0 H GLU A 58 13.372 -8.704 -23.634 1.00 0.00 H new ATOM 0 HA GLU A 58 11.941 -11.049 -24.050 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.221 -9.023 -25.571 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.789 -9.660 -26.026 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.864 -11.515 -27.139 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.336 -11.392 -26.290 1.00 0.00 H new ATOM 916 N ALA A 59 15.204 -11.409 -24.428 1.00 0.00 N ATOM 917 CA ALA A 59 16.273 -12.398 -24.499 1.00 0.00 C ATOM 918 C ALA A 59 16.434 -13.129 -23.170 1.00 0.00 C ATOM 919 O ALA A 59 16.748 -14.318 -23.138 1.00 0.00 O ATOM 920 CB ALA A 59 17.581 -11.733 -24.899 1.00 0.00 C ATOM 0 H ALA A 59 15.526 -10.441 -24.404 1.00 0.00 H new ATOM 0 HA ALA A 59 16.005 -13.133 -25.258 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.370 -12.483 -24.948 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.466 -11.263 -25.876 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.845 -10.976 -24.160 1.00 0.00 H new ATOM 926 N LYS A 60 16.217 -12.409 -22.074 1.00 0.00 N ATOM 927 CA LYS A 60 16.337 -12.988 -20.742 1.00 0.00 C ATOM 928 C LYS A 60 15.446 -14.218 -20.601 1.00 0.00 C ATOM 929 O LYS A 60 15.731 -15.115 -19.807 1.00 0.00 O ATOM 930 CB LYS A 60 15.966 -11.952 -19.678 1.00 0.00 C ATOM 931 CG LYS A 60 16.927 -11.918 -18.502 1.00 0.00 C ATOM 932 CD LYS A 60 17.052 -13.282 -17.844 1.00 0.00 C ATOM 933 CE LYS A 60 18.058 -13.260 -16.703 1.00 0.00 C ATOM 934 NZ LYS A 60 18.424 -14.634 -16.260 1.00 0.00 N ATOM 0 H LYS A 60 15.957 -11.423 -22.083 1.00 0.00 H new ATOM 0 HA LYS A 60 17.373 -13.293 -20.598 1.00 0.00 H new ATOM 0 HB2 LYS A 60 15.934 -10.965 -20.139 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.962 -12.164 -19.310 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.908 -11.586 -18.842 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.580 -11.190 -17.769 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.079 -13.596 -17.466 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.358 -14.019 -18.587 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.956 -12.730 -17.020 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.641 -12.706 -15.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.885 -14.587 -15.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.566 -15.217 -16.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.077 -15.058 -16.949 1.00 0.00 H new ATOM 948 N SER A 61 14.368 -14.255 -21.378 1.00 0.00 N ATOM 949 CA SER A 61 13.434 -15.374 -21.337 1.00 0.00 C ATOM 950 C SER A 61 13.940 -16.534 -22.190 1.00 0.00 C ATOM 951 O SER A 61 13.608 -17.694 -21.941 1.00 0.00 O ATOM 952 CB SER A 61 12.054 -14.932 -21.826 1.00 0.00 C ATOM 953 OG SER A 61 11.806 -15.395 -23.142 1.00 0.00 O ATOM 0 H SER A 61 14.120 -13.523 -22.043 1.00 0.00 H new ATOM 0 HA SER A 61 13.355 -15.712 -20.304 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.287 -15.314 -21.152 1.00 0.00 H new ATOM 0 HB3 SER A 61 11.987 -13.844 -21.801 1.00 0.00 H new ATOM 0 HG SER A 61 12.232 -14.792 -23.787 1.00 0.00 H new ATOM 959 N LEU A 62 14.746 -16.213 -23.196 1.00 0.00 N ATOM 960 CA LEU A 62 15.299 -17.228 -24.086 1.00 0.00 C ATOM 961 C LEU A 62 16.582 -17.818 -23.509 1.00 0.00 C ATOM 962 O LEU A 62 16.886 -18.991 -23.722 1.00 0.00 O ATOM 963 CB LEU A 62 15.577 -16.627 -25.465 1.00 0.00 C ATOM 964 CG LEU A 62 14.484 -15.722 -26.036 1.00 0.00 C ATOM 965 CD1 LEU A 62 14.835 -15.289 -27.451 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.138 -16.432 -26.011 1.00 0.00 C ATOM 0 H LEU A 62 15.031 -15.259 -23.416 1.00 0.00 H new ATOM 0 HA LEU A 62 14.565 -18.028 -24.185 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.503 -16.054 -25.410 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.749 -17.443 -26.167 1.00 0.00 H new ATOM 0 HG LEU A 62 14.414 -14.831 -25.413 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.046 -14.646 -27.841 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.778 -14.742 -27.441 1.00 0.00 H new ATOM 0 HD13 LEU A 62 14.933 -16.169 -28.087 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.372 -15.774 -26.421 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.195 -17.340 -26.611 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.882 -16.691 -24.984 1.00 0.00 H new ATOM 978 N GLU A 63 17.328 -16.998 -22.776 1.00 0.00 N ATOM 979 CA GLU A 63 18.576 -17.441 -22.167 1.00 0.00 C ATOM 980 C GLU A 63 18.306 -18.337 -20.961 1.00 0.00 C ATOM 981 O GLU A 63 19.141 -19.160 -20.586 1.00 0.00 O ATOM 982 CB GLU A 63 19.417 -16.236 -21.741 1.00 0.00 C ATOM 983 CG GLU A 63 18.893 -15.536 -20.498 1.00 0.00 C ATOM 984 CD GLU A 63 19.658 -15.919 -19.246 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.470 -17.055 -18.761 1.00 0.00 O ATOM 986 OE2 GLU A 63 20.443 -15.084 -18.751 1.00 0.00 O ATOM 0 H GLU A 63 17.090 -16.024 -22.590 1.00 0.00 H new ATOM 0 HA GLU A 63 19.128 -18.017 -22.910 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.440 -16.564 -21.559 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.453 -15.520 -22.562 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.954 -14.457 -20.640 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.839 -15.781 -20.365 1.00 0.00 H new ATOM 993 N VAL A 64 17.132 -18.171 -20.360 1.00 0.00 N ATOM 994 CA VAL A 64 16.750 -18.965 -19.197 1.00 0.00 C ATOM 995 C VAL A 64 15.974 -20.209 -19.613 1.00 0.00 C ATOM 996 O VAL A 64 16.494 -21.324 -19.560 1.00 0.00 O ATOM 997 CB VAL A 64 15.895 -18.144 -18.214 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.460 -19.004 -17.037 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.660 -16.920 -17.736 1.00 0.00 C ATOM 0 H VAL A 64 16.429 -17.495 -20.659 1.00 0.00 H new ATOM 0 HA VAL A 64 17.673 -19.265 -18.701 1.00 0.00 H new ATOM 0 HB VAL A 64 15.000 -17.804 -18.735 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.857 -18.407 -16.353 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.871 -19.846 -17.400 1.00 0.00 H new ATOM 0 HG13 VAL A 64 16.341 -19.376 -16.513 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.040 -16.352 -17.042 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.573 -17.236 -17.232 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.915 -16.294 -18.591 1.00 0.00 H new ATOM 1009 N TRP A 65 14.728 -20.011 -20.027 1.00 0.00 N ATOM 1010 CA TRP A 65 13.879 -21.119 -20.453 1.00 0.00 C ATOM 1011 C TRP A 65 14.491 -21.847 -21.644 1.00 0.00 C ATOM 1012 O TRP A 65 14.230 -23.029 -21.862 1.00 0.00 O ATOM 1013 CB TRP A 65 12.483 -20.609 -20.813 1.00 0.00 C ATOM 1014 CG TRP A 65 11.602 -20.396 -19.620 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.417 -19.228 -18.936 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.788 -21.378 -18.969 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.537 -19.425 -17.899 1.00 0.00 N ATOM 1018 CE2 TRP A 65 10.136 -20.735 -17.898 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.545 -22.736 -19.188 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 9.260 -21.407 -17.050 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.675 -23.401 -18.345 1.00 0.00 C ATOM 1022 CH2 TRP A 65 9.040 -22.737 -17.288 1.00 0.00 C ATOM 0 H TRP A 65 14.283 -19.095 -20.077 1.00 0.00 H new ATOM 0 HA TRP A 65 13.799 -21.822 -19.624 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.577 -19.670 -21.359 1.00 0.00 H new ATOM 0 HB3 TRP A 65 12.006 -21.322 -21.485 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.892 -18.288 -19.175 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.232 -18.711 -17.237 1.00 0.00 H new ATOM 0 HE3 TRP A 65 11.028 -23.257 -20.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.771 -20.897 -16.233 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.481 -24.452 -18.504 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.364 -23.285 -16.648 1.00 0.00 H new ATOM 1033 N GLY A 66 15.308 -21.133 -22.413 1.00 0.00 N ATOM 1034 CA GLY A 66 15.944 -21.729 -23.573 1.00 0.00 C ATOM 1035 C GLY A 66 15.379 -21.203 -24.878 1.00 0.00 C ATOM 1036 O GLY A 66 16.127 -20.889 -25.804 1.00 0.00 O ATOM 0 H GLY A 66 15.540 -20.153 -22.253 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.015 -21.531 -23.538 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.819 -22.811 -23.536 1.00 0.00 H new ATOM 1040 N SER A 67 14.056 -21.110 -24.953 1.00 0.00 N ATOM 1041 CA SER A 67 13.391 -20.624 -26.157 1.00 0.00 C ATOM 1042 C SER A 67 12.065 -19.952 -25.811 1.00 0.00 C ATOM 1043 O SER A 67 11.496 -20.159 -24.740 1.00 0.00 O ATOM 1044 CB SER A 67 13.151 -21.778 -27.133 1.00 0.00 C ATOM 1045 OG SER A 67 12.935 -22.995 -26.441 1.00 0.00 O ATOM 0 H SER A 67 13.423 -21.365 -24.195 1.00 0.00 H new ATOM 0 HA SER A 67 14.040 -19.887 -26.629 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.288 -21.554 -27.760 1.00 0.00 H new ATOM 0 HB3 SER A 67 14.009 -21.881 -27.797 1.00 0.00 H new ATOM 0 HG SER A 67 12.782 -23.716 -27.087 1.00 0.00 H new ATOM 1051 N PRO A 68 11.562 -19.126 -26.741 1.00 0.00 N ATOM 1052 CA PRO A 68 10.298 -18.406 -26.559 1.00 0.00 C ATOM 1053 C PRO A 68 9.091 -19.337 -26.591 1.00 0.00 C ATOM 1054 O PRO A 68 8.000 -18.967 -26.159 1.00 0.00 O ATOM 1055 CB PRO A 68 10.264 -17.444 -27.749 1.00 0.00 C ATOM 1056 CG PRO A 68 11.110 -18.095 -28.787 1.00 0.00 C ATOM 1057 CD PRO A 68 12.188 -18.832 -28.041 1.00 0.00 C ATOM 0 HA PRO A 68 10.247 -17.909 -25.590 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.245 -17.292 -28.106 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.656 -16.464 -27.477 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.521 -18.779 -29.398 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.539 -17.354 -29.462 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.485 -19.744 -28.560 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.085 -18.224 -27.927 1.00 0.00 H new ATOM 1065 N GLU A 69 9.295 -20.545 -27.106 1.00 0.00 N ATOM 1066 CA GLU A 69 8.221 -21.528 -27.195 1.00 0.00 C ATOM 1067 C GLU A 69 7.903 -22.111 -25.821 1.00 0.00 C ATOM 1068 O GLU A 69 6.748 -22.403 -25.511 1.00 0.00 O ATOM 1069 CB GLU A 69 8.606 -22.651 -28.160 1.00 0.00 C ATOM 1070 CG GLU A 69 7.577 -22.895 -29.251 1.00 0.00 C ATOM 1071 CD GLU A 69 8.024 -22.372 -30.603 1.00 0.00 C ATOM 1072 OE1 GLU A 69 8.144 -21.138 -30.751 1.00 0.00 O ATOM 1073 OE2 GLU A 69 8.254 -23.197 -31.512 1.00 0.00 O ATOM 0 H GLU A 69 10.193 -20.867 -27.468 1.00 0.00 H new ATOM 0 HA GLU A 69 7.331 -21.023 -27.572 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.563 -22.409 -28.622 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.749 -23.572 -27.594 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.380 -23.964 -29.327 1.00 0.00 H new ATOM 0 HG3 GLU A 69 6.638 -22.417 -28.973 1.00 0.00 H new ATOM 1080 N ALA A 70 8.936 -22.278 -25.001 1.00 0.00 N ATOM 1081 CA ALA A 70 8.767 -22.824 -23.661 1.00 0.00 C ATOM 1082 C ALA A 70 7.882 -21.922 -22.808 1.00 0.00 C ATOM 1083 O ALA A 70 7.153 -22.395 -21.934 1.00 0.00 O ATOM 1084 CB ALA A 70 10.121 -23.020 -22.996 1.00 0.00 C ATOM 0 H ALA A 70 9.899 -22.043 -25.242 1.00 0.00 H new ATOM 0 HA ALA A 70 8.275 -23.792 -23.750 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.979 -23.428 -21.995 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.721 -23.711 -23.588 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.635 -22.061 -22.927 1.00 0.00 H new ATOM 1090 N LEU A 71 7.949 -20.621 -23.065 1.00 0.00 N ATOM 1091 CA LEU A 71 7.154 -19.651 -22.320 1.00 0.00 C ATOM 1092 C LEU A 71 5.779 -19.472 -22.955 1.00 0.00 C ATOM 1093 O LEU A 71 4.774 -19.338 -22.256 1.00 0.00 O ATOM 1094 CB LEU A 71 7.879 -18.305 -22.260 1.00 0.00 C ATOM 1095 CG LEU A 71 7.106 -17.154 -21.616 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.055 -17.325 -20.106 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.736 -15.818 -21.982 1.00 0.00 C ATOM 0 H LEU A 71 8.546 -20.213 -23.784 1.00 0.00 H new ATOM 0 HA LEU A 71 7.020 -20.030 -21.307 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.811 -18.441 -21.712 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.146 -18.013 -23.276 1.00 0.00 H new ATOM 0 HG LEU A 71 6.085 -17.168 -21.998 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.501 -16.497 -19.665 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.558 -18.264 -19.863 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.069 -17.337 -19.707 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.173 -15.010 -21.515 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.767 -15.793 -21.629 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.720 -15.693 -23.065 1.00 0.00 H new ATOM 1109 N ALA A 72 5.741 -19.473 -24.283 1.00 0.00 N ATOM 1110 CA ALA A 72 4.488 -19.315 -25.012 1.00 0.00 C ATOM 1111 C ALA A 72 3.477 -20.381 -24.603 1.00 0.00 C ATOM 1112 O ALA A 72 2.268 -20.155 -24.652 1.00 0.00 O ATOM 1113 CB ALA A 72 4.740 -19.371 -26.512 1.00 0.00 C ATOM 0 H ALA A 72 6.563 -19.581 -24.876 1.00 0.00 H new ATOM 0 HA ALA A 72 4.070 -18.340 -24.761 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.796 -19.252 -27.044 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.421 -18.569 -26.797 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.183 -20.332 -26.771 1.00 0.00 H new ATOM 1119 N ARG A 73 3.980 -21.544 -24.202 1.00 0.00 N ATOM 1120 CA ARG A 73 3.120 -22.646 -23.786 1.00 0.00 C ATOM 1121 C ARG A 73 2.208 -22.221 -22.639 1.00 0.00 C ATOM 1122 O ARG A 73 1.025 -22.557 -22.618 1.00 0.00 O ATOM 1123 CB ARG A 73 3.965 -23.848 -23.362 1.00 0.00 C ATOM 1124 CG ARG A 73 4.885 -24.363 -24.456 1.00 0.00 C ATOM 1125 CD ARG A 73 4.538 -25.791 -24.849 1.00 0.00 C ATOM 1126 NE ARG A 73 5.041 -26.131 -26.178 1.00 0.00 N ATOM 1127 CZ ARG A 73 4.436 -25.774 -27.305 1.00 0.00 C ATOM 1128 NH1 ARG A 73 3.313 -25.070 -27.265 1.00 0.00 N ATOM 1129 NH2 ARG A 73 4.955 -26.121 -28.476 1.00 0.00 N ATOM 0 H ARG A 73 4.978 -21.748 -24.156 1.00 0.00 H new ATOM 0 HA ARG A 73 2.498 -22.929 -24.635 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.565 -23.572 -22.495 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.302 -24.654 -23.047 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.811 -23.716 -25.330 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.919 -24.320 -24.114 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.956 -26.481 -24.116 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.456 -25.920 -24.827 1.00 0.00 H new ATOM 0 HE ARG A 73 5.903 -26.672 -26.244 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.911 -24.801 -26.367 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.851 -24.797 -28.132 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.819 -26.662 -28.511 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.490 -25.847 -29.341 1.00 0.00 H new ATOM 1143 N GLU A 74 2.768 -21.480 -21.688 1.00 0.00 N ATOM 1144 CA GLU A 74 2.005 -21.011 -20.537 1.00 0.00 C ATOM 1145 C GLU A 74 1.223 -19.747 -20.882 1.00 0.00 C ATOM 1146 O GLU A 74 0.092 -19.560 -20.433 1.00 0.00 O ATOM 1147 CB GLU A 74 2.937 -20.741 -19.354 1.00 0.00 C ATOM 1148 CG GLU A 74 3.728 -21.961 -18.912 1.00 0.00 C ATOM 1149 CD GLU A 74 2.855 -23.187 -18.729 1.00 0.00 C ATOM 1150 OE1 GLU A 74 1.953 -23.150 -17.866 1.00 0.00 O ATOM 1151 OE2 GLU A 74 3.073 -24.184 -19.449 1.00 0.00 O ATOM 0 H GLU A 74 3.746 -21.192 -21.692 1.00 0.00 H new ATOM 0 HA GLU A 74 1.297 -21.792 -20.260 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.632 -19.946 -19.624 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.347 -20.377 -18.513 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.500 -22.176 -19.651 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.237 -21.739 -17.974 1.00 0.00 H new ATOM 1158 N LYS A 75 1.835 -18.880 -21.681 1.00 0.00 N ATOM 1159 CA LYS A 75 1.198 -17.633 -22.088 1.00 0.00 C ATOM 1160 C LYS A 75 -0.131 -17.903 -22.787 1.00 0.00 C ATOM 1161 O LYS A 75 -1.104 -17.174 -22.594 1.00 0.00 O ATOM 1162 CB LYS A 75 2.124 -16.843 -23.017 1.00 0.00 C ATOM 1163 CG LYS A 75 3.497 -16.579 -22.426 1.00 0.00 C ATOM 1164 CD LYS A 75 3.822 -15.094 -22.410 1.00 0.00 C ATOM 1165 CE LYS A 75 2.972 -14.349 -21.392 1.00 0.00 C ATOM 1166 NZ LYS A 75 1.930 -13.511 -22.048 1.00 0.00 N ATOM 0 H LYS A 75 2.772 -19.018 -22.060 1.00 0.00 H new ATOM 0 HA LYS A 75 1.003 -17.044 -21.192 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.240 -17.390 -23.952 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.654 -15.891 -23.261 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.539 -16.972 -21.410 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.252 -17.111 -23.005 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.877 -14.954 -22.177 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.656 -14.673 -23.402 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.494 -15.065 -20.724 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.612 -13.717 -20.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.690 -12.709 -21.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.292 -13.153 -22.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.079 -14.084 -22.217 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.165 -18.955 -23.598 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.374 -19.323 -24.323 1.00 0.00 C ATOM 1182 C LYS A 76 -2.534 -19.561 -23.362 1.00 0.00 C ATOM 1183 O LYS A 76 -3.661 -19.132 -23.614 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.128 -20.580 -25.162 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.370 -21.092 -25.870 1.00 0.00 C ATOM 1186 CD LYS A 76 -2.852 -20.112 -26.927 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.842 -19.967 -28.055 1.00 0.00 C ATOM 1188 NZ LYS A 76 -2.507 -19.770 -29.373 1.00 0.00 N ATOM 0 H LYS A 76 0.632 -19.568 -23.769 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.636 -18.497 -24.984 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.359 -20.366 -25.904 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.738 -21.367 -24.516 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.154 -22.054 -26.335 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.162 -21.261 -25.141 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.805 -20.452 -27.332 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.029 -19.139 -26.469 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.186 -19.121 -27.849 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.212 -20.856 -28.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.785 -19.675 -30.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.113 -20.589 -29.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.088 -18.908 -29.343 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.252 -20.244 -22.258 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.272 -20.537 -21.257 1.00 0.00 C ATOM 1204 C LEU A 77 -3.899 -19.252 -20.726 1.00 0.00 C ATOM 1205 O LEU A 77 -5.104 -19.037 -20.857 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.667 -21.338 -20.103 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.707 -22.859 -20.248 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -4.144 -23.348 -20.346 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -1.907 -23.301 -21.465 1.00 0.00 C ATOM 0 H LEU A 77 -1.325 -20.605 -22.033 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.053 -21.130 -21.733 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.628 -21.032 -19.980 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.190 -21.067 -19.186 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.254 -23.301 -19.361 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.153 -24.433 -20.449 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.687 -23.064 -19.444 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.623 -22.897 -21.215 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.947 -24.387 -21.552 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.330 -22.849 -22.362 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.870 -22.984 -21.354 1.00 0.00 H new ATOM 1221 N ARG A 78 -3.072 -18.400 -20.129 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.545 -17.135 -19.579 1.00 0.00 C ATOM 1223 C ARG A 78 -4.191 -16.278 -20.664 1.00 0.00 C ATOM 1224 O ARG A 78 -5.071 -15.463 -20.386 1.00 0.00 O ATOM 1225 CB ARG A 78 -2.388 -16.371 -18.933 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.206 -16.154 -19.863 1.00 0.00 C ATOM 1227 CD ARG A 78 -0.080 -15.406 -19.168 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.563 -14.221 -18.462 1.00 0.00 N ATOM 1229 CZ ARG A 78 0.111 -13.621 -17.487 1.00 0.00 C ATOM 1230 NH1 ARG A 78 1.289 -14.092 -17.104 1.00 0.00 N ATOM 1231 NH2 ARG A 78 -0.395 -12.548 -16.894 1.00 0.00 N ATOM 0 H ARG A 78 -2.072 -18.562 -20.014 1.00 0.00 H new ATOM 0 HA ARG A 78 -4.295 -17.356 -18.820 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -2.751 -15.403 -18.589 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.051 -16.917 -18.052 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.839 -17.117 -20.218 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.530 -15.593 -20.740 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.415 -16.072 -18.461 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.667 -15.110 -19.904 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.467 -13.834 -18.733 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.680 -14.917 -17.558 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.804 -13.629 -16.355 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -1.302 -12.184 -17.187 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.122 -12.087 -16.145 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.748 -16.467 -21.902 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.282 -15.714 -23.030 1.00 0.00 C ATOM 1247 C LYS A 79 -5.717 -16.132 -23.334 1.00 0.00 C ATOM 1248 O LYS A 79 -6.646 -15.337 -23.200 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.406 -15.920 -24.269 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.684 -14.926 -25.383 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.427 -14.612 -26.176 1.00 0.00 C ATOM 1252 CE LYS A 79 -2.648 -14.804 -27.669 1.00 0.00 C ATOM 1253 NZ LYS A 79 -1.361 -14.937 -28.407 1.00 0.00 N ATOM 0 H LYS A 79 -3.019 -17.136 -22.150 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.279 -14.657 -22.762 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.358 -15.844 -23.979 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.560 -16.930 -24.648 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.445 -15.330 -26.051 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.087 -14.006 -24.959 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.120 -13.584 -25.982 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -1.614 -15.256 -25.842 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.256 -15.694 -27.835 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.208 -13.957 -28.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -1.554 -15.066 -29.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -0.792 -14.078 -28.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -0.838 -15.760 -28.047 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.889 -17.386 -23.742 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.212 -17.908 -24.063 1.00 0.00 C ATOM 1269 C GLU A 80 -8.186 -17.669 -22.913 1.00 0.00 C ATOM 1270 O GLU A 80 -9.383 -17.485 -23.128 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.132 -19.404 -24.375 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.079 -19.754 -25.413 1.00 0.00 C ATOM 1273 CD GLU A 80 -6.673 -20.391 -26.654 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.034 -21.585 -26.594 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.776 -19.695 -27.686 1.00 0.00 O ATOM 0 H GLU A 80 -5.130 -18.058 -23.858 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.579 -17.379 -24.943 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.918 -19.947 -23.455 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.105 -19.746 -24.728 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.539 -18.851 -25.696 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.352 -20.436 -24.972 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.662 -17.674 -21.691 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.484 -17.456 -20.507 1.00 0.00 C ATOM 1284 C ALA A 81 -9.226 -16.127 -20.591 1.00 0.00 C ATOM 1285 O ALA A 81 -10.447 -16.078 -20.450 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.624 -17.505 -19.252 1.00 0.00 C ATOM 0 H ALA A 81 -6.673 -17.827 -21.496 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.226 -18.253 -20.458 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.250 -17.341 -18.375 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.144 -18.481 -19.178 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.861 -16.728 -19.303 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.479 -15.051 -20.819 1.00 0.00 N ATOM 1293 CA GLU A 82 -9.068 -13.720 -20.920 1.00 0.00 C ATOM 1294 C GLU A 82 -10.091 -13.662 -22.050 1.00 0.00 C ATOM 1295 O GLU A 82 -11.141 -13.033 -21.919 1.00 0.00 O ATOM 1296 CB GLU A 82 -7.977 -12.672 -21.150 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.432 -12.069 -19.866 1.00 0.00 C ATOM 1298 CD GLU A 82 -7.133 -10.588 -19.998 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -6.367 -10.217 -20.912 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -7.664 -9.801 -19.187 1.00 0.00 O ATOM 0 H GLU A 82 -7.466 -15.075 -20.937 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.578 -13.504 -19.981 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.157 -13.129 -21.704 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.378 -11.874 -21.775 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.154 -12.220 -19.063 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.522 -12.596 -19.580 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.776 -14.322 -23.160 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.668 -14.346 -24.313 1.00 0.00 C ATOM 1309 C ILE A 83 -12.033 -14.914 -23.940 1.00 0.00 C ATOM 1310 O ILE A 83 -13.068 -14.386 -24.348 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.076 -15.178 -25.465 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.699 -14.639 -25.857 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.015 -15.169 -26.662 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.971 -15.510 -26.857 1.00 0.00 C ATOM 0 H ILE A 83 -8.910 -14.847 -23.285 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.784 -13.314 -24.644 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.960 -16.208 -25.127 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.815 -13.639 -26.275 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.087 -14.541 -24.960 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.582 -15.761 -27.468 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.976 -15.595 -26.374 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.160 -14.144 -27.003 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.003 -15.067 -27.089 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.823 -16.504 -26.434 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.562 -15.588 -27.770 1.00 0.00 H new ATOM 1326 N GLU A 84 -12.028 -15.991 -23.161 1.00 0.00 N ATOM 1327 CA GLU A 84 -13.267 -16.629 -22.732 1.00 0.00 C ATOM 1328 C GLU A 84 -14.085 -15.691 -21.849 1.00 0.00 C ATOM 1329 O GLU A 84 -15.313 -15.770 -21.810 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.964 -17.925 -21.976 1.00 0.00 C ATOM 1331 CG GLU A 84 -12.035 -18.864 -22.726 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.613 -20.257 -22.881 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.822 -20.369 -23.174 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -11.856 -21.235 -22.709 1.00 0.00 O ATOM 0 H GLU A 84 -11.180 -16.440 -22.814 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.852 -16.864 -23.621 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.517 -17.678 -21.013 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.901 -18.443 -21.769 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.825 -18.450 -23.712 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.084 -18.926 -22.198 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.395 -14.805 -21.140 1.00 0.00 N ATOM 1342 CA TYR A 85 -14.056 -13.853 -20.254 1.00 0.00 C ATOM 1343 C TYR A 85 -14.675 -12.708 -21.049 1.00 0.00 C ATOM 1344 O TYR A 85 -15.885 -12.485 -21.000 1.00 0.00 O ATOM 1345 CB TYR A 85 -13.061 -13.300 -19.232 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.614 -12.163 -18.403 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -14.582 -12.392 -17.432 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.171 -10.860 -18.591 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -15.091 -11.356 -16.673 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -13.673 -9.819 -17.835 1.00 0.00 C ATOM 1351 CZ TYR A 85 -14.633 -10.072 -16.878 1.00 0.00 C ATOM 1352 OH TYR A 85 -15.137 -9.036 -16.124 1.00 0.00 O ATOM 0 H TYR A 85 -12.378 -14.726 -21.161 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.853 -14.378 -19.728 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.750 -14.106 -18.567 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.169 -12.957 -19.755 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.942 -13.397 -17.268 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.421 -10.657 -19.341 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -15.844 -11.551 -15.923 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.316 -8.812 -17.992 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.708 -8.197 -16.393 1.00 0.00 H new ATOM 1362 N ARG A 86 -13.835 -11.985 -21.783 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.298 -10.861 -22.589 1.00 0.00 C ATOM 1364 C ARG A 86 -15.333 -11.318 -23.614 1.00 0.00 C ATOM 1365 O ARG A 86 -16.179 -10.536 -24.046 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.119 -10.196 -23.301 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.436 -11.095 -24.319 1.00 0.00 C ATOM 1368 CD ARG A 86 -12.684 -10.615 -25.741 1.00 0.00 C ATOM 1369 NE ARG A 86 -11.961 -9.381 -26.036 1.00 0.00 N ATOM 1370 CZ ARG A 86 -11.979 -8.785 -27.222 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -12.679 -9.306 -28.220 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -11.294 -7.664 -27.413 1.00 0.00 N ATOM 0 H ARG A 86 -12.831 -12.157 -21.836 1.00 0.00 H new ATOM 0 HA ARG A 86 -14.766 -10.137 -21.923 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -13.470 -9.295 -23.803 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -12.387 -9.882 -22.557 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.364 -11.119 -24.124 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.803 -12.115 -24.209 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.379 -11.391 -26.444 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.752 -10.453 -25.888 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.412 -8.954 -25.290 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.206 -10.168 -28.078 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.690 -8.845 -29.130 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.753 -7.260 -26.648 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.308 -7.207 -28.325 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.257 -12.588 -23.999 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.186 -13.147 -24.974 1.00 0.00 C ATOM 1388 C GLU A 87 -17.625 -13.046 -24.475 1.00 0.00 C ATOM 1389 O GLU A 87 -18.426 -12.278 -25.009 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.837 -14.608 -25.264 1.00 0.00 C ATOM 1391 CG GLU A 87 -14.987 -14.795 -26.510 1.00 0.00 C ATOM 1392 CD GLU A 87 -15.764 -15.407 -27.660 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.729 -14.769 -28.130 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -15.407 -16.524 -28.089 1.00 0.00 O ATOM 0 H GLU A 87 -14.562 -13.249 -23.651 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.098 -12.570 -25.894 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.307 -15.023 -24.407 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.759 -15.178 -25.375 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.586 -13.830 -26.820 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.135 -15.432 -26.272 1.00 0.00 H new ATOM 1401 N ARG A 88 -17.945 -13.825 -23.447 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.286 -13.825 -22.877 1.00 0.00 C ATOM 1403 C ARG A 88 -19.680 -12.425 -22.414 1.00 0.00 C ATOM 1404 O ARG A 88 -20.865 -12.095 -22.340 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.364 -14.803 -21.702 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.692 -14.291 -20.439 1.00 0.00 C ATOM 1407 CD ARG A 88 -17.916 -15.394 -19.736 1.00 0.00 C ATOM 1408 NE ARG A 88 -18.776 -16.510 -19.353 1.00 0.00 N ATOM 1409 CZ ARG A 88 -18.353 -17.558 -18.655 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -17.088 -17.632 -18.264 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -19.196 -18.535 -18.345 1.00 0.00 N ATOM 0 H ARG A 88 -17.293 -14.464 -22.992 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.983 -14.142 -23.652 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.411 -15.016 -21.486 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -18.901 -15.746 -21.993 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -18.017 -13.473 -20.690 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -19.445 -13.886 -19.763 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -17.124 -15.755 -20.393 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -17.433 -14.987 -18.848 1.00 0.00 H new ATOM 0 HE ARG A 88 -19.755 -16.483 -19.637 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -16.437 -16.883 -18.499 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -16.766 -18.438 -17.728 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -20.170 -18.482 -18.643 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -18.870 -19.339 -17.809 1.00 0.00 H new ATOM 1425 N LEU A 89 -18.681 -11.607 -22.104 1.00 0.00 N ATOM 1426 CA LEU A 89 -18.922 -10.243 -21.648 1.00 0.00 C ATOM 1427 C LEU A 89 -19.846 -9.503 -22.610 1.00 0.00 C ATOM 1428 O LEU A 89 -20.724 -8.749 -22.189 1.00 0.00 O ATOM 1429 CB LEU A 89 -17.599 -9.488 -21.512 1.00 0.00 C ATOM 1430 CG LEU A 89 -17.235 -9.021 -20.102 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -17.050 -10.214 -19.176 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -15.975 -8.167 -20.132 1.00 0.00 C ATOM 0 H LEU A 89 -17.696 -11.865 -22.160 1.00 0.00 H new ATOM 0 HA LEU A 89 -19.407 -10.293 -20.673 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.798 -10.130 -21.879 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.633 -8.616 -22.165 1.00 0.00 H new ATOM 0 HG LEU A 89 -18.054 -8.412 -19.718 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.791 -9.863 -18.177 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.976 -10.787 -19.131 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.249 -10.849 -19.556 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.731 -7.843 -19.120 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.148 -8.752 -20.535 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.143 -7.293 -20.762 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.644 -9.725 -23.905 1.00 0.00 N ATOM 1445 CA PHE A 90 -20.460 -9.080 -24.927 1.00 0.00 C ATOM 1446 C PHE A 90 -21.945 -9.311 -24.664 1.00 0.00 C ATOM 1447 O PHE A 90 -22.777 -8.447 -24.942 1.00 0.00 O ATOM 1448 CB PHE A 90 -20.088 -9.608 -26.314 1.00 0.00 C ATOM 1449 CG PHE A 90 -19.301 -8.629 -27.138 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -17.920 -8.572 -27.038 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -19.942 -7.765 -28.011 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -17.193 -7.673 -27.794 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -19.220 -6.864 -28.770 1.00 0.00 C ATOM 1454 CZ PHE A 90 -17.844 -6.817 -28.661 1.00 0.00 C ATOM 0 H PHE A 90 -18.923 -10.346 -24.271 1.00 0.00 H new ATOM 0 HA PHE A 90 -20.265 -8.008 -24.889 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -19.508 -10.524 -26.202 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -21.000 -9.871 -26.850 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -17.406 -9.238 -26.361 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -21.018 -7.796 -28.099 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -16.117 -7.639 -27.707 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -19.731 -6.197 -29.448 1.00 0.00 H new ATOM 0 HZ PHE A 90 -17.278 -6.112 -29.252 1.00 0.00 H new ATOM 1464 N ARG A 91 -22.269 -10.482 -24.126 1.00 0.00 N ATOM 1465 CA ARG A 91 -23.653 -10.828 -23.827 1.00 0.00 C ATOM 1466 C ARG A 91 -24.121 -10.141 -22.547 1.00 0.00 C ATOM 1467 O ARG A 91 -25.292 -9.791 -22.411 1.00 0.00 O ATOM 1468 CB ARG A 91 -23.804 -12.344 -23.689 1.00 0.00 C ATOM 1469 CG ARG A 91 -25.232 -12.833 -23.869 1.00 0.00 C ATOM 1470 CD ARG A 91 -25.341 -13.821 -25.020 1.00 0.00 C ATOM 1471 NE ARG A 91 -24.965 -15.174 -24.619 1.00 0.00 N ATOM 1472 CZ ARG A 91 -24.971 -16.214 -25.444 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -25.332 -16.057 -26.711 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -24.615 -17.414 -25.004 1.00 0.00 N ATOM 0 H ARG A 91 -21.592 -11.207 -23.888 1.00 0.00 H new ATOM 0 HA ARG A 91 -24.274 -10.482 -24.653 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -23.166 -12.833 -24.426 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -23.446 -12.648 -22.705 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -25.575 -13.306 -22.949 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -25.888 -11.983 -24.054 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -26.364 -13.826 -25.397 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -24.700 -13.495 -25.839 1.00 0.00 H new ATOM 0 HE ARG A 91 -24.682 -15.328 -23.651 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -25.606 -15.136 -27.053 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -25.336 -16.857 -27.343 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -24.336 -17.538 -24.031 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -24.620 -18.212 -25.639 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.196 -9.952 -21.611 1.00 0.00 N ATOM 1489 CA ASN A 92 -23.514 -9.308 -20.342 1.00 0.00 C ATOM 1490 C ASN A 92 -23.839 -7.831 -20.548 1.00 0.00 C ATOM 1491 O ASN A 92 -24.640 -7.255 -19.813 1.00 0.00 O ATOM 1492 CB ASN A 92 -22.345 -9.453 -19.366 1.00 0.00 C ATOM 1493 CG ASN A 92 -22.498 -10.655 -18.455 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -23.455 -10.747 -17.686 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -21.553 -11.585 -18.537 1.00 0.00 N ATOM 0 H ASN A 92 -22.221 -10.236 -21.708 1.00 0.00 H new ATOM 0 HA ASN A 92 -24.392 -9.800 -19.923 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -21.415 -9.542 -19.928 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -22.266 -8.550 -18.761 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -21.603 -12.416 -17.948 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -20.777 -11.468 -19.189 1.00 0.00 H new ATOM 1502 N GLN A 93 -23.210 -7.227 -21.551 1.00 0.00 N ATOM 1503 CA GLN A 93 -23.433 -5.818 -21.853 1.00 0.00 C ATOM 1504 C GLN A 93 -24.167 -5.654 -23.179 1.00 0.00 C ATOM 1505 O GLN A 93 -24.429 -6.632 -23.881 1.00 0.00 O ATOM 1506 CB GLN A 93 -22.101 -5.068 -21.898 1.00 0.00 C ATOM 1507 CG GLN A 93 -21.803 -4.279 -20.633 1.00 0.00 C ATOM 1508 CD GLN A 93 -21.405 -2.845 -20.919 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -21.974 -2.194 -21.796 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -20.424 -2.343 -20.179 1.00 0.00 N ATOM 0 H GLN A 93 -22.543 -7.691 -22.168 1.00 0.00 H new ATOM 0 HA GLN A 93 -24.053 -5.397 -21.062 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -21.296 -5.784 -22.068 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -22.106 -4.386 -22.749 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -22.683 -4.286 -19.989 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -21.001 -4.772 -20.083 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -19.980 -2.918 -19.463 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -20.114 -1.382 -20.326 1.00 0.00 H new ATOM 1519 N LYS A 94 -24.498 -4.413 -23.518 1.00 0.00 N ATOM 1520 CA LYS A 94 -25.202 -4.120 -24.761 1.00 0.00 C ATOM 1521 C LYS A 94 -26.584 -4.766 -24.769 1.00 0.00 C ATOM 1522 O LYS A 94 -27.213 -4.895 -25.819 1.00 0.00 O ATOM 1523 CB LYS A 94 -24.390 -4.614 -25.959 1.00 0.00 C ATOM 1524 CG LYS A 94 -24.731 -3.906 -27.259 1.00 0.00 C ATOM 1525 CD LYS A 94 -23.941 -2.617 -27.415 1.00 0.00 C ATOM 1526 CE LYS A 94 -23.645 -2.318 -28.877 1.00 0.00 C ATOM 1527 NZ LYS A 94 -22.330 -1.640 -29.049 1.00 0.00 N ATOM 0 H LYS A 94 -24.290 -3.593 -22.949 1.00 0.00 H new ATOM 0 HA LYS A 94 -25.325 -3.039 -24.834 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -23.329 -4.479 -25.749 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -24.556 -5.684 -26.083 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -24.521 -4.567 -28.100 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -25.798 -3.685 -27.285 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -24.502 -1.790 -26.980 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -23.005 -2.693 -26.861 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -23.652 -3.247 -29.446 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -24.435 -1.688 -29.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -22.165 -1.453 -30.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -22.332 -0.741 -28.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -21.573 -2.252 -28.682 1.00 0.00 H new ATOM 1541 N ILE A 95 -27.051 -5.168 -23.591 1.00 0.00 N ATOM 1542 CA ILE A 95 -28.359 -5.798 -23.464 1.00 0.00 C ATOM 1543 C ILE A 95 -29.299 -4.947 -22.616 1.00 0.00 C ATOM 1544 O ILE A 95 -30.512 -4.941 -22.830 1.00 0.00 O ATOM 1545 CB ILE A 95 -28.250 -7.201 -22.838 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -29.640 -7.822 -22.681 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -27.543 -7.127 -21.493 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -29.619 -9.332 -22.591 1.00 0.00 C ATOM 0 H ILE A 95 -26.543 -5.068 -22.712 1.00 0.00 H new ATOM 0 HA ILE A 95 -28.764 -5.889 -24.472 1.00 0.00 H new ATOM 0 HB ILE A 95 -27.662 -7.835 -23.502 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -30.110 -7.419 -21.784 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -30.260 -7.525 -23.527 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -27.474 -8.126 -21.063 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -26.541 -6.721 -21.631 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -28.107 -6.481 -20.820 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -30.638 -9.704 -22.481 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -29.178 -9.744 -23.498 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -29.026 -9.637 -21.729 1.00 0.00 H new ATOM 1560 N LEU A 96 -28.730 -4.227 -21.655 1.00 0.00 N ATOM 1561 CA LEU A 96 -29.517 -3.369 -20.775 1.00 0.00 C ATOM 1562 C LEU A 96 -30.571 -4.177 -20.026 1.00 0.00 C ATOM 1563 O LEU A 96 -30.691 -5.388 -20.218 1.00 0.00 O ATOM 1564 CB LEU A 96 -30.189 -2.257 -21.582 1.00 0.00 C ATOM 1565 CG LEU A 96 -29.604 -0.855 -21.409 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -29.357 -0.209 -22.764 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -30.531 0.009 -20.566 1.00 0.00 C ATOM 0 H LEU A 96 -27.728 -4.220 -21.465 1.00 0.00 H new ATOM 0 HA LEU A 96 -28.842 -2.923 -20.045 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -30.140 -2.522 -22.638 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -31.244 -2.225 -21.310 1.00 0.00 H new ATOM 0 HG LEU A 96 -28.649 -0.942 -20.891 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -28.941 0.788 -22.621 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -28.655 -0.817 -23.334 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -30.298 -0.135 -23.309 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -30.099 1.003 -20.453 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -31.501 0.088 -21.057 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -30.658 -0.445 -19.583 1.00 0.00 H new ATOM 1579 N ARG A 97 -31.333 -3.500 -19.174 1.00 0.00 N ATOM 1580 CA ARG A 97 -32.378 -4.155 -18.397 1.00 0.00 C ATOM 1581 C ARG A 97 -33.748 -3.569 -18.724 1.00 0.00 C ATOM 1582 O ARG A 97 -33.860 -2.634 -19.517 1.00 0.00 O ATOM 1583 CB ARG A 97 -32.096 -4.013 -16.900 1.00 0.00 C ATOM 1584 CG ARG A 97 -31.595 -5.293 -16.251 1.00 0.00 C ATOM 1585 CD ARG A 97 -31.556 -5.170 -14.735 1.00 0.00 C ATOM 1586 NE ARG A 97 -32.419 -6.153 -14.085 1.00 0.00 N ATOM 1587 CZ ARG A 97 -32.817 -6.059 -12.821 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -32.432 -5.032 -12.076 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -33.601 -6.994 -12.300 1.00 0.00 N ATOM 0 H ARG A 97 -31.246 -2.498 -19.004 1.00 0.00 H new ATOM 0 HA ARG A 97 -32.382 -5.213 -18.661 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -31.356 -3.226 -16.751 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -33.008 -3.693 -16.396 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -32.242 -6.123 -16.533 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -30.598 -5.525 -16.624 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -30.531 -5.300 -14.387 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -31.866 -4.166 -14.444 1.00 0.00 H new ATOM 0 HE ARG A 97 -32.733 -6.955 -14.631 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -31.829 -4.312 -12.473 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -32.739 -4.962 -11.106 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -33.899 -7.786 -12.870 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -33.906 -6.921 -11.329 1.00 0.00 H new ATOM 1603 N GLU A 98 -34.787 -4.125 -18.109 1.00 0.00 N ATOM 1604 CA GLU A 98 -36.150 -3.658 -18.337 1.00 0.00 C ATOM 1605 C GLU A 98 -36.656 -2.854 -17.143 1.00 0.00 C ATOM 1606 O GLU A 98 -35.990 -2.768 -16.111 1.00 0.00 O ATOM 1607 CB GLU A 98 -37.082 -4.842 -18.601 1.00 0.00 C ATOM 1608 CG GLU A 98 -37.344 -5.094 -20.076 1.00 0.00 C ATOM 1609 CD GLU A 98 -37.009 -6.513 -20.494 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -37.788 -7.429 -20.158 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -35.968 -6.707 -21.157 1.00 0.00 O ATOM 0 H GLU A 98 -34.711 -4.899 -17.449 1.00 0.00 H new ATOM 0 HA GLU A 98 -36.143 -3.010 -19.213 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -36.649 -5.740 -18.159 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -38.032 -4.665 -18.097 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -38.393 -4.893 -20.294 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -36.755 -4.395 -20.670 1.00 0.00 H new ATOM 1618 N TYR A 99 -37.837 -2.266 -17.292 1.00 0.00 N ATOM 1619 CA TYR A 99 -38.433 -1.466 -16.228 1.00 0.00 C ATOM 1620 C TYR A 99 -38.885 -2.350 -15.070 1.00 0.00 C ATOM 1621 O TYR A 99 -38.881 -3.577 -15.173 1.00 0.00 O ATOM 1622 CB TYR A 99 -39.619 -0.665 -16.766 1.00 0.00 C ATOM 1623 CG TYR A 99 -40.710 -1.525 -17.363 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -41.669 -2.124 -16.556 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -40.780 -1.740 -18.734 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -42.667 -2.912 -17.098 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -41.775 -2.525 -19.284 1.00 0.00 C ATOM 1628 CZ TYR A 99 -42.716 -3.108 -18.462 1.00 0.00 C ATOM 1629 OH TYR A 99 -43.708 -3.892 -19.006 1.00 0.00 O ATOM 0 H TYR A 99 -38.401 -2.328 -18.139 1.00 0.00 H new ATOM 0 HA TYR A 99 -37.675 -0.775 -15.860 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -40.040 -0.068 -15.957 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -39.262 0.032 -17.524 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -41.634 -1.971 -15.487 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -40.044 -1.286 -19.381 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -43.404 -3.372 -16.457 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -41.816 -2.681 -20.352 1.00 0.00 H new ATOM 0 HH TYR A 99 -43.600 -3.927 -19.979 1.00 0.00 H new ATOM 1639 N ARG A 100 -39.275 -1.717 -13.968 1.00 0.00 N ATOM 1640 CA ARG A 100 -39.730 -2.445 -12.789 1.00 0.00 C ATOM 1641 C ARG A 100 -41.239 -2.305 -12.613 1.00 0.00 C ATOM 1642 O ARG A 100 -41.830 -1.300 -13.009 1.00 0.00 O ATOM 1643 CB ARG A 100 -39.010 -1.935 -11.540 1.00 0.00 C ATOM 1644 CG ARG A 100 -37.645 -2.567 -11.323 1.00 0.00 C ATOM 1645 CD ARG A 100 -37.616 -3.410 -10.057 1.00 0.00 C ATOM 1646 NE ARG A 100 -36.337 -4.093 -9.884 1.00 0.00 N ATOM 1647 CZ ARG A 100 -35.967 -4.685 -8.753 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -36.775 -4.677 -7.702 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -34.787 -5.286 -8.673 1.00 0.00 N ATOM 0 H ARG A 100 -39.285 -0.702 -13.867 1.00 0.00 H new ATOM 0 HA ARG A 100 -39.495 -3.500 -12.930 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -38.893 -0.854 -11.615 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -39.633 -2.128 -10.667 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -37.390 -3.189 -12.181 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -36.887 -1.786 -11.259 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -37.807 -2.773 -9.193 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -38.418 -4.147 -10.094 1.00 0.00 H new ATOM 0 HE ARG A 100 -35.692 -4.117 -10.674 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -37.683 -4.216 -7.760 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -36.489 -5.132 -6.835 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -34.163 -5.294 -9.480 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -34.504 -5.740 -7.805 1.00 0.00 H new ATOM 1663 N ASP A 101 -41.856 -3.319 -12.017 1.00 0.00 N ATOM 1664 CA ASP A 101 -43.296 -3.309 -11.787 1.00 0.00 C ATOM 1665 C ASP A 101 -44.055 -3.169 -13.103 1.00 0.00 C ATOM 1666 O ASP A 101 -43.739 -3.838 -14.088 1.00 0.00 O ATOM 1667 CB ASP A 101 -43.676 -2.169 -10.842 1.00 0.00 C ATOM 1668 CG ASP A 101 -43.847 -2.637 -9.410 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -42.823 -2.877 -8.737 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -45.006 -2.762 -8.962 1.00 0.00 O ATOM 0 H ASP A 101 -41.382 -4.158 -11.684 1.00 0.00 H new ATOM 0 HA ASP A 101 -43.572 -4.258 -11.327 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -42.907 -1.398 -10.880 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -44.604 -1.711 -11.185 1.00 0.00 H new TER 1675 ASP A 101