USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1068 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 93 THR OG1 : rot 97:sc= 0.946 USER MOD Set 1.2: A 103 HIS : no HE2:sc= 0.797 K(o=1.7,f=-0.41) USER MOD Set 2.1: A 27 TYR OH : rot -3:sc= 0.207 USER MOD Set 2.2: A 140 GLN : amide:sc= -1.88 K(o=-1.7,f=-4.6!) USER MOD Single : A 7 MET CE :methyl 158:sc= 0 (180deg=-0.235) USER MOD Single : A 8 THR OG1 : rot 22:sc= 0.0625 USER MOD Single : A 9 THR OG1 : rot 40:sc= 0.133 USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 16 GLN : amide:sc= -1.13 X(o=-1.1,f=-1.6) USER MOD Single : A 17 THR OG1 : rot -11:sc= 0.298 USER MOD Single : A 19 GLN : amide:sc=-0.00677 X(o=-0.0068,f=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.197 X(o=-0.2,f=-0.7) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= -0.262 USER MOD Single : A 64 LYS NZ :NH3+ -136:sc= -0.609 (180deg=-1.69!) USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 68 HIS : no HD1:sc= -0.149 K(o=-0.15,f=-0.79) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl -140:sc= -0.0517 (180deg=-0.903) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc=-0.00771 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 109 THR OG1 : rot -91:sc= -0.948 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -0.609 X(o=-0.61,f=-0.98) USER MOD Single : A 119 ASN : amide:sc= -0.0197 K(o=-0.02,f=-1) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 15:sc= -1.1 USER MOD Single : A 141 MET CE :methyl -115:sc= -0.0184 (180deg=-0.908) USER MOD Single : A 142 THR OG1 : rot 31:sc= 0.0351 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00721 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -0.963 X(o=-0.96,f=-0.49) USER MOD Single : A 150 ASN : amide:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : A 152 ASN : amide:sc= -0.206 X(o=-0.21,f=-0.25) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N ALA A 3 -6.570 -35.724 15.940 1.00 0.00 N ATOM 35 CA ALA A 3 -7.159 -34.825 16.925 1.00 0.00 C ATOM 36 C ALA A 3 -6.099 -34.265 17.870 1.00 0.00 C ATOM 37 O ALA A 3 -6.305 -33.227 18.500 1.00 0.00 O ATOM 38 CB ALA A 3 -8.243 -35.546 17.713 1.00 0.00 C ATOM 0 HA ALA A 3 -7.606 -33.987 16.391 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -8.675 -34.864 18.445 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -9.022 -35.888 17.031 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.809 -36.404 18.227 1.00 0.00 H new ATOM 44 N ASP A 4 -4.966 -34.954 17.965 1.00 0.00 N ATOM 45 CA ASP A 4 -3.877 -34.520 18.834 1.00 0.00 C ATOM 46 C ASP A 4 -3.109 -33.368 18.198 1.00 0.00 C ATOM 47 O ASP A 4 -2.877 -32.337 18.831 1.00 0.00 O ATOM 48 CB ASP A 4 -2.929 -35.685 19.125 1.00 0.00 C ATOM 49 CG ASP A 4 -2.498 -36.412 17.865 1.00 0.00 C ATOM 50 OD1 ASP A 4 -1.277 -36.521 17.630 1.00 0.00 O ATOM 51 OD2 ASP A 4 -3.384 -36.875 17.116 1.00 0.00 O ATOM 0 H ASP A 4 -4.778 -35.815 17.451 1.00 0.00 H new ATOM 0 HA ASP A 4 -4.308 -34.174 19.774 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -2.047 -35.310 19.644 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -3.419 -36.389 19.797 1.00 0.00 H new ATOM 57 N GLU A 5 -2.721 -33.548 16.941 1.00 0.00 N ATOM 58 CA GLU A 5 -1.983 -32.524 16.213 1.00 0.00 C ATOM 59 C GLU A 5 -2.928 -31.443 15.696 1.00 0.00 C ATOM 60 O GLU A 5 -2.523 -30.299 15.487 1.00 0.00 O ATOM 61 CB GLU A 5 -1.216 -33.149 15.047 1.00 0.00 C ATOM 62 CG GLU A 5 -0.275 -34.265 15.466 1.00 0.00 C ATOM 63 CD GLU A 5 0.391 -34.942 14.284 1.00 0.00 C ATOM 64 OE1 GLU A 5 1.488 -35.512 14.466 1.00 0.00 O ATOM 65 OE2 GLU A 5 -0.185 -34.902 13.177 1.00 0.00 O ATOM 0 H GLU A 5 -2.906 -34.395 16.404 1.00 0.00 H new ATOM 0 HA GLU A 5 -1.271 -32.064 16.899 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -1.930 -33.540 14.322 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -0.642 -32.372 14.542 1.00 0.00 H new ATOM 0 HG2 GLU A 5 0.491 -33.860 16.127 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -0.830 -35.007 16.039 1.00 0.00 H new ATOM 73 N TRP A 6 -4.189 -31.814 15.491 1.00 0.00 N ATOM 74 CA TRP A 6 -5.190 -30.874 14.997 1.00 0.00 C ATOM 75 C TRP A 6 -5.502 -29.809 16.042 1.00 0.00 C ATOM 76 O TRP A 6 -5.807 -28.665 15.705 1.00 0.00 O ATOM 77 CB TRP A 6 -6.470 -31.617 14.611 1.00 0.00 C ATOM 78 CG TRP A 6 -7.421 -30.782 13.807 1.00 0.00 C ATOM 79 CD1 TRP A 6 -8.408 -29.972 14.288 1.00 0.00 C ATOM 80 CD2 TRP A 6 -7.474 -30.677 12.380 1.00 0.00 C ATOM 81 NE1 TRP A 6 -9.072 -29.369 13.247 1.00 0.00 N ATOM 82 CE2 TRP A 6 -8.516 -29.786 12.065 1.00 0.00 C ATOM 83 CE3 TRP A 6 -6.740 -31.250 11.337 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -8.844 -29.454 10.753 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -7.065 -30.921 10.035 1.00 0.00 C ATOM 86 CH2 TRP A 6 -8.109 -30.029 9.752 1.00 0.00 C ATOM 0 H TRP A 6 -4.541 -32.757 15.659 1.00 0.00 H new ATOM 0 HA TRP A 6 -4.783 -30.381 14.114 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -6.207 -32.507 14.040 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -6.972 -31.956 15.517 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -8.634 -29.826 15.334 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -9.851 -28.717 13.339 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -5.933 -31.937 11.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -9.649 -28.768 10.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -6.505 -31.358 9.221 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -8.338 -29.791 8.724 1.00 0.00 H new ATOM 97 N MET A 7 -5.427 -30.192 17.313 1.00 0.00 N ATOM 98 CA MET A 7 -5.703 -29.267 18.408 1.00 0.00 C ATOM 99 C MET A 7 -4.518 -28.340 18.651 1.00 0.00 C ATOM 100 O MET A 7 -4.690 -27.193 19.068 1.00 0.00 O ATOM 101 CB MET A 7 -6.033 -30.041 19.685 1.00 0.00 C ATOM 102 CG MET A 7 -4.900 -30.931 20.169 1.00 0.00 C ATOM 103 SD MET A 7 -5.025 -31.324 21.924 1.00 0.00 S ATOM 104 CE MET A 7 -3.521 -32.266 22.167 1.00 0.00 C ATOM 0 H MET A 7 -5.178 -31.135 17.610 1.00 0.00 H new ATOM 0 HA MET A 7 -6.563 -28.658 18.128 1.00 0.00 H new ATOM 0 HB2 MET A 7 -6.289 -29.333 20.473 1.00 0.00 H new ATOM 0 HB3 MET A 7 -6.916 -30.655 19.509 1.00 0.00 H new ATOM 0 HG2 MET A 7 -4.899 -31.856 19.593 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.948 -30.436 19.979 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.247 -32.249 23.222 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.682 -33.297 21.851 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.717 -31.827 21.576 1.00 0.00 H new ATOM 114 N THR A 8 -3.315 -28.840 18.389 1.00 0.00 N ATOM 115 CA THR A 8 -2.102 -28.054 18.581 1.00 0.00 C ATOM 116 C THR A 8 -2.016 -26.926 17.558 1.00 0.00 C ATOM 117 O THR A 8 -1.646 -25.801 17.891 1.00 0.00 O ATOM 118 CB THR A 8 -0.867 -28.950 18.475 1.00 0.00 C ATOM 119 OG1 THR A 8 -1.005 -29.871 17.408 1.00 0.00 O ATOM 120 CG2 THR A 8 -0.593 -29.744 19.735 1.00 0.00 C ATOM 0 H THR A 8 -3.154 -29.786 18.043 1.00 0.00 H new ATOM 0 HA THR A 8 -2.139 -27.614 19.577 1.00 0.00 H new ATOM 0 HB THR A 8 -0.032 -28.271 18.304 1.00 0.00 H new ATOM 0 HG1 THR A 8 -1.668 -29.535 16.769 1.00 0.00 H new ATOM 0 HG21 THR A 8 0.296 -30.358 19.592 1.00 0.00 H new ATOM 0 HG22 THR A 8 -0.431 -29.060 20.568 1.00 0.00 H new ATOM 0 HG23 THR A 8 -1.446 -30.386 19.953 1.00 0.00 H new ATOM 128 N THR A 9 -2.359 -27.236 16.312 1.00 0.00 N ATOM 129 CA THR A 9 -2.320 -26.249 15.240 1.00 0.00 C ATOM 130 C THR A 9 -3.441 -25.226 15.400 1.00 0.00 C ATOM 131 O THR A 9 -3.272 -24.050 15.079 1.00 0.00 O ATOM 132 CB THR A 9 -2.435 -26.938 13.879 1.00 0.00 C ATOM 133 OG1 THR A 9 -3.232 -28.105 13.974 1.00 0.00 O ATOM 134 CG2 THR A 9 -1.097 -27.343 13.299 1.00 0.00 C ATOM 0 H THR A 9 -2.667 -28.163 16.020 1.00 0.00 H new ATOM 0 HA THR A 9 -1.365 -25.727 15.296 1.00 0.00 H new ATOM 0 HB THR A 9 -2.891 -26.200 13.219 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.991 -27.935 14.570 1.00 0.00 H new ATOM 0 HG21 THR A 9 -1.250 -27.826 12.334 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.475 -26.458 13.167 1.00 0.00 H new ATOM 0 HG23 THR A 9 -0.601 -28.037 13.978 1.00 0.00 H new ATOM 142 N PHE A 10 -4.585 -25.684 15.897 1.00 0.00 N ATOM 143 CA PHE A 10 -5.735 -24.811 16.100 1.00 0.00 C ATOM 144 C PHE A 10 -5.531 -23.915 17.319 1.00 0.00 C ATOM 145 O PHE A 10 -6.029 -22.791 17.366 1.00 0.00 O ATOM 146 CB PHE A 10 -7.009 -25.641 16.266 1.00 0.00 C ATOM 147 CG PHE A 10 -8.143 -25.183 15.394 1.00 0.00 C ATOM 148 CD1 PHE A 10 -8.645 -23.897 15.506 1.00 0.00 C ATOM 149 CD2 PHE A 10 -8.706 -26.040 14.461 1.00 0.00 C ATOM 150 CE1 PHE A 10 -9.687 -23.473 14.704 1.00 0.00 C ATOM 151 CE2 PHE A 10 -9.749 -25.621 13.656 1.00 0.00 C ATOM 152 CZ PHE A 10 -10.240 -24.336 13.779 1.00 0.00 C ATOM 0 H PHE A 10 -4.740 -26.655 16.167 1.00 0.00 H new ATOM 0 HA PHE A 10 -5.837 -24.176 15.220 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -6.786 -26.683 16.039 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -7.325 -25.602 17.309 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.217 -23.218 16.229 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -8.326 -27.046 14.362 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.069 -22.467 14.801 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -10.179 -26.297 12.932 1.00 0.00 H new ATOM 0 HZ PHE A 10 -11.056 -24.007 13.152 1.00 0.00 H new ATOM 162 N ARG A 11 -4.798 -24.423 18.305 1.00 0.00 N ATOM 163 CA ARG A 11 -4.530 -23.671 19.527 1.00 0.00 C ATOM 164 C ARG A 11 -3.873 -22.329 19.211 1.00 0.00 C ATOM 165 O ARG A 11 -4.067 -21.348 19.930 1.00 0.00 O ATOM 166 CB ARG A 11 -3.633 -24.484 20.463 1.00 0.00 C ATOM 167 CG ARG A 11 -4.059 -24.418 21.920 1.00 0.00 C ATOM 168 CD ARG A 11 -2.978 -24.962 22.842 1.00 0.00 C ATOM 169 NE ARG A 11 -3.507 -25.310 24.159 1.00 0.00 N ATOM 170 CZ ARG A 11 -4.170 -26.434 24.418 1.00 0.00 C ATOM 171 NH1 ARG A 11 -4.390 -27.321 23.454 1.00 0.00 N ATOM 172 NH2 ARG A 11 -4.617 -26.673 25.643 1.00 0.00 N ATOM 0 H ARG A 11 -4.379 -25.353 18.282 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.482 -23.479 20.021 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.633 -25.525 20.140 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -2.608 -24.123 20.376 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -4.282 -23.385 22.189 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -4.977 -24.989 22.058 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -2.525 -25.844 22.389 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -2.188 -24.219 22.953 1.00 0.00 H new ATOM 0 HE ARG A 11 -3.359 -24.653 24.925 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -4.050 -27.142 22.509 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -4.899 -28.181 23.659 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -4.453 -25.995 26.387 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -5.125 -27.535 25.841 1.00 0.00 H new ATOM 186 N GLU A 12 -3.095 -22.294 18.134 1.00 0.00 N ATOM 187 CA GLU A 12 -2.411 -21.072 17.726 1.00 0.00 C ATOM 188 C GLU A 12 -3.384 -20.097 17.070 1.00 0.00 C ATOM 189 O GLU A 12 -3.280 -18.884 17.252 1.00 0.00 O ATOM 190 CB GLU A 12 -1.270 -21.399 16.760 1.00 0.00 C ATOM 191 CG GLU A 12 -0.210 -20.313 16.682 1.00 0.00 C ATOM 192 CD GLU A 12 -0.338 -19.464 15.432 1.00 0.00 C ATOM 193 OE1 GLU A 12 -1.443 -18.937 15.183 1.00 0.00 O ATOM 194 OE2 GLU A 12 0.666 -19.323 14.704 1.00 0.00 O ATOM 0 H GLU A 12 -2.923 -23.097 17.529 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.999 -20.601 18.618 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -0.800 -22.333 17.069 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -1.683 -21.564 15.765 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -0.285 -19.673 17.561 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.778 -20.772 16.706 1.00 0.00 H new ATOM 202 N ASN A 13 -4.329 -20.636 16.307 1.00 0.00 N ATOM 203 CA ASN A 13 -5.320 -19.814 15.623 1.00 0.00 C ATOM 204 C ASN A 13 -6.301 -19.203 16.618 1.00 0.00 C ATOM 205 O ASN A 13 -6.620 -18.017 16.541 1.00 0.00 O ATOM 206 CB ASN A 13 -6.077 -20.648 14.588 1.00 0.00 C ATOM 207 CG ASN A 13 -5.221 -20.993 13.385 1.00 0.00 C ATOM 208 OD1 ASN A 13 -4.026 -20.697 13.353 1.00 0.00 O ATOM 209 ND2 ASN A 13 -5.829 -21.622 12.386 1.00 0.00 N ATOM 0 H ASN A 13 -4.429 -21.638 16.147 1.00 0.00 H new ATOM 0 HA ASN A 13 -4.796 -19.005 15.115 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.430 -21.567 15.055 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -6.959 -20.099 14.258 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.304 -21.879 11.550 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.821 -21.848 12.454 1.00 0.00 H new ATOM 216 N ILE A 14 -6.780 -20.022 17.549 1.00 0.00 N ATOM 217 CA ILE A 14 -7.726 -19.561 18.557 1.00 0.00 C ATOM 218 C ILE A 14 -7.088 -18.528 19.481 1.00 0.00 C ATOM 219 O ILE A 14 -7.744 -17.582 19.914 1.00 0.00 O ATOM 220 CB ILE A 14 -8.261 -20.731 19.405 1.00 0.00 C ATOM 221 CG1 ILE A 14 -7.108 -21.449 20.110 1.00 0.00 C ATOM 222 CG2 ILE A 14 -9.041 -21.704 18.533 1.00 0.00 C ATOM 223 CD1 ILE A 14 -7.561 -22.568 21.023 1.00 0.00 C ATOM 0 H ILE A 14 -6.528 -21.007 17.626 1.00 0.00 H new ATOM 0 HA ILE A 14 -8.557 -19.101 18.022 1.00 0.00 H new ATOM 0 HB ILE A 14 -8.934 -20.331 20.163 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.430 -21.855 19.359 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -6.540 -20.723 20.692 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -9.412 -22.525 19.146 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -9.882 -21.186 18.072 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -8.388 -22.099 17.755 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.692 -23.032 21.489 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -8.215 -22.165 21.796 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -8.103 -23.314 20.442 1.00 0.00 H new ATOM 235 N ALA A 15 -5.806 -18.717 19.777 1.00 0.00 N ATOM 236 CA ALA A 15 -5.080 -17.802 20.649 1.00 0.00 C ATOM 237 C ALA A 15 -5.047 -16.394 20.065 1.00 0.00 C ATOM 238 O ALA A 15 -5.481 -15.435 20.704 1.00 0.00 O ATOM 239 CB ALA A 15 -3.666 -18.311 20.886 1.00 0.00 C ATOM 0 H ALA A 15 -5.249 -19.496 19.426 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.604 -17.757 21.604 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.135 -17.618 21.539 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -3.707 -19.294 21.356 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -3.142 -18.386 19.933 1.00 0.00 H new ATOM 245 N GLN A 16 -4.530 -16.276 18.845 1.00 0.00 N ATOM 246 CA GLN A 16 -4.440 -14.984 18.174 1.00 0.00 C ATOM 247 C GLN A 16 -5.810 -14.320 18.080 1.00 0.00 C ATOM 248 O GLN A 16 -5.965 -13.142 18.401 1.00 0.00 O ATOM 249 CB GLN A 16 -3.843 -15.154 16.775 1.00 0.00 C ATOM 250 CG GLN A 16 -2.342 -14.924 16.720 1.00 0.00 C ATOM 251 CD GLN A 16 -1.586 -15.764 17.730 1.00 0.00 C ATOM 252 OE1 GLN A 16 -1.938 -16.916 17.985 1.00 0.00 O ATOM 253 NE2 GLN A 16 -0.538 -15.191 18.311 1.00 0.00 N ATOM 0 H GLN A 16 -4.167 -17.059 18.302 1.00 0.00 H new ATOM 0 HA GLN A 16 -3.787 -14.341 18.765 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.061 -16.160 16.416 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.333 -14.459 16.093 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.979 -15.154 15.718 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.133 -13.870 16.901 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -0.281 -14.234 18.070 1.00 0.00 H new ATOM 0 HE22 GLN A 16 0.010 -15.708 18.998 1.00 0.00 H new ATOM 262 N THR A 17 -6.803 -15.086 17.637 1.00 0.00 N ATOM 263 CA THR A 17 -8.162 -14.573 17.503 1.00 0.00 C ATOM 264 C THR A 17 -8.724 -14.161 18.860 1.00 0.00 C ATOM 265 O THR A 17 -9.551 -13.254 18.949 1.00 0.00 O ATOM 266 CB THR A 17 -9.066 -15.626 16.862 1.00 0.00 C ATOM 267 OG1 THR A 17 -9.106 -16.801 17.652 1.00 0.00 O ATOM 268 CG2 THR A 17 -8.626 -16.024 15.469 1.00 0.00 C ATOM 0 H THR A 17 -6.692 -16.063 17.365 1.00 0.00 H new ATOM 0 HA THR A 17 -8.130 -13.693 16.861 1.00 0.00 H new ATOM 0 HB THR A 17 -10.050 -15.161 16.796 1.00 0.00 H new ATOM 0 HG1 THR A 17 -8.412 -16.755 18.343 1.00 0.00 H new ATOM 0 HG21 THR A 17 -9.310 -16.774 15.072 1.00 0.00 H new ATOM 0 HG22 THR A 17 -8.632 -15.147 14.821 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.618 -16.438 15.510 1.00 0.00 H new ATOM 276 N TRP A 18 -8.268 -14.831 19.914 1.00 0.00 N ATOM 277 CA TRP A 18 -8.727 -14.532 21.266 1.00 0.00 C ATOM 278 C TRP A 18 -8.423 -13.084 21.635 1.00 0.00 C ATOM 279 O TRP A 18 -9.317 -12.329 22.014 1.00 0.00 O ATOM 280 CB TRP A 18 -8.066 -15.478 22.272 1.00 0.00 C ATOM 281 CG TRP A 18 -9.022 -16.023 23.289 1.00 0.00 C ATOM 282 CD1 TRP A 18 -9.114 -15.665 24.604 1.00 0.00 C ATOM 283 CD2 TRP A 18 -10.021 -17.028 23.076 1.00 0.00 C ATOM 284 NE1 TRP A 18 -10.109 -16.384 25.220 1.00 0.00 N ATOM 285 CE2 TRP A 18 -10.681 -17.227 24.303 1.00 0.00 C ATOM 286 CE3 TRP A 18 -10.422 -17.777 21.966 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -11.717 -18.145 24.450 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -11.451 -18.686 22.113 1.00 0.00 C ATOM 289 CH2 TRP A 18 -12.089 -18.864 23.347 1.00 0.00 C ATOM 0 H TRP A 18 -7.582 -15.584 19.858 1.00 0.00 H new ATOM 0 HA TRP A 18 -9.807 -14.677 21.298 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -7.607 -16.307 21.733 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.263 -14.948 22.785 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -8.495 -14.925 25.089 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -10.378 -16.304 26.200 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -9.936 -17.647 21.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -12.210 -18.285 25.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -11.769 -19.270 21.262 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -12.891 -19.583 23.430 1.00 0.00 H new ATOM 300 N GLN A 19 -7.154 -12.704 21.520 1.00 0.00 N ATOM 301 CA GLN A 19 -6.735 -11.345 21.842 1.00 0.00 C ATOM 302 C GLN A 19 -7.376 -10.339 20.891 1.00 0.00 C ATOM 303 O GLN A 19 -8.316 -9.634 21.259 1.00 0.00 O ATOM 304 CB GLN A 19 -5.209 -11.232 21.779 1.00 0.00 C ATOM 305 CG GLN A 19 -4.686 -9.840 22.095 1.00 0.00 C ATOM 306 CD GLN A 19 -4.153 -9.724 23.509 1.00 0.00 C ATOM 307 OE1 GLN A 19 -2.948 -9.597 23.723 1.00 0.00 O ATOM 308 NE2 GLN A 19 -5.053 -9.768 24.486 1.00 0.00 N ATOM 0 H GLN A 19 -6.401 -13.316 21.207 1.00 0.00 H new ATOM 0 HA GLN A 19 -7.066 -11.117 22.855 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -4.772 -11.943 22.480 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.873 -11.519 20.783 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -3.894 -9.585 21.390 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -5.486 -9.114 21.952 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.043 -9.874 24.263 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -4.754 -9.695 25.458 1.00 0.00 H new ATOM 334 N PRO A 21 -5.241 -9.043 17.509 1.00 0.00 N ATOM 335 CA PRO A 21 -4.320 -9.035 16.369 1.00 0.00 C ATOM 336 C PRO A 21 -3.887 -10.439 15.963 1.00 0.00 C ATOM 337 O PRO A 21 -3.853 -11.354 16.787 1.00 0.00 O ATOM 338 CB PRO A 21 -3.126 -8.240 16.895 1.00 0.00 C ATOM 339 CG PRO A 21 -3.131 -8.484 18.364 1.00 0.00 C ATOM 340 CD PRO A 21 -4.577 -8.627 18.760 1.00 0.00 C ATOM 0 HA PRO A 21 -4.777 -8.611 15.475 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -2.194 -8.576 16.440 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.226 -7.178 16.669 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -2.569 -9.384 18.611 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.661 -7.658 18.898 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -4.705 -9.369 19.548 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -4.984 -7.689 19.137 1.00 0.00 H new ATOM 348 N GLU A 22 -3.553 -10.603 14.686 1.00 0.00 N ATOM 349 CA GLU A 22 -3.119 -11.896 14.169 1.00 0.00 C ATOM 350 C GLU A 22 -1.633 -11.870 13.826 1.00 0.00 C ATOM 351 O GLU A 22 -0.941 -12.883 13.938 1.00 0.00 O ATOM 352 CB GLU A 22 -3.936 -12.275 12.932 1.00 0.00 C ATOM 353 CG GLU A 22 -5.178 -13.090 13.250 1.00 0.00 C ATOM 354 CD GLU A 22 -5.397 -14.226 12.271 1.00 0.00 C ATOM 355 OE1 GLU A 22 -5.527 -13.949 11.059 1.00 0.00 O ATOM 356 OE2 GLU A 22 -5.438 -15.393 12.713 1.00 0.00 O ATOM 0 H GLU A 22 -3.575 -9.857 13.991 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.282 -12.645 14.944 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.232 -11.365 12.410 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.304 -12.843 12.249 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -5.093 -13.496 14.258 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.049 -12.435 13.242 1.00 0.00 H new ATOM 364 N HIS A 23 -1.149 -10.706 13.406 1.00 0.00 N ATOM 365 CA HIS A 23 0.255 -10.546 13.046 1.00 0.00 C ATOM 366 C HIS A 23 0.708 -9.105 13.258 1.00 0.00 C ATOM 367 O HIS A 23 -0.073 -8.254 13.682 1.00 0.00 O ATOM 368 CB HIS A 23 0.480 -10.955 11.590 1.00 0.00 C ATOM 369 CG HIS A 23 0.652 -12.431 11.403 1.00 0.00 C ATOM 370 ND1 HIS A 23 1.398 -13.217 12.256 1.00 0.00 N ATOM 371 CD2 HIS A 23 0.166 -13.267 10.454 1.00 0.00 C ATOM 372 CE1 HIS A 23 1.367 -14.470 11.839 1.00 0.00 C ATOM 373 NE2 HIS A 23 0.625 -14.527 10.748 1.00 0.00 N ATOM 0 H HIS A 23 -1.709 -9.859 13.306 1.00 0.00 H new ATOM 0 HA HIS A 23 0.847 -11.194 13.693 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.366 -10.617 10.991 1.00 0.00 H new ATOM 0 HB3 HIS A 23 1.364 -10.443 11.210 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -0.465 -12.993 9.621 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.864 -15.305 12.310 1.00 0.00 H new ATOM 0 HE2 HIS A 23 0.425 -15.371 10.211 1.00 0.00 H new ATOM 382 N TYR A 24 1.977 -8.838 12.962 1.00 0.00 N ATOM 383 CA TYR A 24 2.532 -7.498 13.122 1.00 0.00 C ATOM 384 C TYR A 24 3.291 -7.070 11.869 1.00 0.00 C ATOM 385 O TYR A 24 3.951 -7.883 11.222 1.00 0.00 O ATOM 386 CB TYR A 24 3.459 -7.451 14.339 1.00 0.00 C ATOM 387 CG TYR A 24 2.843 -6.776 15.543 1.00 0.00 C ATOM 388 CD1 TYR A 24 1.843 -7.402 16.278 1.00 0.00 C ATOM 389 CD2 TYR A 24 3.260 -5.514 15.946 1.00 0.00 C ATOM 390 CE1 TYR A 24 1.278 -6.788 17.379 1.00 0.00 C ATOM 391 CE2 TYR A 24 2.701 -4.894 17.047 1.00 0.00 C ATOM 392 CZ TYR A 24 1.710 -5.535 17.759 1.00 0.00 C ATOM 393 OH TYR A 24 1.148 -4.920 18.856 1.00 0.00 O ATOM 0 H TYR A 24 2.639 -9.530 12.611 1.00 0.00 H new ATOM 0 HA TYR A 24 1.706 -6.804 13.277 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.743 -8.468 14.609 1.00 0.00 H new ATOM 0 HB3 TYR A 24 4.375 -6.926 14.068 1.00 0.00 H new ATOM 0 HD1 TYR A 24 1.502 -8.384 15.984 1.00 0.00 H new ATOM 0 HD2 TYR A 24 4.035 -5.008 15.389 1.00 0.00 H new ATOM 0 HE1 TYR A 24 0.501 -7.287 17.940 1.00 0.00 H new ATOM 0 HE2 TYR A 24 3.038 -3.913 17.348 1.00 0.00 H new ATOM 0 HH TYR A 24 1.565 -4.043 18.989 1.00 0.00 H new ATOM 403 N ASP A 25 3.191 -5.788 11.534 1.00 0.00 N ATOM 404 CA ASP A 25 3.867 -5.249 10.360 1.00 0.00 C ATOM 405 C ASP A 25 4.530 -3.914 10.680 1.00 0.00 C ATOM 406 O ASP A 25 4.216 -3.280 11.688 1.00 0.00 O ATOM 407 CB ASP A 25 2.875 -5.076 9.208 1.00 0.00 C ATOM 408 CG ASP A 25 2.162 -6.367 8.860 1.00 0.00 C ATOM 409 OD1 ASP A 25 0.915 -6.360 8.797 1.00 0.00 O ATOM 410 OD2 ASP A 25 2.852 -7.388 8.647 1.00 0.00 O ATOM 0 H ASP A 25 2.648 -5.103 12.059 1.00 0.00 H new ATOM 0 HA ASP A 25 4.640 -5.956 10.060 1.00 0.00 H new ATOM 0 HB2 ASP A 25 2.139 -4.319 9.477 1.00 0.00 H new ATOM 0 HB3 ASP A 25 3.404 -4.708 8.329 1.00 0.00 H new ATOM 416 N LEU A 26 5.449 -3.492 9.817 1.00 0.00 N ATOM 417 CA LEU A 26 6.157 -2.232 10.010 1.00 0.00 C ATOM 418 C LEU A 26 6.220 -1.438 8.709 1.00 0.00 C ATOM 419 O LEU A 26 6.532 -1.986 7.650 1.00 0.00 O ATOM 420 CB LEU A 26 7.571 -2.493 10.536 1.00 0.00 C ATOM 421 CG LEU A 26 7.966 -1.674 11.765 1.00 0.00 C ATOM 422 CD1 LEU A 26 7.833 -0.186 11.481 1.00 0.00 C ATOM 423 CD2 LEU A 26 7.114 -2.069 12.962 1.00 0.00 C ATOM 0 H LEU A 26 5.720 -4.004 8.978 1.00 0.00 H new ATOM 0 HA LEU A 26 5.608 -1.643 10.745 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.662 -3.552 10.779 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.283 -2.287 9.737 1.00 0.00 H new ATOM 0 HG LEU A 26 9.009 -1.885 12.000 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.118 0.381 12.367 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.485 0.086 10.651 1.00 0.00 H new ATOM 0 HD13 LEU A 26 6.800 0.044 11.221 1.00 0.00 H new ATOM 0 HD21 LEU A 26 7.408 -1.477 13.829 1.00 0.00 H new ATOM 0 HD22 LEU A 26 6.063 -1.886 12.737 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.260 -3.127 13.179 1.00 0.00 H new ATOM 435 N TYR A 27 5.921 -0.146 8.794 1.00 0.00 N ATOM 436 CA TYR A 27 5.944 0.723 7.624 1.00 0.00 C ATOM 437 C TYR A 27 6.966 1.842 7.798 1.00 0.00 C ATOM 438 O TYR A 27 6.816 2.705 8.662 1.00 0.00 O ATOM 439 CB TYR A 27 4.555 1.317 7.376 1.00 0.00 C ATOM 440 CG TYR A 27 3.807 0.654 6.241 1.00 0.00 C ATOM 441 CD1 TYR A 27 3.935 1.116 4.938 1.00 0.00 C ATOM 442 CD2 TYR A 27 2.973 -0.432 6.474 1.00 0.00 C ATOM 443 CE1 TYR A 27 3.253 0.514 3.897 1.00 0.00 C ATOM 444 CE2 TYR A 27 2.289 -1.040 5.439 1.00 0.00 C ATOM 445 CZ TYR A 27 2.432 -0.564 4.153 1.00 0.00 C ATOM 446 OH TYR A 27 1.752 -1.166 3.119 1.00 0.00 O ATOM 0 H TYR A 27 5.660 0.322 9.662 1.00 0.00 H new ATOM 0 HA TYR A 27 6.233 0.123 6.761 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.964 1.232 8.288 1.00 0.00 H new ATOM 0 HB3 TYR A 27 4.657 2.381 7.161 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.578 1.960 4.734 1.00 0.00 H new ATOM 0 HD2 TYR A 27 2.857 -0.807 7.480 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.363 0.886 2.889 1.00 0.00 H new ATOM 0 HE2 TYR A 27 1.645 -1.884 5.636 1.00 0.00 H new ATOM 0 HH TYR A 27 1.929 -0.682 2.285 1.00 0.00 H new ATOM 456 N ILE A 28 8.006 1.821 6.969 1.00 0.00 N ATOM 457 CA ILE A 28 9.052 2.835 7.031 1.00 0.00 C ATOM 458 C ILE A 28 9.455 3.294 5.632 1.00 0.00 C ATOM 459 O ILE A 28 9.349 2.538 4.667 1.00 0.00 O ATOM 460 CB ILE A 28 10.300 2.309 7.765 1.00 0.00 C ATOM 461 CG1 ILE A 28 10.799 1.019 7.112 1.00 0.00 C ATOM 462 CG2 ILE A 28 9.991 2.078 9.237 1.00 0.00 C ATOM 463 CD1 ILE A 28 12.167 0.587 7.595 1.00 0.00 C ATOM 0 H ILE A 28 8.146 1.114 6.248 1.00 0.00 H new ATOM 0 HA ILE A 28 8.643 3.680 7.585 1.00 0.00 H new ATOM 0 HB ILE A 28 11.088 3.059 7.692 1.00 0.00 H new ATOM 0 HG12 ILE A 28 10.084 0.221 7.310 1.00 0.00 H new ATOM 0 HG13 ILE A 28 10.831 1.157 6.031 1.00 0.00 H new ATOM 0 HG21 ILE A 28 10.883 1.706 9.742 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.679 3.017 9.695 1.00 0.00 H new ATOM 0 HG23 ILE A 28 9.189 1.345 9.330 1.00 0.00 H new ATOM 0 HD11 ILE A 28 12.457 -0.334 7.090 1.00 0.00 H new ATOM 0 HD12 ILE A 28 12.895 1.367 7.372 1.00 0.00 H new ATOM 0 HD13 ILE A 28 12.136 0.416 8.671 1.00 0.00 H new ATOM 475 N PRO A 29 9.926 4.547 5.505 1.00 0.00 N ATOM 476 CA PRO A 29 10.347 5.105 4.216 1.00 0.00 C ATOM 477 C PRO A 29 11.348 4.209 3.495 1.00 0.00 C ATOM 478 O PRO A 29 12.125 3.494 4.129 1.00 0.00 O ATOM 479 CB PRO A 29 10.999 6.436 4.599 1.00 0.00 C ATOM 480 CG PRO A 29 10.366 6.808 5.894 1.00 0.00 C ATOM 481 CD PRO A 29 10.086 5.515 6.607 1.00 0.00 C ATOM 0 HA PRO A 29 9.510 5.209 3.525 1.00 0.00 H new ATOM 0 HB2 PRO A 29 12.079 6.333 4.701 1.00 0.00 H new ATOM 0 HB3 PRO A 29 10.822 7.197 3.839 1.00 0.00 H new ATOM 0 HG2 PRO A 29 11.028 7.443 6.483 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.447 7.370 5.731 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.904 5.237 7.271 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.186 5.580 7.219 1.00 0.00 H new ATOM 489 N ALA A 30 11.325 4.253 2.167 1.00 0.00 N ATOM 490 CA ALA A 30 12.231 3.445 1.360 1.00 0.00 C ATOM 491 C ALA A 30 13.537 4.186 1.095 1.00 0.00 C ATOM 492 O ALA A 30 13.737 4.747 0.018 1.00 0.00 O ATOM 493 CB ALA A 30 11.566 3.058 0.049 1.00 0.00 C ATOM 0 H ALA A 30 10.689 4.840 1.627 1.00 0.00 H new ATOM 0 HA ALA A 30 12.465 2.538 1.917 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.254 2.455 -0.544 1.00 0.00 H new ATOM 0 HB2 ALA A 30 10.664 2.482 0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 30 11.303 3.959 -0.505 1.00 0.00 H new ATOM 872 N TRP A 52 11.037 12.600 10.415 1.00 0.00 N ATOM 873 CA TRP A 52 11.069 11.234 10.924 1.00 0.00 C ATOM 874 C TRP A 52 9.657 10.671 11.059 1.00 0.00 C ATOM 875 O TRP A 52 8.949 10.965 12.022 1.00 0.00 O ATOM 876 CB TRP A 52 11.782 11.189 12.278 1.00 0.00 C ATOM 877 CG TRP A 52 13.127 10.532 12.218 1.00 0.00 C ATOM 878 CD1 TRP A 52 13.717 9.781 13.194 1.00 0.00 C ATOM 879 CD2 TRP A 52 14.051 10.566 11.124 1.00 0.00 C ATOM 880 NE1 TRP A 52 14.950 9.347 12.774 1.00 0.00 N ATOM 881 CE2 TRP A 52 15.179 9.815 11.507 1.00 0.00 C ATOM 882 CE3 TRP A 52 14.034 11.158 9.858 1.00 0.00 C ATOM 883 CZ2 TRP A 52 16.278 9.642 10.669 1.00 0.00 C ATOM 884 CZ3 TRP A 52 15.126 10.985 9.027 1.00 0.00 C ATOM 885 CH2 TRP A 52 16.233 10.233 9.436 1.00 0.00 C ATOM 0 HA TRP A 52 11.619 10.619 10.212 1.00 0.00 H new ATOM 0 HB2 TRP A 52 11.898 12.206 12.653 1.00 0.00 H new ATOM 0 HB3 TRP A 52 11.156 10.655 12.993 1.00 0.00 H new ATOM 0 HD1 TRP A 52 13.278 9.561 14.156 1.00 0.00 H new ATOM 0 HE1 TRP A 52 15.592 8.770 13.317 1.00 0.00 H new ATOM 0 HE3 TRP A 52 13.184 11.740 9.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 17.134 9.063 10.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 15.124 11.438 8.046 1.00 0.00 H new ATOM 0 HH2 TRP A 52 17.070 10.117 8.764 1.00 0.00 H new ATOM 896 N GLY A 53 9.254 9.860 10.085 1.00 0.00 N ATOM 897 CA GLY A 53 7.929 9.269 10.113 1.00 0.00 C ATOM 898 C GLY A 53 7.971 7.754 10.158 1.00 0.00 C ATOM 899 O GLY A 53 9.012 7.148 9.902 1.00 0.00 O ATOM 0 H GLY A 53 9.821 9.602 9.278 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.387 9.640 10.983 1.00 0.00 H new ATOM 0 HA3 GLY A 53 7.373 9.588 9.231 1.00 0.00 H new ATOM 903 N GLY A 54 6.838 7.141 10.485 1.00 0.00 N ATOM 904 CA GLY A 54 6.773 5.693 10.558 1.00 0.00 C ATOM 905 C GLY A 54 5.407 5.195 10.987 1.00 0.00 C ATOM 906 O GLY A 54 4.523 5.987 11.311 1.00 0.00 O ATOM 0 H GLY A 54 5.964 7.621 10.701 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.020 5.272 9.584 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.525 5.334 11.261 1.00 0.00 H new ATOM 910 N GLY A 55 5.234 3.877 10.989 1.00 0.00 N ATOM 911 CA GLY A 55 3.964 3.296 11.384 1.00 0.00 C ATOM 912 C GLY A 55 3.984 1.781 11.352 1.00 0.00 C ATOM 913 O GLY A 55 5.021 1.172 11.096 1.00 0.00 O ATOM 0 H GLY A 55 5.951 3.201 10.724 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.712 3.632 12.390 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.180 3.660 10.720 1.00 0.00 H new ATOM 917 N PHE A 56 2.832 1.171 11.615 1.00 0.00 N ATOM 918 CA PHE A 56 2.720 -0.283 11.616 1.00 0.00 C ATOM 919 C PHE A 56 1.472 -0.732 10.863 1.00 0.00 C ATOM 920 O PHE A 56 0.656 0.090 10.447 1.00 0.00 O ATOM 921 CB PHE A 56 2.682 -0.812 13.051 1.00 0.00 C ATOM 922 CG PHE A 56 1.704 -0.088 13.932 1.00 0.00 C ATOM 923 CD1 PHE A 56 1.991 1.179 14.414 1.00 0.00 C ATOM 924 CD2 PHE A 56 0.497 -0.675 14.278 1.00 0.00 C ATOM 925 CE1 PHE A 56 1.093 1.847 15.224 1.00 0.00 C ATOM 926 CE2 PHE A 56 -0.405 -0.012 15.088 1.00 0.00 C ATOM 927 CZ PHE A 56 -0.106 1.251 15.562 1.00 0.00 C ATOM 0 H PHE A 56 1.964 1.661 11.830 1.00 0.00 H new ATOM 0 HA PHE A 56 3.595 -0.690 11.110 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.427 -1.871 13.032 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.678 -0.732 13.486 1.00 0.00 H new ATOM 0 HD1 PHE A 56 2.927 1.650 14.153 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.259 -1.662 13.910 1.00 0.00 H new ATOM 0 HE1 PHE A 56 1.329 2.834 15.593 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.342 -0.480 15.350 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.809 1.771 16.196 1.00 0.00 H new ATOM 937 N GLY A 57 1.329 -2.042 10.692 1.00 0.00 N ATOM 938 CA GLY A 57 0.178 -2.577 9.990 1.00 0.00 C ATOM 939 C GLY A 57 -0.220 -3.952 10.491 1.00 0.00 C ATOM 940 O GLY A 57 0.556 -4.620 11.173 1.00 0.00 O ATOM 0 H GLY A 57 1.990 -2.743 11.027 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.664 -1.894 10.105 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.400 -2.632 8.924 1.00 0.00 H new ATOM 944 N LEU A 58 -1.435 -4.373 10.154 1.00 0.00 N ATOM 945 CA LEU A 58 -1.936 -5.676 10.573 1.00 0.00 C ATOM 946 C LEU A 58 -2.482 -6.459 9.384 1.00 0.00 C ATOM 947 O LEU A 58 -2.496 -5.964 8.256 1.00 0.00 O ATOM 948 CB LEU A 58 -3.028 -5.509 11.632 1.00 0.00 C ATOM 949 CG LEU A 58 -2.552 -4.941 12.970 1.00 0.00 C ATOM 950 CD1 LEU A 58 -3.644 -4.100 13.612 1.00 0.00 C ATOM 951 CD2 LEU A 58 -2.123 -6.063 13.902 1.00 0.00 C ATOM 0 H LEU A 58 -2.090 -3.830 9.592 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.104 -6.235 11.002 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.803 -4.855 11.232 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.491 -6.480 11.811 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.690 -4.300 12.785 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.287 -3.704 14.563 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.904 -3.274 12.950 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.525 -4.718 13.784 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.787 -5.641 14.849 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.966 -6.730 14.081 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.307 -6.624 13.445 1.00 0.00 H new ATOM 963 N SER A 59 -2.930 -7.683 9.642 1.00 0.00 N ATOM 964 CA SER A 59 -3.476 -8.533 8.591 1.00 0.00 C ATOM 965 C SER A 59 -4.647 -9.361 9.114 1.00 0.00 C ATOM 966 O SER A 59 -4.710 -9.685 10.300 1.00 0.00 O ATOM 967 CB SER A 59 -2.390 -9.457 8.038 1.00 0.00 C ATOM 968 OG SER A 59 -1.403 -9.729 9.017 1.00 0.00 O ATOM 0 H SER A 59 -2.926 -8.108 10.569 1.00 0.00 H new ATOM 0 HA SER A 59 -3.839 -7.890 7.789 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.840 -10.391 7.702 1.00 0.00 H new ATOM 0 HB3 SER A 59 -1.925 -8.996 7.167 1.00 0.00 H new ATOM 0 HG SER A 59 -0.722 -10.323 8.638 1.00 0.00 H new ATOM 974 N ARG A 60 -5.570 -9.700 8.220 1.00 0.00 N ATOM 975 CA ARG A 60 -6.739 -10.489 8.591 1.00 0.00 C ATOM 976 C ARG A 60 -7.194 -11.363 7.425 1.00 0.00 C ATOM 977 O ARG A 60 -6.719 -11.210 6.299 1.00 0.00 O ATOM 978 CB ARG A 60 -7.879 -9.572 9.037 1.00 0.00 C ATOM 979 CG ARG A 60 -8.225 -9.705 10.511 1.00 0.00 C ATOM 980 CD ARG A 60 -9.038 -8.518 11.002 1.00 0.00 C ATOM 981 NE ARG A 60 -10.001 -8.901 12.032 1.00 0.00 N ATOM 982 CZ ARG A 60 -11.088 -9.631 11.795 1.00 0.00 C ATOM 983 NH1 ARG A 60 -11.356 -10.058 10.568 1.00 0.00 N ATOM 984 NH2 ARG A 60 -11.911 -9.934 12.791 1.00 0.00 N ATOM 0 H ARG A 60 -5.531 -9.441 7.234 1.00 0.00 H new ATOM 0 HA ARG A 60 -6.463 -11.138 9.422 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -7.605 -8.538 8.828 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.766 -9.793 8.443 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.788 -10.624 10.672 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -7.308 -9.786 11.095 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -8.365 -7.758 11.399 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.566 -8.068 10.161 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.830 -8.591 12.988 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.727 -9.827 9.799 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.191 -10.617 10.394 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -11.710 -9.607 13.736 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -12.745 -10.493 12.611 1.00 0.00 H new ATOM 998 N TRP A 61 -8.117 -12.278 7.703 1.00 0.00 N ATOM 999 CA TRP A 61 -8.636 -13.176 6.678 1.00 0.00 C ATOM 1000 C TRP A 61 -10.089 -12.844 6.351 1.00 0.00 C ATOM 1001 O TRP A 61 -10.887 -12.558 7.244 1.00 0.00 O ATOM 1002 CB TRP A 61 -8.524 -14.630 7.140 1.00 0.00 C ATOM 1003 CG TRP A 61 -7.133 -15.177 7.046 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -6.090 -14.912 7.884 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -6.633 -16.082 6.054 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -4.971 -15.597 7.476 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -5.279 -16.323 6.355 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -7.199 -16.713 4.943 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -4.484 -17.168 5.585 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -6.408 -17.550 4.179 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -5.063 -17.772 4.503 1.00 0.00 C ATOM 0 H TRP A 61 -8.521 -12.417 8.629 1.00 0.00 H new ATOM 0 HA TRP A 61 -8.039 -13.042 5.776 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -8.867 -14.703 8.172 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -9.191 -15.247 6.538 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -6.137 -14.259 8.743 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.059 -15.570 7.933 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -8.235 -16.550 4.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -3.447 -17.340 5.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -6.834 -18.042 3.317 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -4.472 -18.433 3.886 1.00 0.00 H new ATOM 1022 N ASP A 62 -10.425 -12.884 5.066 1.00 0.00 N ATOM 1023 CA ASP A 62 -11.782 -12.588 4.620 1.00 0.00 C ATOM 1024 C ASP A 62 -12.437 -13.823 4.012 1.00 0.00 C ATOM 1025 O ASP A 62 -11.890 -14.444 3.099 1.00 0.00 O ATOM 1026 CB ASP A 62 -11.768 -11.448 3.599 1.00 0.00 C ATOM 1027 CG ASP A 62 -11.468 -10.105 4.235 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -11.994 -9.840 5.337 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -10.707 -9.320 3.632 1.00 0.00 O ATOM 0 H ASP A 62 -9.776 -13.119 4.315 1.00 0.00 H new ATOM 0 HA ASP A 62 -12.365 -12.282 5.489 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -11.021 -11.659 2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -12.735 -11.401 3.097 1.00 0.00 H new ATOM 1035 N GLU A 63 -13.614 -14.172 4.525 1.00 0.00 N ATOM 1036 CA GLU A 63 -14.354 -15.334 4.040 1.00 0.00 C ATOM 1037 C GLU A 63 -14.577 -15.264 2.531 1.00 0.00 C ATOM 1038 O GLU A 63 -14.808 -16.285 1.883 1.00 0.00 O ATOM 1039 CB GLU A 63 -15.700 -15.441 4.759 1.00 0.00 C ATOM 1040 CG GLU A 63 -16.113 -16.871 5.069 1.00 0.00 C ATOM 1041 CD GLU A 63 -16.763 -17.008 6.430 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -16.048 -16.871 7.447 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -17.986 -17.253 6.482 1.00 0.00 O ATOM 0 H GLU A 63 -14.077 -13.665 5.279 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.757 -16.221 4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -15.651 -14.876 5.690 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -16.469 -14.975 4.143 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -16.806 -17.219 4.303 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.236 -17.517 5.023 1.00 0.00 H new ATOM 1051 N LYS A 64 -14.507 -14.057 1.974 1.00 0.00 N ATOM 1052 CA LYS A 64 -14.704 -13.865 0.542 1.00 0.00 C ATOM 1053 C LYS A 64 -13.379 -13.948 -0.216 1.00 0.00 C ATOM 1054 O LYS A 64 -13.234 -13.370 -1.292 1.00 0.00 O ATOM 1055 CB LYS A 64 -15.370 -12.514 0.275 1.00 0.00 C ATOM 1056 CG LYS A 64 -16.889 -12.581 0.237 1.00 0.00 C ATOM 1057 CD LYS A 64 -17.510 -11.905 1.449 1.00 0.00 C ATOM 1058 CE LYS A 64 -17.345 -12.748 2.704 1.00 0.00 C ATOM 1059 NZ LYS A 64 -16.261 -12.230 3.583 1.00 0.00 N ATOM 0 H LYS A 64 -14.316 -13.200 2.493 1.00 0.00 H new ATOM 0 HA LYS A 64 -15.353 -14.664 0.185 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -15.065 -11.809 1.048 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -15.008 -12.121 -0.675 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.252 -12.103 -0.673 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.207 -13.623 0.198 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -17.046 -10.930 1.601 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -18.570 -11.728 1.265 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -18.284 -12.763 3.257 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -17.124 -13.778 2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.681 -13.023 3.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -15.663 -11.570 3.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.680 -11.734 4.395 1.00 0.00 H new ATOM 1073 N GLY A 65 -12.415 -14.670 0.352 1.00 0.00 N ATOM 1074 CA GLY A 65 -11.121 -14.812 -0.288 1.00 0.00 C ATOM 1075 C GLY A 65 -10.384 -13.493 -0.399 1.00 0.00 C ATOM 1076 O GLY A 65 -9.893 -13.135 -1.471 1.00 0.00 O ATOM 0 H GLY A 65 -12.509 -15.158 1.243 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.514 -15.518 0.279 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.255 -15.235 -1.284 1.00 0.00 H new ATOM 1080 N ASN A 66 -10.303 -12.766 0.712 1.00 0.00 N ATOM 1081 CA ASN A 66 -9.617 -11.479 0.732 1.00 0.00 C ATOM 1082 C ASN A 66 -8.661 -11.387 1.918 1.00 0.00 C ATOM 1083 O ASN A 66 -8.825 -12.090 2.915 1.00 0.00 O ATOM 1084 CB ASN A 66 -10.635 -10.336 0.789 1.00 0.00 C ATOM 1085 CG ASN A 66 -10.912 -9.740 -0.577 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -10.266 -8.775 -0.987 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -11.876 -10.312 -1.288 1.00 0.00 N ATOM 0 H ASN A 66 -10.703 -13.046 1.608 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.034 -11.392 -0.185 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.567 -10.704 1.217 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -10.265 -9.556 1.454 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.108 -9.954 -2.214 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.385 -11.110 -0.908 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.665 -10.517 1.801 1.00 0.00 N ATOM 1095 CA TRP A 67 -6.681 -10.332 2.863 1.00 0.00 C ATOM 1096 C TRP A 67 -6.715 -8.902 3.391 1.00 0.00 C ATOM 1097 O TRP A 67 -6.130 -7.996 2.797 1.00 0.00 O ATOM 1098 CB TRP A 67 -5.278 -10.666 2.352 1.00 0.00 C ATOM 1099 CG TRP A 67 -4.977 -12.133 2.355 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -5.455 -13.070 1.484 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -4.130 -12.833 3.273 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -4.956 -14.309 1.804 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -4.141 -14.190 2.898 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -3.362 -12.445 4.375 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -3.413 -15.159 3.587 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -2.641 -13.406 5.057 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -2.671 -14.750 4.661 1.00 0.00 C ATOM 0 H TRP A 67 -7.517 -9.928 0.982 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.933 -11.009 3.680 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.168 -10.282 1.338 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -4.542 -10.151 2.969 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -6.127 -12.866 0.664 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -5.159 -15.177 1.308 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -3.333 -11.412 4.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -3.434 -16.195 3.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -2.044 -13.117 5.909 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -2.097 -15.478 5.215 1.00 0.00 H new ATOM 1118 N HIS A 68 -7.403 -8.707 4.511 1.00 0.00 N ATOM 1119 CA HIS A 68 -7.512 -7.386 5.119 1.00 0.00 C ATOM 1120 C HIS A 68 -6.165 -6.926 5.665 1.00 0.00 C ATOM 1121 O HIS A 68 -5.390 -7.726 6.190 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.551 -7.403 6.242 1.00 0.00 C ATOM 1123 CG HIS A 68 -8.775 -6.061 6.870 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -8.569 -5.814 8.210 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -9.189 -4.890 6.331 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -8.846 -4.548 8.470 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -9.223 -3.967 7.347 1.00 0.00 N ATOM 0 H HIS A 68 -7.893 -9.446 5.016 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.831 -6.684 4.349 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.497 -7.772 5.845 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.232 -8.106 7.011 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.444 -4.715 5.296 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -8.776 -4.071 9.436 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -9.496 -2.989 7.249 1.00 0.00 H new ATOM 1136 N GLY A 69 -5.890 -5.631 5.537 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.635 -5.088 6.022 1.00 0.00 C ATOM 1138 C GLY A 69 -4.802 -3.729 6.673 1.00 0.00 C ATOM 1139 O GLY A 69 -5.338 -2.804 6.064 1.00 0.00 O ATOM 0 H GLY A 69 -6.514 -4.949 5.106 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.197 -5.780 6.741 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.934 -5.006 5.192 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.341 -3.609 7.913 1.00 0.00 N ATOM 1144 CA LEU A 70 -4.440 -2.353 8.648 1.00 0.00 C ATOM 1145 C LEU A 70 -3.210 -1.485 8.408 1.00 0.00 C ATOM 1146 O LEU A 70 -2.115 -1.995 8.168 1.00 0.00 O ATOM 1147 CB LEU A 70 -4.603 -2.626 10.146 1.00 0.00 C ATOM 1148 CG LEU A 70 -5.038 -1.419 10.979 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -5.901 -1.863 12.150 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -3.822 -0.648 11.472 1.00 0.00 C ATOM 0 H LEU A 70 -3.895 -4.366 8.431 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.317 -1.816 8.286 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.336 -3.422 10.277 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.656 -2.997 10.538 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.632 -0.758 10.347 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -6.201 -0.991 12.732 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.789 -2.373 11.775 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.332 -2.544 12.784 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -4.149 0.208 12.063 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -3.203 -1.300 12.089 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.242 -0.299 10.618 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.397 -0.170 8.475 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.301 0.768 8.263 1.00 0.00 C ATOM 1164 C TYR A 71 -2.385 1.936 9.242 1.00 0.00 C ATOM 1165 O TYR A 71 -3.377 2.665 9.270 1.00 0.00 O ATOM 1166 CB TYR A 71 -2.319 1.290 6.825 1.00 0.00 C ATOM 1167 CG TYR A 71 -2.315 0.194 5.783 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -1.124 -0.373 5.350 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -3.502 -0.272 5.233 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -1.116 -1.374 4.397 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -3.503 -1.274 4.281 1.00 0.00 C ATOM 1172 CZ TYR A 71 -2.307 -1.821 3.866 1.00 0.00 C ATOM 1173 OH TYR A 71 -2.303 -2.818 2.918 1.00 0.00 O ATOM 0 H TYR A 71 -4.296 0.269 8.674 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.365 0.238 8.438 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.204 1.911 6.684 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.451 1.931 6.669 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.189 -0.026 5.764 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -4.440 0.156 5.555 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.181 -1.804 4.070 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -4.435 -1.627 3.865 1.00 0.00 H new ATOM 0 HH TYR A 71 -3.224 -3.017 2.649 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.338 2.106 10.041 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.292 3.186 11.020 1.00 0.00 C ATOM 1185 C ALA A 72 0.055 3.899 10.986 1.00 0.00 C ATOM 1186 O ALA A 72 1.076 3.339 11.386 1.00 0.00 O ATOM 1187 CB ALA A 72 -1.569 2.645 12.415 1.00 0.00 C ATOM 0 H ALA A 72 -0.510 1.510 10.030 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.065 3.911 10.763 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.532 3.462 13.136 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.557 2.186 12.438 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.817 1.899 12.672 1.00 0.00 H new ATOM 1193 N MET A 73 0.052 5.137 10.502 1.00 0.00 N ATOM 1194 CA MET A 73 1.276 5.926 10.413 1.00 0.00 C ATOM 1195 C MET A 73 1.187 7.173 11.287 1.00 0.00 C ATOM 1196 O MET A 73 0.099 7.587 11.687 1.00 0.00 O ATOM 1197 CB MET A 73 1.545 6.324 8.961 1.00 0.00 C ATOM 1198 CG MET A 73 2.259 5.249 8.158 1.00 0.00 C ATOM 1199 SD MET A 73 2.159 5.530 6.380 1.00 0.00 S ATOM 1200 CE MET A 73 1.984 3.852 5.781 1.00 0.00 C ATOM 0 H MET A 73 -0.784 5.615 10.166 1.00 0.00 H new ATOM 0 HA MET A 73 2.101 5.312 10.774 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.598 6.559 8.476 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.144 7.234 8.948 1.00 0.00 H new ATOM 0 HG2 MET A 73 3.306 5.212 8.458 1.00 0.00 H new ATOM 0 HG3 MET A 73 1.826 4.277 8.393 1.00 0.00 H new ATOM 0 HE1 MET A 73 2.576 3.726 4.874 1.00 0.00 H new ATOM 0 HE2 MET A 73 2.334 3.155 6.543 1.00 0.00 H new ATOM 0 HE3 MET A 73 0.935 3.652 5.561 1.00 0.00 H new ATOM 1210 N ALA A 74 2.339 7.768 11.576 1.00 0.00 N ATOM 1211 CA ALA A 74 2.396 8.968 12.401 1.00 0.00 C ATOM 1212 C ALA A 74 3.638 9.793 12.081 1.00 0.00 C ATOM 1213 O ALA A 74 4.727 9.247 11.901 1.00 0.00 O ATOM 1214 CB ALA A 74 2.370 8.598 13.876 1.00 0.00 C ATOM 0 H ALA A 74 3.247 7.438 11.250 1.00 0.00 H new ATOM 0 HA ALA A 74 1.519 9.576 12.177 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.413 9.505 14.479 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.450 8.057 14.099 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.228 7.967 14.108 1.00 0.00 H new ATOM 1220 N PHE A 75 3.468 11.108 12.010 1.00 0.00 N ATOM 1221 CA PHE A 75 4.578 12.006 11.711 1.00 0.00 C ATOM 1222 C PHE A 75 4.737 13.062 12.801 1.00 0.00 C ATOM 1223 O PHE A 75 3.793 13.363 13.531 1.00 0.00 O ATOM 1224 CB PHE A 75 4.360 12.684 10.357 1.00 0.00 C ATOM 1225 CG PHE A 75 4.987 11.945 9.209 1.00 0.00 C ATOM 1226 CD1 PHE A 75 4.398 10.798 8.702 1.00 0.00 C ATOM 1227 CD2 PHE A 75 6.165 12.400 8.637 1.00 0.00 C ATOM 1228 CE1 PHE A 75 4.973 10.117 7.645 1.00 0.00 C ATOM 1229 CE2 PHE A 75 6.744 11.722 7.581 1.00 0.00 C ATOM 1230 CZ PHE A 75 6.148 10.579 7.085 1.00 0.00 C ATOM 0 H PHE A 75 2.573 11.576 12.155 1.00 0.00 H new ATOM 0 HA PHE A 75 5.491 11.412 11.672 1.00 0.00 H new ATOM 0 HB2 PHE A 75 3.289 12.780 10.176 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.769 13.694 10.395 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.480 10.432 9.137 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.635 13.293 9.021 1.00 0.00 H new ATOM 0 HE1 PHE A 75 4.504 9.225 7.258 1.00 0.00 H new ATOM 0 HE2 PHE A 75 7.662 12.086 7.144 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.600 10.047 6.261 1.00 0.00 H new ATOM 1240 N LYS A 76 5.940 13.617 12.905 1.00 0.00 N ATOM 1241 CA LYS A 76 6.226 14.640 13.906 1.00 0.00 C ATOM 1242 C LYS A 76 6.311 16.021 13.263 1.00 0.00 C ATOM 1243 O LYS A 76 7.329 16.379 12.673 1.00 0.00 O ATOM 1244 CB LYS A 76 7.534 14.320 14.631 1.00 0.00 C ATOM 1245 CG LYS A 76 7.338 13.558 15.932 1.00 0.00 C ATOM 1246 CD LYS A 76 8.557 13.672 16.833 1.00 0.00 C ATOM 1247 CE LYS A 76 8.486 14.904 17.721 1.00 0.00 C ATOM 1248 NZ LYS A 76 9.670 15.789 17.538 1.00 0.00 N ATOM 0 H LYS A 76 6.732 13.376 12.309 1.00 0.00 H new ATOM 0 HA LYS A 76 5.410 14.646 14.629 1.00 0.00 H new ATOM 0 HB2 LYS A 76 8.173 13.735 13.969 1.00 0.00 H new ATOM 0 HB3 LYS A 76 8.061 15.251 14.841 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.462 13.944 16.453 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.142 12.508 15.714 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.635 12.780 17.454 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.459 13.715 16.222 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.577 15.462 17.496 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.421 14.596 18.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.584 16.617 18.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.536 15.265 17.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.718 16.104 16.548 1.00 0.00 H new ATOM 1262 N ASP A 77 5.235 16.791 13.381 1.00 0.00 N ATOM 1263 CA ASP A 77 5.189 18.133 12.812 1.00 0.00 C ATOM 1264 C ASP A 77 6.288 19.011 13.400 1.00 0.00 C ATOM 1265 O ASP A 77 6.709 18.816 14.540 1.00 0.00 O ATOM 1266 CB ASP A 77 3.821 18.770 13.063 1.00 0.00 C ATOM 1267 CG ASP A 77 2.799 18.378 12.014 1.00 0.00 C ATOM 1268 OD1 ASP A 77 2.385 19.259 11.231 1.00 0.00 O ATOM 1269 OD2 ASP A 77 2.412 17.192 11.975 1.00 0.00 O ATOM 0 H ASP A 77 4.383 16.509 13.866 1.00 0.00 H new ATOM 0 HA ASP A 77 5.351 18.051 11.737 1.00 0.00 H new ATOM 0 HB2 ASP A 77 3.460 18.472 14.047 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.926 19.855 13.077 1.00 0.00 H new ATOM 1275 N SER A 78 6.747 19.981 12.616 1.00 0.00 N ATOM 1276 CA SER A 78 7.796 20.892 13.059 1.00 0.00 C ATOM 1277 C SER A 78 7.238 21.983 13.974 1.00 0.00 C ATOM 1278 O SER A 78 7.989 22.809 14.493 1.00 0.00 O ATOM 1279 CB SER A 78 8.489 21.529 11.853 1.00 0.00 C ATOM 1280 OG SER A 78 9.522 20.695 11.359 1.00 0.00 O ATOM 0 H SER A 78 6.409 20.156 11.670 1.00 0.00 H new ATOM 0 HA SER A 78 8.522 20.311 13.627 1.00 0.00 H new ATOM 0 HB2 SER A 78 7.758 21.713 11.065 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.903 22.497 12.137 1.00 0.00 H new ATOM 0 HG SER A 78 9.948 21.124 10.588 1.00 0.00 H new ATOM 1286 N TRP A 79 5.922 21.983 14.169 1.00 0.00 N ATOM 1287 CA TRP A 79 5.277 22.976 15.021 1.00 0.00 C ATOM 1288 C TRP A 79 4.183 22.332 15.867 1.00 0.00 C ATOM 1289 O TRP A 79 4.101 22.561 17.074 1.00 0.00 O ATOM 1290 CB TRP A 79 4.689 24.104 14.171 1.00 0.00 C ATOM 1291 CG TRP A 79 5.518 25.352 14.186 1.00 0.00 C ATOM 1292 CD1 TRP A 79 6.194 25.899 13.133 1.00 0.00 C ATOM 1293 CD2 TRP A 79 5.759 26.209 15.308 1.00 0.00 C ATOM 1294 NE1 TRP A 79 6.841 27.044 13.533 1.00 0.00 N ATOM 1295 CE2 TRP A 79 6.590 27.255 14.864 1.00 0.00 C ATOM 1296 CE3 TRP A 79 5.353 26.192 16.645 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 7.020 28.274 15.709 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 5.782 27.205 17.484 1.00 0.00 C ATOM 1299 CH2 TRP A 79 6.607 28.233 17.013 1.00 0.00 C ATOM 0 H TRP A 79 5.283 21.308 13.749 1.00 0.00 H new ATOM 0 HA TRP A 79 6.030 23.394 15.689 1.00 0.00 H new ATOM 0 HB2 TRP A 79 4.585 23.758 13.143 1.00 0.00 H new ATOM 0 HB3 TRP A 79 3.687 24.337 14.532 1.00 0.00 H new ATOM 0 HD1 TRP A 79 6.217 25.492 12.133 1.00 0.00 H new ATOM 0 HE1 TRP A 79 7.415 27.640 12.936 1.00 0.00 H new ATOM 0 HE3 TRP A 79 4.716 25.403 17.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 7.657 29.068 15.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 5.475 27.203 18.520 1.00 0.00 H new ATOM 0 HH2 TRP A 79 6.924 29.010 17.693 1.00 0.00 H new ATOM 1310 N ASN A 80 3.345 21.525 15.224 1.00 0.00 N ATOM 1311 CA ASN A 80 2.256 20.846 15.915 1.00 0.00 C ATOM 1312 C ASN A 80 2.749 19.559 16.571 1.00 0.00 C ATOM 1313 O ASN A 80 3.951 19.295 16.616 1.00 0.00 O ATOM 1314 CB ASN A 80 1.121 20.536 14.936 1.00 0.00 C ATOM 1315 CG ASN A 80 -0.062 21.469 15.108 1.00 0.00 C ATOM 1316 OD1 ASN A 80 0.103 22.683 15.231 1.00 0.00 O ATOM 1317 ND2 ASN A 80 -1.264 20.906 15.119 1.00 0.00 N ATOM 0 H ASN A 80 3.400 21.326 14.225 1.00 0.00 H new ATOM 0 HA ASN A 80 1.881 21.508 16.696 1.00 0.00 H new ATOM 0 HB2 ASN A 80 1.495 20.612 13.915 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.792 19.507 15.079 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -2.097 21.484 15.233 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -1.355 19.896 15.014 1.00 0.00 H new ATOM 1324 N LYS A 81 1.814 18.764 17.078 1.00 0.00 N ATOM 1325 CA LYS A 81 2.153 17.506 17.732 1.00 0.00 C ATOM 1326 C LYS A 81 2.101 16.347 16.741 1.00 0.00 C ATOM 1327 O LYS A 81 1.941 16.552 15.538 1.00 0.00 O ATOM 1328 CB LYS A 81 1.198 17.241 18.900 1.00 0.00 C ATOM 1329 CG LYS A 81 1.833 17.454 20.264 1.00 0.00 C ATOM 1330 CD LYS A 81 2.915 16.422 20.542 1.00 0.00 C ATOM 1331 CE LYS A 81 3.890 16.908 21.602 1.00 0.00 C ATOM 1332 NZ LYS A 81 3.578 16.344 22.943 1.00 0.00 N ATOM 0 H LYS A 81 0.815 18.968 17.049 1.00 0.00 H new ATOM 0 HA LYS A 81 3.170 17.586 18.116 1.00 0.00 H new ATOM 0 HB2 LYS A 81 0.331 17.895 18.806 1.00 0.00 H new ATOM 0 HB3 LYS A 81 0.832 16.216 18.834 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.262 18.455 20.315 1.00 0.00 H new ATOM 0 HG3 LYS A 81 1.066 17.396 21.037 1.00 0.00 H new ATOM 0 HD2 LYS A 81 2.455 15.490 20.870 1.00 0.00 H new ATOM 0 HD3 LYS A 81 3.456 16.204 19.621 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.904 16.628 21.318 1.00 0.00 H new ATOM 0 HE3 LYS A 81 3.861 17.997 21.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 4.266 16.700 23.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.619 16.632 23.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 3.631 15.306 22.904 1.00 0.00 H new ATOM 1346 N TRP A 82 2.237 15.129 17.256 1.00 0.00 N ATOM 1347 CA TRP A 82 2.206 13.936 16.416 1.00 0.00 C ATOM 1348 C TRP A 82 0.854 13.796 15.723 1.00 0.00 C ATOM 1349 O TRP A 82 -0.193 13.843 16.369 1.00 0.00 O ATOM 1350 CB TRP A 82 2.492 12.689 17.255 1.00 0.00 C ATOM 1351 CG TRP A 82 3.900 12.626 17.767 1.00 0.00 C ATOM 1352 CD1 TRP A 82 4.661 13.671 18.204 1.00 0.00 C ATOM 1353 CD2 TRP A 82 4.714 11.454 17.893 1.00 0.00 C ATOM 1354 NE1 TRP A 82 5.898 13.221 18.596 1.00 0.00 N ATOM 1355 CE2 TRP A 82 5.956 11.864 18.414 1.00 0.00 C ATOM 1356 CE3 TRP A 82 4.514 10.099 17.616 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 6.991 10.967 18.664 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 5.542 9.209 17.865 1.00 0.00 C ATOM 1359 CH2 TRP A 82 6.767 9.646 18.384 1.00 0.00 C ATOM 0 H TRP A 82 2.370 14.942 18.250 1.00 0.00 H new ATOM 0 HA TRP A 82 2.978 14.038 15.653 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.804 12.663 18.100 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.292 11.802 16.654 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.338 14.701 18.237 1.00 0.00 H new ATOM 0 HE1 TRP A 82 6.651 13.803 18.963 1.00 0.00 H new ATOM 0 HE3 TRP A 82 3.573 9.753 17.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 7.937 11.301 19.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 5.398 8.159 17.656 1.00 0.00 H new ATOM 0 HH2 TRP A 82 7.551 8.926 18.567 1.00 0.00 H new ATOM 1370 N GLU A 83 0.884 13.624 14.406 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.341 13.477 13.627 1.00 0.00 C ATOM 1372 C GLU A 83 -0.604 12.008 13.299 1.00 0.00 C ATOM 1373 O GLU A 83 0.252 11.331 12.727 1.00 0.00 O ATOM 1374 CB GLU A 83 -0.249 14.290 12.335 1.00 0.00 C ATOM 1375 CG GLU A 83 -1.598 14.559 11.689 1.00 0.00 C ATOM 1376 CD GLU A 83 -1.475 15.000 10.243 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -1.116 16.173 10.009 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -1.737 14.171 9.347 1.00 0.00 O ATOM 0 H GLU A 83 1.742 13.583 13.856 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.171 13.852 14.226 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.239 15.241 12.548 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.385 13.758 11.625 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.207 13.656 11.739 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.121 15.329 12.256 1.00 0.00 H new ATOM 1386 N PRO A 84 -1.794 11.489 13.656 1.00 0.00 N ATOM 1387 CA PRO A 84 -2.157 10.095 13.394 1.00 0.00 C ATOM 1388 C PRO A 84 -2.596 9.870 11.951 1.00 0.00 C ATOM 1389 O PRO A 84 -2.918 10.818 11.235 1.00 0.00 O ATOM 1390 CB PRO A 84 -3.324 9.862 14.350 1.00 0.00 C ATOM 1391 CG PRO A 84 -3.978 11.195 14.470 1.00 0.00 C ATOM 1392 CD PRO A 84 -2.878 12.219 14.346 1.00 0.00 C ATOM 0 HA PRO A 84 -1.318 9.415 13.541 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -4.014 9.115 13.959 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -2.978 9.501 15.318 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.727 11.332 13.690 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.493 11.291 15.426 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.203 13.088 13.774 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.557 12.582 15.322 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.607 8.609 11.531 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.009 8.259 10.174 1.00 0.00 C ATOM 1402 C ILE A 85 -3.683 6.892 10.138 1.00 0.00 C ATOM 1403 O ILE A 85 -3.065 5.876 10.456 1.00 0.00 O ATOM 1404 CB ILE A 85 -1.804 8.249 9.215 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -0.988 9.534 9.374 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.272 8.085 7.777 1.00 0.00 C ATOM 1407 CD1 ILE A 85 0.234 9.587 8.482 1.00 0.00 C ATOM 0 H ILE A 85 -2.342 7.813 12.111 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.717 9.021 9.847 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.165 7.402 9.466 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.626 10.390 9.154 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.674 9.629 10.413 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.409 8.080 7.112 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -2.814 7.145 7.676 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.930 8.913 7.512 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.765 10.525 8.647 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.893 8.751 8.717 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.074 9.523 7.438 1.00 0.00 H new ATOM 1419 N ALA A 86 -4.954 6.873 9.749 1.00 0.00 N ATOM 1420 CA ALA A 86 -5.711 5.630 9.672 1.00 0.00 C ATOM 1421 C ALA A 86 -5.730 5.086 8.248 1.00 0.00 C ATOM 1422 O ALA A 86 -5.706 5.847 7.281 1.00 0.00 O ATOM 1423 CB ALA A 86 -7.129 5.845 10.178 1.00 0.00 C ATOM 0 H ALA A 86 -5.481 7.705 9.482 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.219 4.893 10.306 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.684 4.909 10.115 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.098 6.180 11.215 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.623 6.601 9.567 1.00 0.00 H new ATOM 1429 N GLY A 87 -5.775 3.763 8.126 1.00 0.00 N ATOM 1430 CA GLY A 87 -5.798 3.140 6.816 1.00 0.00 C ATOM 1431 C GLY A 87 -6.384 1.742 6.848 1.00 0.00 C ATOM 1432 O GLY A 87 -6.205 1.008 7.819 1.00 0.00 O ATOM 0 H GLY A 87 -5.796 3.112 8.911 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.380 3.759 6.133 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.783 3.096 6.420 1.00 0.00 H new ATOM 1436 N TYR A 88 -7.088 1.374 5.783 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.704 0.055 5.691 1.00 0.00 C ATOM 1438 C TYR A 88 -7.943 -0.332 4.235 1.00 0.00 C ATOM 1439 O TYR A 88 -8.719 0.312 3.530 1.00 0.00 O ATOM 1440 CB TYR A 88 -9.026 0.031 6.460 1.00 0.00 C ATOM 1441 CG TYR A 88 -8.854 0.064 7.962 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -8.359 -1.039 8.647 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -9.188 1.196 8.694 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -8.201 -1.013 10.020 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -9.032 1.229 10.067 1.00 0.00 C ATOM 1446 CZ TYR A 88 -8.538 0.122 10.724 1.00 0.00 C ATOM 1447 OH TYR A 88 -8.383 0.151 12.091 1.00 0.00 O ATOM 0 H TYR A 88 -7.246 1.971 4.971 1.00 0.00 H new ATOM 0 HA TYR A 88 -7.021 -0.669 6.135 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.631 0.885 6.153 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.580 -0.867 6.186 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.094 -1.930 8.098 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.576 2.064 8.182 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.815 -1.878 10.538 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.296 2.117 10.622 1.00 0.00 H new ATOM 0 HH TYR A 88 -8.665 1.025 12.434 1.00 0.00 H new ATOM 1457 N GLY A 89 -7.271 -1.390 3.791 1.00 0.00 N ATOM 1458 CA GLY A 89 -7.425 -1.843 2.421 1.00 0.00 C ATOM 1459 C GLY A 89 -7.432 -3.353 2.304 1.00 0.00 C ATOM 1460 O GLY A 89 -7.118 -4.059 3.263 1.00 0.00 O ATOM 0 H GLY A 89 -6.624 -1.941 4.355 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -8.355 -1.446 2.014 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.614 -1.439 1.815 1.00 0.00 H new ATOM 1464 N TRP A 90 -7.792 -3.851 1.126 1.00 0.00 N ATOM 1465 CA TRP A 90 -7.839 -5.289 0.883 1.00 0.00 C ATOM 1466 C TRP A 90 -6.921 -5.674 -0.272 1.00 0.00 C ATOM 1467 O TRP A 90 -7.073 -5.179 -1.389 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.271 -5.731 0.581 1.00 0.00 C ATOM 1469 CG TRP A 90 -10.261 -5.293 1.617 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -10.269 -5.633 2.940 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -11.390 -4.434 1.417 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -11.333 -5.037 3.573 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -12.036 -4.296 2.659 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -11.915 -3.766 0.306 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -13.180 -3.520 2.823 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -13.052 -2.996 0.469 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -13.672 -2.878 1.719 1.00 0.00 C ATOM 0 H TRP A 90 -8.056 -3.280 0.323 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.493 -5.796 1.784 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.570 -5.331 -0.388 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.298 -6.818 0.500 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.545 -6.276 3.418 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -11.562 -5.131 4.562 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -11.441 -3.850 -0.661 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -13.661 -3.428 3.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.469 -2.477 -0.382 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -14.558 -2.267 1.814 1.00 0.00 H new ATOM 1488 N GLU A 91 -5.969 -6.559 0.004 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.027 -7.012 -1.014 1.00 0.00 C ATOM 1490 C GLU A 91 -5.266 -8.476 -1.364 1.00 0.00 C ATOM 1491 O GLU A 91 -5.764 -9.247 -0.544 1.00 0.00 O ATOM 1492 CB GLU A 91 -3.589 -6.817 -0.530 1.00 0.00 C ATOM 1493 CG GLU A 91 -3.242 -5.370 -0.218 1.00 0.00 C ATOM 1494 CD GLU A 91 -2.432 -4.716 -1.319 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -1.300 -5.177 -1.579 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -2.928 -3.741 -1.924 1.00 0.00 O ATOM 0 H GLU A 91 -5.829 -6.977 0.924 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.184 -6.414 -1.912 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.430 -7.421 0.364 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.904 -7.190 -1.292 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.161 -4.805 -0.063 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.681 -5.328 0.715 1.00 0.00 H new ATOM 1504 N SER A 92 -4.907 -8.854 -2.586 1.00 0.00 N ATOM 1505 CA SER A 92 -5.082 -10.227 -3.044 1.00 0.00 C ATOM 1506 C SER A 92 -3.734 -10.908 -3.251 1.00 0.00 C ATOM 1507 O SER A 92 -2.908 -10.446 -4.038 1.00 0.00 O ATOM 1508 CB SER A 92 -5.884 -10.253 -4.347 1.00 0.00 C ATOM 1509 OG SER A 92 -6.737 -11.383 -4.398 1.00 0.00 O ATOM 0 H SER A 92 -4.493 -8.229 -3.277 1.00 0.00 H new ATOM 0 HA SER A 92 -5.630 -10.773 -2.276 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.477 -9.342 -4.431 1.00 0.00 H new ATOM 0 HB3 SER A 92 -5.202 -10.269 -5.197 1.00 0.00 H new ATOM 0 HG SER A 92 -7.240 -11.376 -5.239 1.00 0.00 H new ATOM 1515 N THR A 93 -3.519 -12.011 -2.540 1.00 0.00 N ATOM 1516 CA THR A 93 -2.270 -12.757 -2.647 1.00 0.00 C ATOM 1517 C THR A 93 -2.211 -13.532 -3.958 1.00 0.00 C ATOM 1518 O THR A 93 -3.231 -14.018 -4.450 1.00 0.00 O ATOM 1519 CB THR A 93 -2.123 -13.717 -1.465 1.00 0.00 C ATOM 1520 OG1 THR A 93 -0.954 -14.505 -1.603 1.00 0.00 O ATOM 1521 CG2 THR A 93 -3.297 -14.659 -1.311 1.00 0.00 C ATOM 0 H THR A 93 -4.193 -12.407 -1.885 1.00 0.00 H new ATOM 0 HA THR A 93 -1.446 -12.044 -2.631 1.00 0.00 H new ATOM 0 HB THR A 93 -2.069 -13.082 -0.581 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.225 -14.102 -1.086 1.00 0.00 H new ATOM 0 HG21 THR A 93 -3.129 -15.312 -0.455 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.208 -14.082 -1.154 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.400 -15.262 -2.213 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.013 -13.645 -4.521 1.00 0.00 N ATOM 1530 CA TRP A 94 -0.823 -14.363 -5.776 1.00 0.00 C ATOM 1531 C TRP A 94 0.585 -14.944 -5.864 1.00 0.00 C ATOM 1532 O TRP A 94 1.559 -14.212 -6.045 1.00 0.00 O ATOM 1533 CB TRP A 94 -1.083 -13.432 -6.963 1.00 0.00 C ATOM 1534 CG TRP A 94 -2.201 -13.893 -7.845 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -3.537 -13.685 -7.652 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -2.083 -14.642 -9.060 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -4.256 -14.259 -8.673 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -3.386 -14.852 -9.549 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -1.002 -15.155 -9.782 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -3.636 -15.554 -10.727 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -1.251 -15.850 -10.950 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -2.558 -16.043 -11.413 1.00 0.00 C ATOM 0 H TRP A 94 -0.159 -13.249 -4.128 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.536 -15.187 -5.807 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.312 -12.434 -6.589 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.172 -13.349 -7.556 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -3.966 -13.148 -6.819 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -5.272 -14.246 -8.764 1.00 0.00 H new ATOM 0 HE3 TRP A 94 0.010 -15.011 -9.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -4.644 -15.706 -11.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -0.423 -16.251 -11.516 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -2.719 -16.589 -12.331 1.00 0.00 H new ATOM 1553 N ARG A 95 0.685 -16.263 -5.736 1.00 0.00 N ATOM 1554 CA ARG A 95 1.974 -16.942 -5.800 1.00 0.00 C ATOM 1555 C ARG A 95 2.099 -17.751 -7.090 1.00 0.00 C ATOM 1556 O ARG A 95 1.110 -18.281 -7.597 1.00 0.00 O ATOM 1557 CB ARG A 95 2.153 -17.859 -4.590 1.00 0.00 C ATOM 1558 CG ARG A 95 2.818 -17.180 -3.404 1.00 0.00 C ATOM 1559 CD ARG A 95 3.481 -18.191 -2.482 1.00 0.00 C ATOM 1560 NE ARG A 95 3.609 -17.685 -1.117 1.00 0.00 N ATOM 1561 CZ ARG A 95 2.599 -17.625 -0.251 1.00 0.00 C ATOM 1562 NH1 ARG A 95 1.387 -18.034 -0.606 1.00 0.00 N ATOM 1563 NH2 ARG A 95 2.803 -17.153 0.971 1.00 0.00 N ATOM 0 H ARG A 95 -0.111 -16.883 -5.587 1.00 0.00 H new ATOM 0 HA ARG A 95 2.757 -16.184 -5.790 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.177 -18.235 -4.282 1.00 0.00 H new ATOM 0 HB3 ARG A 95 2.749 -18.723 -4.884 1.00 0.00 H new ATOM 0 HG2 ARG A 95 3.563 -16.469 -3.761 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.075 -16.610 -2.846 1.00 0.00 H new ATOM 0 HD2 ARG A 95 2.898 -19.112 -2.474 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.468 -18.442 -2.870 1.00 0.00 H new ATOM 0 HE ARG A 95 4.525 -17.359 -0.810 1.00 0.00 H new ATOM 0 HH11 ARG A 95 1.226 -18.396 -1.546 1.00 0.00 H new ATOM 0 HH12 ARG A 95 0.617 -17.986 0.061 1.00 0.00 H new ATOM 0 HH21 ARG A 95 3.733 -16.836 1.247 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.030 -17.106 1.635 1.00 0.00 H new ATOM 1577 N PRO A 96 3.322 -17.858 -7.639 1.00 0.00 N ATOM 1578 CA PRO A 96 3.567 -18.607 -8.874 1.00 0.00 C ATOM 1579 C PRO A 96 3.492 -20.115 -8.663 1.00 0.00 C ATOM 1580 O PRO A 96 3.256 -20.585 -7.549 1.00 0.00 O ATOM 1581 CB PRO A 96 4.988 -18.193 -9.259 1.00 0.00 C ATOM 1582 CG PRO A 96 5.640 -17.840 -7.967 1.00 0.00 C ATOM 1583 CD PRO A 96 4.556 -17.257 -7.100 1.00 0.00 C ATOM 0 HA PRO A 96 2.821 -18.390 -9.638 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.515 -19.005 -9.760 1.00 0.00 H new ATOM 0 HB3 PRO A 96 4.982 -17.346 -9.944 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.082 -18.720 -7.500 1.00 0.00 H new ATOM 0 HG3 PRO A 96 6.446 -17.122 -8.120 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.701 -17.512 -6.050 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.533 -16.169 -7.163 1.00 0.00 H new ATOM 1591 N LEU A 97 3.693 -20.870 -9.738 1.00 0.00 N ATOM 1592 CA LEU A 97 3.647 -22.326 -9.670 1.00 0.00 C ATOM 1593 C LEU A 97 5.049 -22.919 -9.776 1.00 0.00 C ATOM 1594 O LEU A 97 5.362 -23.636 -10.728 1.00 0.00 O ATOM 1595 CB LEU A 97 2.756 -22.882 -10.783 1.00 0.00 C ATOM 1596 CG LEU A 97 2.309 -24.331 -10.591 1.00 0.00 C ATOM 1597 CD1 LEU A 97 1.016 -24.391 -9.793 1.00 0.00 C ATOM 1598 CD2 LEU A 97 2.137 -25.018 -11.938 1.00 0.00 C ATOM 0 H LEU A 97 3.889 -20.497 -10.667 1.00 0.00 H new ATOM 0 HA LEU A 97 3.226 -22.608 -8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.870 -22.253 -10.867 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.292 -22.805 -11.729 1.00 0.00 H new ATOM 0 HG LEU A 97 3.082 -24.858 -10.031 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.714 -25.431 -9.667 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.171 -23.937 -8.814 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.235 -23.848 -10.325 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.819 -26.049 -11.783 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.384 -24.490 -12.522 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.085 -25.008 -12.475 1.00 0.00 H new ATOM 1610 N ALA A 98 5.890 -22.615 -8.793 1.00 0.00 N ATOM 1611 CA ALA A 98 7.258 -23.118 -8.777 1.00 0.00 C ATOM 1612 C ALA A 98 7.975 -22.717 -7.491 1.00 0.00 C ATOM 1613 O ALA A 98 8.364 -23.571 -6.694 1.00 0.00 O ATOM 1614 CB ALA A 98 8.023 -22.608 -9.989 1.00 0.00 C ATOM 0 H ALA A 98 5.648 -22.023 -7.998 1.00 0.00 H new ATOM 0 HA ALA A 98 7.219 -24.207 -8.817 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.043 -22.992 -9.963 1.00 0.00 H new ATOM 0 HB2 ALA A 98 7.530 -22.948 -10.900 1.00 0.00 H new ATOM 0 HB3 ALA A 98 8.045 -21.518 -9.973 1.00 0.00 H new ATOM 1620 N ASP A 99 8.147 -21.414 -7.297 1.00 0.00 N ATOM 1621 CA ASP A 99 8.817 -20.900 -6.108 1.00 0.00 C ATOM 1622 C ASP A 99 7.815 -20.260 -5.152 1.00 0.00 C ATOM 1623 O ASP A 99 6.980 -19.454 -5.562 1.00 0.00 O ATOM 1624 CB ASP A 99 9.888 -19.881 -6.501 1.00 0.00 C ATOM 1625 CG ASP A 99 10.895 -20.451 -7.481 1.00 0.00 C ATOM 1626 OD1 ASP A 99 11.207 -21.657 -7.379 1.00 0.00 O ATOM 1627 OD2 ASP A 99 11.374 -19.692 -8.350 1.00 0.00 O ATOM 0 H ASP A 99 7.832 -20.695 -7.948 1.00 0.00 H new ATOM 0 HA ASP A 99 9.293 -21.738 -5.599 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.410 -19.007 -6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.408 -19.541 -5.606 1.00 0.00 H new ATOM 1633 N GLU A 100 7.907 -20.622 -3.877 1.00 0.00 N ATOM 1634 CA GLU A 100 7.009 -20.082 -2.863 1.00 0.00 C ATOM 1635 C GLU A 100 7.681 -18.953 -2.088 1.00 0.00 C ATOM 1636 O GLU A 100 7.445 -18.782 -0.891 1.00 0.00 O ATOM 1637 CB GLU A 100 6.570 -21.187 -1.900 1.00 0.00 C ATOM 1638 CG GLU A 100 5.132 -21.047 -1.429 1.00 0.00 C ATOM 1639 CD GLU A 100 4.629 -22.287 -0.716 1.00 0.00 C ATOM 1640 OE1 GLU A 100 3.760 -22.984 -1.278 1.00 0.00 O ATOM 1641 OE2 GLU A 100 5.105 -22.560 0.407 1.00 0.00 O ATOM 0 H GLU A 100 8.594 -21.287 -3.521 1.00 0.00 H new ATOM 0 HA GLU A 100 6.131 -19.680 -3.368 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.691 -22.153 -2.390 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.230 -21.185 -1.032 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.055 -20.191 -0.759 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.491 -20.840 -2.286 1.00 0.00 H new ATOM 1649 N ASN A 101 8.519 -18.186 -2.777 1.00 0.00 N ATOM 1650 CA ASN A 101 9.225 -17.073 -2.153 1.00 0.00 C ATOM 1651 C ASN A 101 8.656 -15.737 -2.620 1.00 0.00 C ATOM 1652 O ASN A 101 8.317 -14.878 -1.806 1.00 0.00 O ATOM 1653 CB ASN A 101 10.719 -17.145 -2.478 1.00 0.00 C ATOM 1654 CG ASN A 101 11.537 -16.171 -1.652 1.00 0.00 C ATOM 1655 OD1 ASN A 101 11.452 -16.155 -0.425 1.00 0.00 O ATOM 1656 ND2 ASN A 101 12.336 -15.351 -2.326 1.00 0.00 N ATOM 0 H ASN A 101 8.726 -18.315 -3.767 1.00 0.00 H new ATOM 0 HA ASN A 101 9.089 -17.148 -1.074 1.00 0.00 H new ATOM 0 HB2 ASN A 101 11.078 -18.159 -2.301 1.00 0.00 H new ATOM 0 HB3 ASN A 101 10.868 -16.934 -3.537 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.911 -14.673 -1.825 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.375 -15.399 -3.344 1.00 0.00 H new ATOM 1663 N PHE A 102 8.555 -15.569 -3.935 1.00 0.00 N ATOM 1664 CA PHE A 102 8.027 -14.338 -4.509 1.00 0.00 C ATOM 1665 C PHE A 102 6.538 -14.192 -4.215 1.00 0.00 C ATOM 1666 O PHE A 102 5.730 -15.028 -4.621 1.00 0.00 O ATOM 1667 CB PHE A 102 8.264 -14.313 -6.020 1.00 0.00 C ATOM 1668 CG PHE A 102 8.460 -12.930 -6.575 1.00 0.00 C ATOM 1669 CD1 PHE A 102 7.440 -11.995 -6.518 1.00 0.00 C ATOM 1670 CD2 PHE A 102 9.666 -12.566 -7.152 1.00 0.00 C ATOM 1671 CE1 PHE A 102 7.617 -10.723 -7.027 1.00 0.00 C ATOM 1672 CE2 PHE A 102 9.850 -11.295 -7.663 1.00 0.00 C ATOM 1673 CZ PHE A 102 8.825 -10.372 -7.600 1.00 0.00 C ATOM 0 H PHE A 102 8.832 -16.270 -4.622 1.00 0.00 H new ATOM 0 HA PHE A 102 8.552 -13.500 -4.050 1.00 0.00 H new ATOM 0 HB2 PHE A 102 9.142 -14.916 -6.252 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.415 -14.779 -6.520 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.495 -12.264 -6.070 1.00 0.00 H new ATOM 0 HD2 PHE A 102 10.471 -13.284 -7.203 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.813 -10.004 -6.977 1.00 0.00 H new ATOM 0 HE2 PHE A 102 10.795 -11.024 -8.111 1.00 0.00 H new ATOM 0 HZ PHE A 102 8.967 -9.378 -7.998 1.00 0.00 H new ATOM 1683 N HIS A 103 6.182 -13.127 -3.505 1.00 0.00 N ATOM 1684 CA HIS A 103 4.789 -12.872 -3.155 1.00 0.00 C ATOM 1685 C HIS A 103 4.219 -11.729 -3.989 1.00 0.00 C ATOM 1686 O HIS A 103 4.858 -10.690 -4.156 1.00 0.00 O ATOM 1687 CB HIS A 103 4.668 -12.540 -1.666 1.00 0.00 C ATOM 1688 CG HIS A 103 3.271 -12.655 -1.139 1.00 0.00 C ATOM 1689 ND1 HIS A 103 2.322 -11.668 -1.302 1.00 0.00 N ATOM 1690 CD2 HIS A 103 2.663 -13.648 -0.448 1.00 0.00 C ATOM 1691 CE1 HIS A 103 1.192 -12.049 -0.734 1.00 0.00 C ATOM 1692 NE2 HIS A 103 1.372 -13.247 -0.210 1.00 0.00 N ATOM 0 H HIS A 103 6.838 -12.426 -3.161 1.00 0.00 H new ATOM 0 HA HIS A 103 4.216 -13.775 -3.368 1.00 0.00 H new ATOM 0 HB2 HIS A 103 5.317 -13.207 -1.099 1.00 0.00 H new ATOM 0 HB3 HIS A 103 5.029 -11.525 -1.498 1.00 0.00 H new ATOM 0 HD1 HIS A 103 2.470 -10.782 -1.786 1.00 0.00 H new ATOM 0 HD2 HIS A 103 3.111 -14.582 -0.141 1.00 0.00 H new ATOM 0 HE1 HIS A 103 0.276 -11.477 -0.704 1.00 0.00 H new ATOM 1701 N LEU A 104 3.014 -11.929 -4.513 1.00 0.00 N ATOM 1702 CA LEU A 104 2.358 -10.915 -5.331 1.00 0.00 C ATOM 1703 C LEU A 104 1.123 -10.363 -4.627 1.00 0.00 C ATOM 1704 O LEU A 104 0.325 -11.118 -4.069 1.00 0.00 O ATOM 1705 CB LEU A 104 1.967 -11.501 -6.689 1.00 0.00 C ATOM 1706 CG LEU A 104 2.033 -10.521 -7.861 1.00 0.00 C ATOM 1707 CD1 LEU A 104 2.403 -11.247 -9.145 1.00 0.00 C ATOM 1708 CD2 LEU A 104 0.706 -9.793 -8.021 1.00 0.00 C ATOM 0 H LEU A 104 2.472 -12.784 -4.386 1.00 0.00 H new ATOM 0 HA LEU A 104 3.061 -10.097 -5.485 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.621 -12.346 -6.905 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.952 -11.893 -6.620 1.00 0.00 H new ATOM 0 HG LEU A 104 2.807 -9.783 -7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.445 -10.533 -9.968 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.377 -11.722 -9.027 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.653 -12.007 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 104 0.770 -9.099 -8.859 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.086 -10.518 -8.209 1.00 0.00 H new ATOM 0 HD23 LEU A 104 0.482 -9.240 -7.109 1.00 0.00 H new ATOM 1720 N GLY A 105 0.971 -9.044 -4.657 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.169 -8.413 -4.019 1.00 0.00 C ATOM 1722 C GLY A 105 -0.800 -7.340 -4.886 1.00 0.00 C ATOM 1723 O GLY A 105 -0.105 -6.473 -5.415 1.00 0.00 O ATOM 0 H GLY A 105 1.618 -8.400 -5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.916 -9.172 -3.784 1.00 0.00 H new ATOM 0 HA3 GLY A 105 0.146 -7.972 -3.073 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.120 -7.400 -5.031 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.844 -6.427 -5.841 1.00 0.00 C ATOM 1729 C LEU A 106 -4.242 -6.188 -5.280 1.00 0.00 C ATOM 1730 O LEU A 106 -4.996 -7.130 -5.040 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.939 -6.907 -7.290 1.00 0.00 C ATOM 1732 CG LEU A 106 -3.037 -5.795 -8.336 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -4.314 -4.992 -8.144 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -1.818 -4.887 -8.260 1.00 0.00 C ATOM 0 H LEU A 106 -2.709 -8.111 -4.599 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.294 -5.487 -5.813 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.064 -7.518 -7.512 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.812 -7.553 -7.386 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.066 -6.252 -9.325 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.366 -4.206 -8.897 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -5.177 -5.650 -8.246 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -4.316 -4.544 -7.151 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -1.902 -4.101 -9.010 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.760 -4.438 -7.269 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -0.917 -5.471 -8.447 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.583 -4.919 -5.074 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.889 -4.579 -4.544 1.00 0.00 C ATOM 1748 C GLY A 107 -6.069 -3.085 -4.354 1.00 0.00 C ATOM 1749 O GLY A 107 -5.350 -2.286 -4.955 1.00 0.00 O ATOM 0 H GLY A 107 -3.977 -4.121 -5.265 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.659 -4.951 -5.219 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.032 -5.083 -3.588 1.00 0.00 H new ATOM 1753 N PHE A 108 -7.028 -2.708 -3.516 1.00 0.00 N ATOM 1754 CA PHE A 108 -7.300 -1.301 -3.248 1.00 0.00 C ATOM 1755 C PHE A 108 -6.970 -0.950 -1.801 1.00 0.00 C ATOM 1756 O PHE A 108 -6.842 -1.833 -0.952 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.767 -0.978 -3.542 1.00 0.00 C ATOM 1758 CG PHE A 108 -9.195 -1.344 -4.934 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -9.565 -2.644 -5.240 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -9.227 -0.389 -5.937 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -9.959 -2.984 -6.520 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -9.620 -0.722 -7.219 1.00 0.00 C ATOM 1763 CZ PHE A 108 -9.986 -2.022 -7.511 1.00 0.00 C ATOM 0 H PHE A 108 -7.630 -3.358 -3.010 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.666 -0.703 -3.902 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.397 -1.506 -2.826 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.934 0.088 -3.388 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -9.545 -3.400 -4.469 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.941 0.628 -5.714 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -10.245 -4.001 -6.745 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.641 0.032 -7.992 1.00 0.00 H new ATOM 0 HZ PHE A 108 -10.293 -2.286 -8.512 1.00 0.00 H new ATOM 1773 N THR A 109 -6.835 0.343 -1.526 1.00 0.00 N ATOM 1774 CA THR A 109 -6.520 0.808 -0.182 1.00 0.00 C ATOM 1775 C THR A 109 -7.324 2.057 0.166 1.00 0.00 C ATOM 1776 O THR A 109 -7.189 3.094 -0.482 1.00 0.00 O ATOM 1777 CB THR A 109 -5.024 1.100 -0.057 1.00 0.00 C ATOM 1778 OG1 THR A 109 -4.260 -0.032 -0.435 1.00 0.00 O ATOM 1779 CG2 THR A 109 -4.604 1.490 1.344 1.00 0.00 C ATOM 0 H THR A 109 -6.939 1.087 -2.216 1.00 0.00 H new ATOM 0 HA THR A 109 -6.789 0.018 0.519 1.00 0.00 H new ATOM 0 HB THR A 109 -4.838 1.943 -0.722 1.00 0.00 H new ATOM 0 HG1 THR A 109 -4.083 -0.585 0.354 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.531 1.683 1.362 1.00 0.00 H new ATOM 0 HG22 THR A 109 -5.140 2.389 1.647 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.838 0.679 2.033 1.00 0.00 H new ATOM 1787 N ALA A 110 -8.159 1.950 1.194 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.983 3.071 1.629 1.00 0.00 C ATOM 1789 C ALA A 110 -8.618 3.502 3.046 1.00 0.00 C ATOM 1790 O ALA A 110 -8.818 2.756 4.004 1.00 0.00 O ATOM 1791 CB ALA A 110 -10.458 2.701 1.552 1.00 0.00 C ATOM 0 H ALA A 110 -8.283 1.098 1.741 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.794 3.911 0.961 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -11.063 3.547 1.880 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.716 2.447 0.524 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.652 1.844 2.197 1.00 0.00 H new ATOM 1797 N GLY A 111 -8.082 4.712 3.170 1.00 0.00 N ATOM 1798 CA GLY A 111 -7.697 5.222 4.473 1.00 0.00 C ATOM 1799 C GLY A 111 -8.343 6.557 4.787 1.00 0.00 C ATOM 1800 O GLY A 111 -8.738 7.291 3.880 1.00 0.00 O ATOM 0 H GLY A 111 -7.908 5.348 2.392 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -7.974 4.498 5.239 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.613 5.328 4.512 1.00 0.00 H new ATOM 1804 N VAL A 112 -8.450 6.873 6.073 1.00 0.00 N ATOM 1805 CA VAL A 112 -9.053 8.129 6.504 1.00 0.00 C ATOM 1806 C VAL A 112 -8.034 9.010 7.218 1.00 0.00 C ATOM 1807 O VAL A 112 -7.214 8.524 7.995 1.00 0.00 O ATOM 1808 CB VAL A 112 -10.251 7.886 7.440 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -11.459 7.407 6.650 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -9.885 6.887 8.527 1.00 0.00 C ATOM 0 H VAL A 112 -8.127 6.277 6.835 1.00 0.00 H new ATOM 0 HA VAL A 112 -9.403 8.637 5.605 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.511 8.830 7.919 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -12.295 7.241 7.329 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.734 8.162 5.913 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -11.214 6.475 6.141 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -10.744 6.728 9.179 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -9.596 5.941 8.069 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -9.052 7.276 9.113 1.00 0.00 H new ATOM 1820 N THR A 113 -8.094 10.311 6.949 1.00 0.00 N ATOM 1821 CA THR A 113 -7.178 11.262 7.566 1.00 0.00 C ATOM 1822 C THR A 113 -7.937 12.453 8.143 1.00 0.00 C ATOM 1823 O THR A 113 -8.835 12.998 7.503 1.00 0.00 O ATOM 1824 CB THR A 113 -6.147 11.746 6.545 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.912 10.754 5.561 1.00 0.00 O ATOM 1826 CG2 THR A 113 -4.814 12.103 7.164 1.00 0.00 C ATOM 0 H THR A 113 -8.768 10.730 6.308 1.00 0.00 H new ATOM 0 HA THR A 113 -6.662 10.754 8.380 1.00 0.00 H new ATOM 0 HB THR A 113 -6.577 12.645 6.104 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.251 11.083 4.916 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.129 12.438 6.385 1.00 0.00 H new ATOM 0 HG22 THR A 113 -4.953 12.901 7.893 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.397 11.227 7.661 1.00 0.00 H new ATOM 1834 N ALA A 114 -7.571 12.850 9.358 1.00 0.00 N ATOM 1835 CA ALA A 114 -8.216 13.976 10.021 1.00 0.00 C ATOM 1836 C ALA A 114 -7.419 15.261 9.825 1.00 0.00 C ATOM 1837 O ALA A 114 -6.189 15.253 9.876 1.00 0.00 O ATOM 1838 CB ALA A 114 -8.393 13.683 11.503 1.00 0.00 C ATOM 0 H ALA A 114 -6.831 12.408 9.903 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.198 14.118 9.569 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -8.876 14.532 11.987 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.012 12.794 11.627 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.418 13.512 11.959 1.00 0.00 H new ATOM 1844 N ARG A 115 -8.127 16.362 9.600 1.00 0.00 N ATOM 1845 CA ARG A 115 -7.485 17.655 9.396 1.00 0.00 C ATOM 1846 C ARG A 115 -8.524 18.767 9.287 1.00 0.00 C ATOM 1847 O ARG A 115 -9.022 19.059 8.200 1.00 0.00 O ATOM 1848 CB ARG A 115 -6.618 17.626 8.137 1.00 0.00 C ATOM 1849 CG ARG A 115 -5.699 18.829 8.002 1.00 0.00 C ATOM 1850 CD ARG A 115 -5.268 19.043 6.560 1.00 0.00 C ATOM 1851 NE ARG A 115 -6.344 19.603 5.745 1.00 0.00 N ATOM 1852 CZ ARG A 115 -6.152 20.178 4.560 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -4.931 20.272 4.049 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -7.185 20.663 3.883 1.00 0.00 N ATOM 0 H ARG A 115 -9.146 16.385 9.554 1.00 0.00 H new ATOM 0 HA ARG A 115 -6.851 17.857 10.259 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -6.015 16.718 8.142 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -7.265 17.574 7.262 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -6.209 19.721 8.366 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -4.818 18.687 8.629 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.408 19.712 6.534 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -4.946 18.093 6.133 1.00 0.00 H new ATOM 0 HE ARG A 115 -7.297 19.550 6.105 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -4.132 19.902 4.565 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -4.791 20.714 3.140 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -8.126 20.595 4.271 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -7.038 21.104 2.975 1.00 0.00 H new ATOM 1868 N ASP A 116 -8.845 19.384 10.420 1.00 0.00 N ATOM 1869 CA ASP A 116 -9.823 20.465 10.450 1.00 0.00 C ATOM 1870 C ASP A 116 -9.958 21.037 11.858 1.00 0.00 C ATOM 1871 O ASP A 116 -9.226 20.651 12.769 1.00 0.00 O ATOM 1872 CB ASP A 116 -11.184 19.964 9.960 1.00 0.00 C ATOM 1873 CG ASP A 116 -11.919 21.002 9.136 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -12.051 22.152 9.608 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -12.362 20.668 8.017 1.00 0.00 O ATOM 0 H ASP A 116 -8.442 19.154 11.328 1.00 0.00 H new ATOM 0 HA ASP A 116 -9.473 21.256 9.786 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -11.043 19.063 9.363 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -11.796 19.685 10.818 1.00 0.00 H new ATOM 1881 N ASN A 117 -10.899 21.961 12.028 1.00 0.00 N ATOM 1882 CA ASN A 117 -11.129 22.588 13.324 1.00 0.00 C ATOM 1883 C ASN A 117 -12.206 21.840 14.104 1.00 0.00 C ATOM 1884 O ASN A 117 -12.000 21.458 15.257 1.00 0.00 O ATOM 1885 CB ASN A 117 -11.538 24.050 13.141 1.00 0.00 C ATOM 1886 CG ASN A 117 -11.606 24.800 14.457 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -10.868 24.498 15.395 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -12.494 25.784 14.533 1.00 0.00 N ATOM 0 H ASN A 117 -11.514 22.292 11.284 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.199 22.547 13.891 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -10.825 24.544 12.481 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -12.510 24.094 12.650 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -12.585 26.324 15.394 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.086 26.000 13.731 1.00 0.00 H new ATOM 1895 N TRP A 118 -13.356 21.637 13.469 1.00 0.00 N ATOM 1896 CA TRP A 118 -14.466 20.936 14.104 1.00 0.00 C ATOM 1897 C TRP A 118 -14.500 19.472 13.676 1.00 0.00 C ATOM 1898 O TRP A 118 -14.883 19.152 12.551 1.00 0.00 O ATOM 1899 CB TRP A 118 -15.791 21.613 13.753 1.00 0.00 C ATOM 1900 CG TRP A 118 -15.938 22.977 14.355 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -14.987 23.956 14.408 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -17.104 23.514 14.988 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -15.492 25.069 15.037 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -16.789 24.823 15.402 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -18.385 23.016 15.246 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -17.707 25.638 16.059 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -19.296 23.827 15.897 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -18.954 25.125 16.297 1.00 0.00 C ATOM 0 H TRP A 118 -13.543 21.948 12.516 1.00 0.00 H new ATOM 0 HA TRP A 118 -14.320 20.977 15.183 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -15.875 21.691 12.669 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -16.614 20.983 14.092 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -13.985 23.868 14.014 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -14.983 25.937 15.205 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -18.658 22.016 14.942 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -17.445 26.639 16.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -20.289 23.453 16.101 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -19.689 25.733 16.803 1.00 0.00 H new ATOM 1919 N ASN A 119 -14.095 18.587 14.582 1.00 0.00 N ATOM 1920 CA ASN A 119 -14.079 17.156 14.298 1.00 0.00 C ATOM 1921 C ASN A 119 -15.485 16.643 14.003 1.00 0.00 C ATOM 1922 O ASN A 119 -16.324 16.551 14.898 1.00 0.00 O ATOM 1923 CB ASN A 119 -13.481 16.388 15.479 1.00 0.00 C ATOM 1924 CG ASN A 119 -11.990 16.621 15.625 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -11.291 16.874 14.644 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -11.496 16.536 16.854 1.00 0.00 N ATOM 0 H ASN A 119 -13.774 18.835 15.518 1.00 0.00 H new ATOM 0 HA ASN A 119 -13.460 16.993 13.416 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -13.985 16.690 16.397 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -13.668 15.322 15.348 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -10.499 16.683 17.014 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -12.113 16.324 17.638 1.00 0.00 H new ATOM 1933 N TYR A 120 -15.733 16.310 12.741 1.00 0.00 N ATOM 1934 CA TYR A 120 -17.037 15.806 12.325 1.00 0.00 C ATOM 1935 C TYR A 120 -16.887 14.556 11.465 1.00 0.00 C ATOM 1936 O TYR A 120 -17.232 13.453 11.890 1.00 0.00 O ATOM 1937 CB TYR A 120 -17.803 16.883 11.555 1.00 0.00 C ATOM 1938 CG TYR A 120 -18.603 17.809 12.441 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -19.540 17.308 13.337 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -18.422 19.185 12.384 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -20.273 18.152 14.149 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -19.152 20.035 13.193 1.00 0.00 C ATOM 1943 CZ TYR A 120 -20.076 19.514 14.073 1.00 0.00 C ATOM 1944 OH TYR A 120 -20.804 20.356 14.880 1.00 0.00 O ATOM 0 H TYR A 120 -15.048 16.380 11.988 1.00 0.00 H new ATOM 0 HA TYR A 120 -17.600 15.543 13.221 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -17.096 17.473 10.972 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -18.476 16.401 10.846 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -19.698 16.241 13.400 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -17.699 19.597 11.696 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -20.997 17.746 14.840 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -18.999 21.103 13.136 1.00 0.00 H new ATOM 0 HH TYR A 120 -20.544 21.284 14.703 1.00 0.00 H new ATOM 1954 N ILE A 121 -16.369 14.735 10.255 1.00 0.00 N ATOM 1955 CA ILE A 121 -16.170 13.621 9.335 1.00 0.00 C ATOM 1956 C ILE A 121 -14.740 13.600 8.800 1.00 0.00 C ATOM 1957 O ILE A 121 -14.172 14.646 8.486 1.00 0.00 O ATOM 1958 CB ILE A 121 -17.149 13.692 8.148 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -17.093 15.073 7.492 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -18.564 13.375 8.608 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -17.237 15.033 5.987 1.00 0.00 C ATOM 0 H ILE A 121 -16.079 15.641 9.888 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.359 12.707 9.898 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.853 12.948 7.409 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -17.884 15.696 7.908 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.146 15.549 7.746 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -19.244 13.429 7.758 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.593 12.371 9.032 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -18.871 14.097 9.365 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -17.188 16.047 5.590 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.431 14.437 5.560 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -18.196 14.587 5.725 1.00 0.00 H new ATOM 1973 N PRO A 122 -14.134 12.404 8.689 1.00 0.00 N ATOM 1974 CA PRO A 122 -12.765 12.258 8.191 1.00 0.00 C ATOM 1975 C PRO A 122 -12.678 12.414 6.677 1.00 0.00 C ATOM 1976 O PRO A 122 -13.691 12.600 6.002 1.00 0.00 O ATOM 1977 CB PRO A 122 -12.395 10.834 8.603 1.00 0.00 C ATOM 1978 CG PRO A 122 -13.691 10.101 8.618 1.00 0.00 C ATOM 1979 CD PRO A 122 -14.735 11.102 9.043 1.00 0.00 C ATOM 0 HA PRO A 122 -12.099 13.022 8.592 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -11.694 10.386 7.898 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -11.917 10.816 9.583 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -13.920 9.694 7.633 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.654 9.259 9.310 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.679 10.942 8.522 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -14.944 11.034 10.111 1.00 0.00 H new ATOM 1987 N LEU A 123 -11.461 12.337 6.147 1.00 0.00 N ATOM 1988 CA LEU A 123 -11.240 12.468 4.713 1.00 0.00 C ATOM 1989 C LEU A 123 -10.745 11.151 4.117 1.00 0.00 C ATOM 1990 O LEU A 123 -9.540 10.910 4.041 1.00 0.00 O ATOM 1991 CB LEU A 123 -10.231 13.582 4.430 1.00 0.00 C ATOM 1992 CG LEU A 123 -10.841 14.968 4.211 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -9.879 16.053 4.670 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -11.209 15.162 2.747 1.00 0.00 C ATOM 0 H LEU A 123 -10.612 12.184 6.691 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.191 12.723 4.245 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.531 13.638 5.264 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -9.653 13.312 3.546 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.751 15.043 4.807 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.330 17.032 4.507 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.665 15.925 5.731 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.952 15.981 4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -11.642 16.153 2.609 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.314 15.067 2.131 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -11.935 14.405 2.451 1.00 0.00 H new ATOM 2006 N PRO A 124 -11.673 10.278 3.687 1.00 0.00 N ATOM 2007 CA PRO A 124 -11.322 8.981 3.098 1.00 0.00 C ATOM 2008 C PRO A 124 -10.658 9.126 1.733 1.00 0.00 C ATOM 2009 O PRO A 124 -10.901 10.094 1.012 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.671 8.273 2.965 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.672 9.372 2.887 1.00 0.00 C ATOM 2012 CD PRO A 124 -13.131 10.485 3.742 1.00 0.00 C ATOM 0 HA PRO A 124 -10.601 8.438 3.709 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.702 7.646 2.074 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.863 7.623 3.819 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.810 9.702 1.857 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.645 9.040 3.248 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.413 11.464 3.354 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.507 10.427 4.763 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.820 8.156 1.383 1.00 0.00 N ATOM 2021 CA VAL A 125 -9.122 8.174 0.104 1.00 0.00 C ATOM 2022 C VAL A 125 -8.847 6.757 -0.392 1.00 0.00 C ATOM 2023 O VAL A 125 -8.218 5.958 0.299 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.788 8.938 0.203 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -8.035 10.436 0.279 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -6.987 8.461 1.405 1.00 0.00 C ATOM 0 H VAL A 125 -9.608 7.348 1.968 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.774 8.685 -0.605 1.00 0.00 H new ATOM 0 HB VAL A 125 -7.206 8.734 -0.696 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -7.081 10.959 0.348 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.564 10.763 -0.616 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -8.637 10.661 1.159 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.048 9.012 1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.561 8.632 2.316 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.777 7.396 1.303 1.00 0.00 H new ATOM 2036 N LEU A 126 -9.325 6.455 -1.595 1.00 0.00 N ATOM 2037 CA LEU A 126 -9.133 5.135 -2.184 1.00 0.00 C ATOM 2038 C LEU A 126 -8.281 5.220 -3.447 1.00 0.00 C ATOM 2039 O LEU A 126 -8.613 5.945 -4.384 1.00 0.00 O ATOM 2040 CB LEU A 126 -10.484 4.497 -2.509 1.00 0.00 C ATOM 2041 CG LEU A 126 -10.543 2.979 -2.334 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -11.946 2.540 -1.944 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -10.100 2.278 -3.610 1.00 0.00 C ATOM 0 H LEU A 126 -9.848 7.106 -2.181 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.611 4.514 -1.457 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.245 4.950 -1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.744 4.739 -3.540 1.00 0.00 H new ATOM 0 HG LEU A 126 -9.860 2.699 -1.532 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.968 1.457 -1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -12.228 3.015 -1.004 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.649 2.833 -2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -10.148 1.198 -3.468 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -10.758 2.566 -4.430 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -9.076 2.567 -3.847 1.00 0.00 H new ATOM 2055 N LEU A 127 -7.181 4.473 -3.464 1.00 0.00 N ATOM 2056 CA LEU A 127 -6.281 4.463 -4.611 1.00 0.00 C ATOM 2057 C LEU A 127 -5.651 3.085 -4.798 1.00 0.00 C ATOM 2058 O LEU A 127 -5.561 2.303 -3.852 1.00 0.00 O ATOM 2059 CB LEU A 127 -5.186 5.518 -4.437 1.00 0.00 C ATOM 2060 CG LEU A 127 -5.679 6.894 -3.985 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -5.768 6.956 -2.468 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -4.760 7.986 -4.513 1.00 0.00 C ATOM 0 H LEU A 127 -6.892 3.867 -2.696 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.865 4.699 -5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.462 5.151 -3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.658 5.631 -5.384 1.00 0.00 H new ATOM 0 HG LEU A 127 -6.677 7.056 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -6.120 7.942 -2.164 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -6.465 6.196 -2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.783 6.774 -2.038 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.124 8.959 -4.183 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.751 7.828 -4.132 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -4.746 7.954 -5.602 1.00 0.00 H new ATOM 2074 N PRO A 128 -5.205 2.769 -6.027 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.581 1.476 -6.333 1.00 0.00 C ATOM 2076 C PRO A 128 -3.313 1.242 -5.518 1.00 0.00 C ATOM 2077 O PRO A 128 -2.591 2.183 -5.191 1.00 0.00 O ATOM 2078 CB PRO A 128 -4.244 1.576 -7.826 1.00 0.00 C ATOM 2079 CG PRO A 128 -5.105 2.674 -8.348 1.00 0.00 C ATOM 2080 CD PRO A 128 -5.274 3.640 -7.211 1.00 0.00 C ATOM 0 HA PRO A 128 -5.240 0.642 -6.090 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -3.188 1.798 -7.977 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -4.449 0.637 -8.340 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -4.641 3.159 -9.207 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -6.069 2.290 -8.681 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -4.489 4.396 -7.203 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -6.225 4.169 -7.268 1.00 0.00 H new ATOM 2088 N LEU A 129 -3.049 -0.020 -5.193 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.868 -0.376 -4.416 1.00 0.00 C ATOM 2090 C LEU A 129 -1.385 -1.778 -4.772 1.00 0.00 C ATOM 2091 O LEU A 129 -2.181 -2.653 -5.113 1.00 0.00 O ATOM 2092 CB LEU A 129 -2.172 -0.293 -2.920 1.00 0.00 C ATOM 2093 CG LEU A 129 -0.942 -0.233 -2.011 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -0.506 1.208 -1.799 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -1.234 -0.905 -0.678 1.00 0.00 C ATOM 0 H LEU A 129 -3.636 -0.812 -5.455 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.077 0.334 -4.658 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.783 0.591 -2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.771 -1.159 -2.638 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.127 -0.770 -2.496 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.370 1.232 -1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.258 1.658 -2.760 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.317 1.769 -1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.349 -0.854 -0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.063 -0.395 -0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.499 -1.949 -0.847 1.00 0.00 H new ATOM 2107 N ALA A 130 -0.074 -1.986 -4.689 1.00 0.00 N ATOM 2108 CA ALA A 130 0.517 -3.281 -5.000 1.00 0.00 C ATOM 2109 C ALA A 130 1.707 -3.572 -4.092 1.00 0.00 C ATOM 2110 O ALA A 130 2.565 -2.715 -3.884 1.00 0.00 O ATOM 2111 CB ALA A 130 0.940 -3.330 -6.460 1.00 0.00 C ATOM 0 H ALA A 130 0.599 -1.273 -4.409 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.236 -4.049 -4.826 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.380 -4.303 -6.679 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.069 -3.174 -7.097 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.675 -2.548 -6.652 1.00 0.00 H new ATOM 2117 N SER A 131 1.750 -4.786 -3.551 1.00 0.00 N ATOM 2118 CA SER A 131 2.835 -5.188 -2.663 1.00 0.00 C ATOM 2119 C SER A 131 3.629 -6.345 -3.261 1.00 0.00 C ATOM 2120 O SER A 131 3.090 -7.160 -4.009 1.00 0.00 O ATOM 2121 CB SER A 131 2.280 -5.589 -1.296 1.00 0.00 C ATOM 2122 OG SER A 131 1.736 -6.897 -1.329 1.00 0.00 O ATOM 0 H SER A 131 1.047 -5.507 -3.712 1.00 0.00 H new ATOM 0 HA SER A 131 3.505 -4.337 -2.541 1.00 0.00 H new ATOM 0 HB2 SER A 131 3.073 -5.541 -0.550 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.511 -4.880 -0.990 1.00 0.00 H new ATOM 0 HG SER A 131 1.390 -7.130 -0.442 1.00 0.00 H new ATOM 2128 N VAL A 132 4.913 -6.410 -2.924 1.00 0.00 N ATOM 2129 CA VAL A 132 5.783 -7.467 -3.426 1.00 0.00 C ATOM 2130 C VAL A 132 6.632 -8.056 -2.305 1.00 0.00 C ATOM 2131 O VAL A 132 7.426 -7.354 -1.680 1.00 0.00 O ATOM 2132 CB VAL A 132 6.713 -6.949 -4.538 1.00 0.00 C ATOM 2133 CG1 VAL A 132 7.465 -8.101 -5.187 1.00 0.00 C ATOM 2134 CG2 VAL A 132 5.921 -6.168 -5.577 1.00 0.00 C ATOM 0 H VAL A 132 5.374 -5.743 -2.305 1.00 0.00 H new ATOM 0 HA VAL A 132 5.135 -8.242 -3.836 1.00 0.00 H new ATOM 0 HB VAL A 132 7.443 -6.276 -4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 132 8.117 -7.715 -5.970 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.065 -8.613 -4.435 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.752 -8.802 -5.621 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.595 -5.810 -6.355 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.166 -6.816 -6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.434 -5.318 -5.100 1.00 0.00 H new ATOM 2144 N GLY A 133 6.457 -9.351 -2.054 1.00 0.00 N ATOM 2145 CA GLY A 133 7.213 -10.011 -1.007 1.00 0.00 C ATOM 2146 C GLY A 133 8.472 -10.674 -1.530 1.00 0.00 C ATOM 2147 O GLY A 133 8.403 -11.630 -2.304 1.00 0.00 O ATOM 0 H GLY A 133 5.805 -9.953 -2.557 1.00 0.00 H new ATOM 0 HA2 GLY A 133 7.481 -9.282 -0.242 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.584 -10.761 -0.527 1.00 0.00 H new ATOM 2151 N TYR A 134 9.625 -10.167 -1.107 1.00 0.00 N ATOM 2152 CA TYR A 134 10.906 -10.717 -1.537 1.00 0.00 C ATOM 2153 C TYR A 134 11.872 -10.826 -0.361 1.00 0.00 C ATOM 2154 O TYR A 134 12.280 -9.817 0.217 1.00 0.00 O ATOM 2155 CB TYR A 134 11.517 -9.844 -2.634 1.00 0.00 C ATOM 2156 CG TYR A 134 12.358 -10.617 -3.626 1.00 0.00 C ATOM 2157 CD1 TYR A 134 13.366 -11.469 -3.195 1.00 0.00 C ATOM 2158 CD2 TYR A 134 12.142 -10.493 -4.993 1.00 0.00 C ATOM 2159 CE1 TYR A 134 14.137 -12.176 -4.098 1.00 0.00 C ATOM 2160 CE2 TYR A 134 12.909 -11.198 -5.902 1.00 0.00 C ATOM 2161 CZ TYR A 134 13.904 -12.037 -5.449 1.00 0.00 C ATOM 2162 OH TYR A 134 14.669 -12.740 -6.351 1.00 0.00 O ATOM 0 H TYR A 134 9.699 -9.376 -0.467 1.00 0.00 H new ATOM 0 HA TYR A 134 10.730 -11.717 -1.934 1.00 0.00 H new ATOM 0 HB2 TYR A 134 10.716 -9.334 -3.169 1.00 0.00 H new ATOM 0 HB3 TYR A 134 12.133 -9.073 -2.172 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.551 -11.581 -2.137 1.00 0.00 H new ATOM 0 HD2 TYR A 134 11.363 -9.836 -5.351 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.918 -12.834 -3.747 1.00 0.00 H new ATOM 0 HE2 TYR A 134 12.729 -11.092 -6.962 1.00 0.00 H new ATOM 0 HH TYR A 134 14.376 -12.530 -7.262 1.00 0.00 H new ATOM 2172 N GLY A 135 12.235 -12.056 -0.011 1.00 0.00 N ATOM 2173 CA GLY A 135 13.149 -12.272 1.093 1.00 0.00 C ATOM 2174 C GLY A 135 12.620 -11.715 2.402 1.00 0.00 C ATOM 2175 O GLY A 135 11.407 -11.657 2.607 1.00 0.00 O ATOM 0 H GLY A 135 11.912 -12.906 -0.473 1.00 0.00 H new ATOM 0 HA2 GLY A 135 13.333 -13.341 1.204 1.00 0.00 H new ATOM 0 HA3 GLY A 135 14.107 -11.806 0.864 1.00 0.00 H new ATOM 2179 N PRO A 136 13.512 -11.295 3.315 1.00 0.00 N ATOM 2180 CA PRO A 136 13.114 -10.740 4.613 1.00 0.00 C ATOM 2181 C PRO A 136 12.543 -9.328 4.501 1.00 0.00 C ATOM 2182 O PRO A 136 12.066 -8.765 5.486 1.00 0.00 O ATOM 2183 CB PRO A 136 14.422 -10.726 5.402 1.00 0.00 C ATOM 2184 CG PRO A 136 15.484 -10.593 4.366 1.00 0.00 C ATOM 2185 CD PRO A 136 14.979 -11.328 3.155 1.00 0.00 C ATOM 0 HA PRO A 136 12.320 -11.325 5.078 1.00 0.00 H new ATOM 0 HB2 PRO A 136 14.450 -9.896 6.108 1.00 0.00 H new ATOM 0 HB3 PRO A 136 14.545 -11.641 5.981 1.00 0.00 H new ATOM 0 HG2 PRO A 136 15.674 -9.545 4.135 1.00 0.00 H new ATOM 0 HG3 PRO A 136 16.425 -11.018 4.716 1.00 0.00 H new ATOM 0 HD2 PRO A 136 15.292 -10.842 2.231 1.00 0.00 H new ATOM 0 HD3 PRO A 136 15.356 -12.350 3.121 1.00 0.00 H new ATOM 2193 N VAL A 137 12.597 -8.757 3.300 1.00 0.00 N ATOM 2194 CA VAL A 137 12.084 -7.410 3.074 1.00 0.00 C ATOM 2195 C VAL A 137 10.850 -7.431 2.178 1.00 0.00 C ATOM 2196 O VAL A 137 10.660 -8.355 1.388 1.00 0.00 O ATOM 2197 CB VAL A 137 13.153 -6.503 2.432 1.00 0.00 C ATOM 2198 CG1 VAL A 137 14.239 -6.161 3.440 1.00 0.00 C ATOM 2199 CG2 VAL A 137 13.747 -7.169 1.201 1.00 0.00 C ATOM 0 H VAL A 137 12.989 -9.205 2.472 1.00 0.00 H new ATOM 0 HA VAL A 137 11.813 -7.009 4.051 1.00 0.00 H new ATOM 0 HB VAL A 137 12.676 -5.574 2.119 1.00 0.00 H new ATOM 0 HG11 VAL A 137 14.984 -5.520 2.969 1.00 0.00 H new ATOM 0 HG12 VAL A 137 13.797 -5.639 4.289 1.00 0.00 H new ATOM 0 HG13 VAL A 137 14.716 -7.078 3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 137 14.500 -6.515 0.761 1.00 0.00 H new ATOM 0 HG22 VAL A 137 14.210 -8.114 1.486 1.00 0.00 H new ATOM 0 HG23 VAL A 137 12.958 -7.356 0.472 1.00 0.00 H new ATOM 2209 N THR A 138 10.015 -6.405 2.307 1.00 0.00 N ATOM 2210 CA THR A 138 8.799 -6.304 1.509 1.00 0.00 C ATOM 2211 C THR A 138 8.720 -4.951 0.810 1.00 0.00 C ATOM 2212 O THR A 138 8.799 -3.904 1.451 1.00 0.00 O ATOM 2213 CB THR A 138 7.566 -6.509 2.391 1.00 0.00 C ATOM 2214 OG1 THR A 138 7.827 -6.094 3.721 1.00 0.00 O ATOM 2215 CG2 THR A 138 7.098 -7.947 2.442 1.00 0.00 C ATOM 0 H THR A 138 10.158 -5.632 2.957 1.00 0.00 H new ATOM 0 HA THR A 138 8.826 -7.085 0.749 1.00 0.00 H new ATOM 0 HB THR A 138 6.781 -5.905 1.935 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.643 -5.552 3.740 1.00 0.00 H new ATOM 0 HG21 THR A 138 6.221 -8.022 3.085 1.00 0.00 H new ATOM 0 HG22 THR A 138 6.841 -8.282 1.437 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.894 -8.575 2.841 1.00 0.00 H new ATOM 2223 N PHE A 139 8.564 -4.981 -0.510 1.00 0.00 N ATOM 2224 CA PHE A 139 8.476 -3.756 -1.297 1.00 0.00 C ATOM 2225 C PHE A 139 7.025 -3.311 -1.453 1.00 0.00 C ATOM 2226 O PHE A 139 6.122 -4.138 -1.586 1.00 0.00 O ATOM 2227 CB PHE A 139 9.111 -3.962 -2.674 1.00 0.00 C ATOM 2228 CG PHE A 139 10.011 -2.836 -3.096 1.00 0.00 C ATOM 2229 CD1 PHE A 139 9.504 -1.560 -3.282 1.00 0.00 C ATOM 2230 CD2 PHE A 139 11.363 -3.053 -3.305 1.00 0.00 C ATOM 2231 CE1 PHE A 139 10.331 -0.521 -3.669 1.00 0.00 C ATOM 2232 CE2 PHE A 139 12.194 -2.020 -3.692 1.00 0.00 C ATOM 2233 CZ PHE A 139 11.677 -0.752 -3.875 1.00 0.00 C ATOM 0 H PHE A 139 8.496 -5.839 -1.057 1.00 0.00 H new ATOM 0 HA PHE A 139 9.021 -2.974 -0.767 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.683 -4.890 -2.666 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.321 -4.081 -3.415 1.00 0.00 H new ATOM 0 HD1 PHE A 139 8.452 -1.375 -3.123 1.00 0.00 H new ATOM 0 HD2 PHE A 139 11.772 -4.042 -3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 139 9.925 0.470 -3.810 1.00 0.00 H new ATOM 0 HE2 PHE A 139 13.246 -2.203 -3.851 1.00 0.00 H new ATOM 0 HZ PHE A 139 12.324 0.057 -4.179 1.00 0.00 H new ATOM 2243 N GLN A 140 6.809 -1.999 -1.438 1.00 0.00 N ATOM 2244 CA GLN A 140 5.468 -1.443 -1.577 1.00 0.00 C ATOM 2245 C GLN A 140 5.467 -0.272 -2.555 1.00 0.00 C ATOM 2246 O GLN A 140 6.446 0.470 -2.652 1.00 0.00 O ATOM 2247 CB GLN A 140 4.935 -0.992 -0.215 1.00 0.00 C ATOM 2248 CG GLN A 140 3.826 -1.880 0.328 1.00 0.00 C ATOM 2249 CD GLN A 140 2.458 -1.488 -0.195 1.00 0.00 C ATOM 2250 OE1 GLN A 140 1.875 -0.495 0.239 1.00 0.00 O ATOM 2251 NE2 GLN A 140 1.937 -2.270 -1.134 1.00 0.00 N ATOM 0 H GLN A 140 7.546 -1.302 -1.331 1.00 0.00 H new ATOM 0 HA GLN A 140 4.815 -2.222 -1.971 1.00 0.00 H new ATOM 0 HB2 GLN A 140 5.758 -0.974 0.500 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.563 0.029 -0.299 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.031 -2.916 0.059 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.824 -1.828 1.417 1.00 0.00 H new ATOM 0 HE21 GLN A 140 2.455 -3.084 -1.465 1.00 0.00 H new ATOM 0 HE22 GLN A 140 1.019 -2.057 -1.524 1.00 0.00 H new ATOM 2260 N MET A 141 4.363 -0.110 -3.276 1.00 0.00 N ATOM 2261 CA MET A 141 4.236 0.972 -4.246 1.00 0.00 C ATOM 2262 C MET A 141 2.771 1.329 -4.474 1.00 0.00 C ATOM 2263 O MET A 141 1.929 0.448 -4.656 1.00 0.00 O ATOM 2264 CB MET A 141 4.891 0.578 -5.572 1.00 0.00 C ATOM 2265 CG MET A 141 6.357 0.967 -5.665 1.00 0.00 C ATOM 2266 SD MET A 141 7.108 0.473 -7.227 1.00 0.00 S ATOM 2267 CE MET A 141 8.848 0.633 -6.831 1.00 0.00 C ATOM 0 H MET A 141 3.544 -0.714 -3.207 1.00 0.00 H new ATOM 0 HA MET A 141 4.746 1.848 -3.844 1.00 0.00 H new ATOM 0 HB2 MET A 141 4.800 -0.500 -5.706 1.00 0.00 H new ATOM 0 HB3 MET A 141 4.346 1.048 -6.391 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.451 2.046 -5.547 1.00 0.00 H new ATOM 0 HG3 MET A 141 6.904 0.507 -4.842 1.00 0.00 H new ATOM 0 HE1 MET A 141 9.289 1.422 -7.440 1.00 0.00 H new ATOM 0 HE2 MET A 141 8.960 0.883 -5.776 1.00 0.00 H new ATOM 0 HE3 MET A 141 9.356 -0.309 -7.036 1.00 0.00 H new ATOM 2277 N THR A 142 2.472 2.624 -4.464 1.00 0.00 N ATOM 2278 CA THR A 142 1.109 3.096 -4.670 1.00 0.00 C ATOM 2279 C THR A 142 0.998 3.892 -5.967 1.00 0.00 C ATOM 2280 O THR A 142 1.847 4.732 -6.266 1.00 0.00 O ATOM 2281 CB THR A 142 0.663 3.960 -3.489 1.00 0.00 C ATOM 2282 OG1 THR A 142 -0.693 4.342 -3.631 1.00 0.00 O ATOM 2283 CG2 THR A 142 1.481 5.223 -3.327 1.00 0.00 C ATOM 0 H THR A 142 3.157 3.365 -4.315 1.00 0.00 H new ATOM 0 HA THR A 142 0.457 2.226 -4.742 1.00 0.00 H new ATOM 0 HB THR A 142 0.808 3.338 -2.606 1.00 0.00 H new ATOM 0 HG1 THR A 142 -1.182 3.640 -4.109 1.00 0.00 H new ATOM 0 HG21 THR A 142 1.112 5.789 -2.472 1.00 0.00 H new ATOM 0 HG22 THR A 142 2.527 4.961 -3.165 1.00 0.00 H new ATOM 0 HG23 THR A 142 1.395 5.830 -4.228 1.00 0.00 H new ATOM 2291 N TYR A 143 -0.052 3.621 -6.734 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.273 4.312 -8.000 1.00 0.00 C ATOM 2293 C TYR A 143 -1.390 5.343 -7.871 1.00 0.00 C ATOM 2294 O TYR A 143 -2.237 5.248 -6.982 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.616 3.306 -9.100 1.00 0.00 C ATOM 2296 CG TYR A 143 0.286 2.093 -9.115 1.00 0.00 C ATOM 2297 CD1 TYR A 143 -0.019 0.967 -8.361 1.00 0.00 C ATOM 2298 CD2 TYR A 143 1.444 2.074 -9.884 1.00 0.00 C ATOM 2299 CE1 TYR A 143 0.803 -0.144 -8.372 1.00 0.00 C ATOM 2300 CE2 TYR A 143 2.271 0.967 -9.899 1.00 0.00 C ATOM 2301 CZ TYR A 143 1.946 -0.139 -9.142 1.00 0.00 C ATOM 2302 OH TYR A 143 2.767 -1.243 -9.157 1.00 0.00 O ATOM 0 H TYR A 143 -0.764 2.928 -6.502 1.00 0.00 H new ATOM 0 HA TYR A 143 0.647 4.832 -8.266 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -1.648 2.979 -8.973 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -0.557 3.804 -10.068 1.00 0.00 H new ATOM 0 HD1 TYR A 143 -0.914 0.960 -7.756 1.00 0.00 H new ATOM 0 HD2 TYR A 143 1.701 2.938 -10.479 1.00 0.00 H new ATOM 0 HE1 TYR A 143 0.551 -1.012 -7.780 1.00 0.00 H new ATOM 0 HE2 TYR A 143 3.168 0.968 -10.501 1.00 0.00 H new ATOM 0 HH TYR A 143 3.529 -1.076 -9.751 1.00 0.00 H new ATOM 2312 N ILE A 144 -1.383 6.328 -8.763 1.00 0.00 N ATOM 2313 CA ILE A 144 -2.396 7.378 -8.749 1.00 0.00 C ATOM 2314 C ILE A 144 -3.470 7.118 -9.807 1.00 0.00 C ATOM 2315 O ILE A 144 -3.155 6.811 -10.957 1.00 0.00 O ATOM 2316 CB ILE A 144 -1.766 8.765 -8.995 1.00 0.00 C ATOM 2317 CG1 ILE A 144 -2.816 9.866 -8.832 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -1.134 8.829 -10.379 1.00 0.00 C ATOM 2319 CD1 ILE A 144 -2.964 10.353 -7.406 1.00 0.00 C ATOM 0 H ILE A 144 -0.688 6.421 -9.504 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.856 7.367 -7.761 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.983 8.923 -8.254 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -2.549 10.709 -9.470 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -3.779 9.494 -9.182 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -0.695 9.815 -10.533 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -0.357 8.069 -10.460 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -1.897 8.649 -11.136 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -3.725 11.133 -7.365 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -3.261 9.522 -6.767 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -2.013 10.756 -7.058 1.00 0.00 H new ATOM 2331 N PRO A 145 -4.757 7.237 -9.433 1.00 0.00 N ATOM 2332 CA PRO A 145 -5.870 7.012 -10.361 1.00 0.00 C ATOM 2333 C PRO A 145 -5.993 8.123 -11.399 1.00 0.00 C ATOM 2334 O PRO A 145 -5.962 9.306 -11.061 1.00 0.00 O ATOM 2335 CB PRO A 145 -7.096 6.997 -9.447 1.00 0.00 C ATOM 2336 CG PRO A 145 -6.704 7.828 -8.276 1.00 0.00 C ATOM 2337 CD PRO A 145 -5.230 7.599 -8.082 1.00 0.00 C ATOM 0 HA PRO A 145 -5.740 6.097 -10.938 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -7.970 7.409 -9.950 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -7.352 5.982 -9.144 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -6.915 8.882 -8.457 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -7.264 7.539 -7.387 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -4.731 8.493 -7.708 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -5.039 6.803 -7.363 1.00 0.00 H new ATOM 2345 N GLY A 146 -6.132 7.733 -12.661 1.00 0.00 N ATOM 2346 CA GLY A 146 -6.256 8.709 -13.728 1.00 0.00 C ATOM 2347 C GLY A 146 -5.603 8.246 -15.016 1.00 0.00 C ATOM 2348 O GLY A 146 -4.591 7.546 -14.989 1.00 0.00 O ATOM 0 H GLY A 146 -6.161 6.760 -12.964 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -7.311 8.910 -13.911 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -5.803 9.648 -13.412 1.00 0.00 H new ATOM 2352 N THR A 147 -6.182 8.640 -16.145 1.00 0.00 N ATOM 2353 CA THR A 147 -5.649 8.262 -17.449 1.00 0.00 C ATOM 2354 C THR A 147 -5.071 9.475 -18.173 1.00 0.00 C ATOM 2355 O THR A 147 -5.139 9.568 -19.399 1.00 0.00 O ATOM 2356 CB THR A 147 -6.743 7.618 -18.302 1.00 0.00 C ATOM 2357 OG1 THR A 147 -8.009 8.173 -17.997 1.00 0.00 O ATOM 2358 CG2 THR A 147 -6.841 6.119 -18.116 1.00 0.00 C ATOM 0 H THR A 147 -7.020 9.221 -16.184 1.00 0.00 H new ATOM 0 HA THR A 147 -4.848 7.540 -17.291 1.00 0.00 H new ATOM 0 HB THR A 147 -6.462 7.822 -19.335 1.00 0.00 H new ATOM 0 HG1 THR A 147 -8.695 7.749 -18.554 1.00 0.00 H new ATOM 0 HG21 THR A 147 -7.636 5.725 -18.749 1.00 0.00 H new ATOM 0 HG22 THR A 147 -5.894 5.655 -18.392 1.00 0.00 H new ATOM 0 HG23 THR A 147 -7.064 5.896 -17.073 1.00 0.00 H new ATOM 2366 N TYR A 148 -4.503 10.400 -17.408 1.00 0.00 N ATOM 2367 CA TYR A 148 -3.913 11.607 -17.976 1.00 0.00 C ATOM 2368 C TYR A 148 -2.782 11.256 -18.937 1.00 0.00 C ATOM 2369 O TYR A 148 -2.319 10.116 -18.978 1.00 0.00 O ATOM 2370 CB TYR A 148 -3.390 12.517 -16.864 1.00 0.00 C ATOM 2371 CG TYR A 148 -3.417 13.986 -17.221 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -4.621 14.661 -17.375 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -2.237 14.698 -17.404 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -4.649 16.004 -17.703 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -2.257 16.040 -17.731 1.00 0.00 C ATOM 2376 CZ TYR A 148 -3.465 16.689 -17.878 1.00 0.00 C ATOM 2377 OH TYR A 148 -3.489 18.025 -18.203 1.00 0.00 O ATOM 0 H TYR A 148 -4.438 10.337 -16.392 1.00 0.00 H new ATOM 0 HA TYR A 148 -4.688 12.135 -18.531 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -3.987 12.359 -15.966 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -2.367 12.229 -16.622 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -5.550 14.128 -17.236 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -1.289 14.194 -17.289 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -5.594 16.514 -17.822 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -1.331 16.578 -17.871 1.00 0.00 H new ATOM 0 HH TYR A 148 -2.571 18.357 -18.289 1.00 0.00 H new ATOM 2387 N ASN A 149 -2.340 12.244 -19.709 1.00 0.00 N ATOM 2388 CA ASN A 149 -1.263 12.039 -20.669 1.00 0.00 C ATOM 2389 C ASN A 149 0.057 12.582 -20.131 1.00 0.00 C ATOM 2390 O ASN A 149 0.186 13.776 -19.863 1.00 0.00 O ATOM 2391 CB ASN A 149 -1.601 12.716 -21.999 1.00 0.00 C ATOM 2392 CG ASN A 149 -1.774 14.216 -21.857 1.00 0.00 C ATOM 2393 OD1 ASN A 149 -0.854 14.987 -22.126 1.00 0.00 O ATOM 2394 ND2 ASN A 149 -2.960 14.637 -21.430 1.00 0.00 N ATOM 0 H ASN A 149 -2.711 13.194 -19.688 1.00 0.00 H new ATOM 0 HA ASN A 149 -1.155 10.967 -20.832 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -0.809 12.511 -22.719 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -2.517 12.284 -22.401 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -3.135 15.635 -21.314 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -3.695 13.962 -21.218 1.00 0.00 H new ATOM 2401 N ASN A 150 1.036 11.695 -19.974 1.00 0.00 N ATOM 2402 CA ASN A 150 2.346 12.085 -19.468 1.00 0.00 C ATOM 2403 C ASN A 150 2.233 12.680 -18.068 1.00 0.00 C ATOM 2404 O ASN A 150 1.134 12.949 -17.583 1.00 0.00 O ATOM 2405 CB ASN A 150 3.003 13.093 -20.415 1.00 0.00 C ATOM 2406 CG ASN A 150 4.422 12.703 -20.779 1.00 0.00 C ATOM 2407 OD1 ASN A 150 4.650 11.975 -21.745 1.00 0.00 O ATOM 2408 ND2 ASN A 150 5.387 13.188 -20.005 1.00 0.00 N ATOM 0 H ASN A 150 0.946 10.702 -20.190 1.00 0.00 H new ATOM 0 HA ASN A 150 2.968 11.192 -19.413 1.00 0.00 H new ATOM 0 HB2 ASN A 150 2.407 13.175 -21.324 1.00 0.00 H new ATOM 0 HB3 ASN A 150 3.008 14.077 -19.947 1.00 0.00 H new ATOM 0 HD21 ASN A 150 6.362 12.960 -20.202 1.00 0.00 H new ATOM 0 HD22 ASN A 150 5.153 13.788 -19.214 1.00 0.00 H new ATOM 2415 N GLY A 151 3.377 12.883 -17.422 1.00 0.00 N ATOM 2416 CA GLY A 151 3.384 13.445 -16.084 1.00 0.00 C ATOM 2417 C GLY A 151 3.019 12.423 -15.024 1.00 0.00 C ATOM 2418 O GLY A 151 2.478 12.774 -13.976 1.00 0.00 O ATOM 0 H GLY A 151 4.299 12.668 -17.801 1.00 0.00 H new ATOM 0 HA2 GLY A 151 4.373 13.850 -15.869 1.00 0.00 H new ATOM 0 HA3 GLY A 151 2.682 14.277 -16.039 1.00 0.00 H new ATOM 2422 N ASN A 152 3.316 11.157 -15.298 1.00 0.00 N ATOM 2423 CA ASN A 152 3.016 10.081 -14.361 1.00 0.00 C ATOM 2424 C ASN A 152 4.084 9.991 -13.276 1.00 0.00 C ATOM 2425 O ASN A 152 5.250 10.314 -13.510 1.00 0.00 O ATOM 2426 CB ASN A 152 2.908 8.747 -15.099 1.00 0.00 C ATOM 2427 CG ASN A 152 4.130 8.458 -15.951 1.00 0.00 C ATOM 2428 OD1 ASN A 152 5.159 8.006 -15.449 1.00 0.00 O ATOM 2429 ND2 ASN A 152 4.021 8.719 -17.249 1.00 0.00 N ATOM 0 H ASN A 152 3.764 10.851 -16.162 1.00 0.00 H new ATOM 0 HA ASN A 152 2.060 10.303 -13.887 1.00 0.00 H new ATOM 0 HB2 ASN A 152 2.775 7.944 -14.375 1.00 0.00 H new ATOM 0 HB3 ASN A 152 2.021 8.756 -15.732 1.00 0.00 H new ATOM 0 HD21 ASN A 152 4.810 8.545 -17.872 1.00 0.00 H new ATOM 0 HD22 ASN A 152 3.149 9.093 -17.622 1.00 0.00 H new ATOM 2436 N VAL A 153 3.680 9.550 -12.089 1.00 0.00 N ATOM 2437 CA VAL A 153 4.603 9.416 -10.969 1.00 0.00 C ATOM 2438 C VAL A 153 4.137 8.332 -10.002 1.00 0.00 C ATOM 2439 O VAL A 153 2.984 8.323 -9.572 1.00 0.00 O ATOM 2440 CB VAL A 153 4.755 10.747 -10.205 1.00 0.00 C ATOM 2441 CG1 VAL A 153 3.422 11.186 -9.619 1.00 0.00 C ATOM 2442 CG2 VAL A 153 5.810 10.623 -9.116 1.00 0.00 C ATOM 0 H VAL A 153 2.719 9.279 -11.878 1.00 0.00 H new ATOM 0 HA VAL A 153 5.571 9.135 -11.385 1.00 0.00 H new ATOM 0 HB VAL A 153 5.083 11.511 -10.910 1.00 0.00 H new ATOM 0 HG11 VAL A 153 3.552 12.127 -9.084 1.00 0.00 H new ATOM 0 HG12 VAL A 153 2.698 11.322 -10.423 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.059 10.424 -8.929 1.00 0.00 H new ATOM 0 HG21 VAL A 153 5.902 11.573 -8.589 1.00 0.00 H new ATOM 0 HG22 VAL A 153 5.517 9.844 -8.412 1.00 0.00 H new ATOM 0 HG23 VAL A 153 6.768 10.363 -9.566 1.00 0.00 H new ATOM 2452 N TYR A 154 5.043 7.420 -9.663 1.00 0.00 N ATOM 2453 CA TYR A 154 4.726 6.331 -8.745 1.00 0.00 C ATOM 2454 C TYR A 154 5.477 6.493 -7.427 1.00 0.00 C ATOM 2455 O TYR A 154 6.655 6.848 -7.414 1.00 0.00 O ATOM 2456 CB TYR A 154 5.071 4.985 -9.381 1.00 0.00 C ATOM 2457 CG TYR A 154 4.457 4.785 -10.749 1.00 0.00 C ATOM 2458 CD1 TYR A 154 3.093 4.958 -10.951 1.00 0.00 C ATOM 2459 CD2 TYR A 154 5.241 4.425 -11.838 1.00 0.00 C ATOM 2460 CE1 TYR A 154 2.529 4.777 -12.200 1.00 0.00 C ATOM 2461 CE2 TYR A 154 4.684 4.242 -13.089 1.00 0.00 C ATOM 2462 CZ TYR A 154 3.328 4.419 -13.264 1.00 0.00 C ATOM 2463 OH TYR A 154 2.768 4.238 -14.509 1.00 0.00 O ATOM 0 H TYR A 154 6.002 7.413 -10.010 1.00 0.00 H new ATOM 0 HA TYR A 154 3.656 6.363 -8.538 1.00 0.00 H new ATOM 0 HB2 TYR A 154 6.155 4.898 -9.462 1.00 0.00 H new ATOM 0 HB3 TYR A 154 4.736 4.185 -8.721 1.00 0.00 H new ATOM 0 HD1 TYR A 154 2.464 5.238 -10.119 1.00 0.00 H new ATOM 0 HD2 TYR A 154 6.304 4.286 -11.704 1.00 0.00 H new ATOM 0 HE1 TYR A 154 1.467 4.916 -12.341 1.00 0.00 H new ATOM 0 HE2 TYR A 154 5.307 3.962 -13.925 1.00 0.00 H new ATOM 0 HH TYR A 154 3.467 3.989 -15.149 1.00 0.00 H new ATOM 2473 N PHE A 155 4.787 6.230 -6.323 1.00 0.00 N ATOM 2474 CA PHE A 155 5.389 6.346 -5.000 1.00 0.00 C ATOM 2475 C PHE A 155 5.713 4.970 -4.428 1.00 0.00 C ATOM 2476 O PHE A 155 4.889 4.056 -4.475 1.00 0.00 O ATOM 2477 CB PHE A 155 4.449 7.096 -4.054 1.00 0.00 C ATOM 2478 CG PHE A 155 5.080 7.450 -2.738 1.00 0.00 C ATOM 2479 CD1 PHE A 155 5.929 8.541 -2.634 1.00 0.00 C ATOM 2480 CD2 PHE A 155 4.824 6.693 -1.606 1.00 0.00 C ATOM 2481 CE1 PHE A 155 6.511 8.870 -1.424 1.00 0.00 C ATOM 2482 CE2 PHE A 155 5.403 7.018 -0.393 1.00 0.00 C ATOM 2483 CZ PHE A 155 6.248 8.107 -0.303 1.00 0.00 C ATOM 0 H PHE A 155 3.811 5.935 -6.318 1.00 0.00 H new ATOM 0 HA PHE A 155 6.318 6.907 -5.098 1.00 0.00 H new ATOM 0 HB2 PHE A 155 4.108 8.009 -4.542 1.00 0.00 H new ATOM 0 HB3 PHE A 155 3.566 6.484 -3.871 1.00 0.00 H new ATOM 0 HD1 PHE A 155 6.138 9.140 -3.508 1.00 0.00 H new ATOM 0 HD2 PHE A 155 4.165 5.840 -1.672 1.00 0.00 H new ATOM 0 HE1 PHE A 155 7.170 9.723 -1.355 1.00 0.00 H new ATOM 0 HE2 PHE A 155 5.195 6.421 0.483 1.00 0.00 H new ATOM 0 HZ PHE A 155 6.703 8.362 0.643 1.00 0.00 H new ATOM 2493 N ALA A 156 6.919 4.830 -3.886 1.00 0.00 N ATOM 2494 CA ALA A 156 7.353 3.566 -3.305 1.00 0.00 C ATOM 2495 C ALA A 156 7.450 3.666 -1.786 1.00 0.00 C ATOM 2496 O ALA A 156 7.395 4.759 -1.221 1.00 0.00 O ATOM 2497 CB ALA A 156 8.690 3.145 -3.895 1.00 0.00 C ATOM 0 H ALA A 156 7.612 5.577 -3.837 1.00 0.00 H new ATOM 0 HA ALA A 156 6.608 2.808 -3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.002 2.199 -3.452 1.00 0.00 H new ATOM 0 HB2 ALA A 156 8.590 3.025 -4.974 1.00 0.00 H new ATOM 0 HB3 ALA A 156 9.438 3.909 -3.683 1.00 0.00 H new ATOM 2503 N TRP A 157 7.595 2.519 -1.130 1.00 0.00 N ATOM 2504 CA TRP A 157 7.699 2.477 0.324 1.00 0.00 C ATOM 2505 C TRP A 157 8.313 1.160 0.787 1.00 0.00 C ATOM 2506 O TRP A 157 8.349 0.183 0.039 1.00 0.00 O ATOM 2507 CB TRP A 157 6.319 2.668 0.959 1.00 0.00 C ATOM 2508 CG TRP A 157 6.274 3.779 1.962 1.00 0.00 C ATOM 2509 CD1 TRP A 157 7.320 4.270 2.690 1.00 0.00 C ATOM 2510 CD2 TRP A 157 5.123 4.538 2.351 1.00 0.00 C ATOM 2511 NE1 TRP A 157 6.890 5.288 3.506 1.00 0.00 N ATOM 2512 CE2 TRP A 157 5.545 5.472 3.316 1.00 0.00 C ATOM 2513 CE3 TRP A 157 3.777 4.518 1.975 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 4.668 6.376 3.910 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 2.908 5.417 2.565 1.00 0.00 C ATOM 2516 CH2 TRP A 157 3.357 6.335 3.524 1.00 0.00 C ATOM 0 H TRP A 157 7.643 1.606 -1.583 1.00 0.00 H new ATOM 0 HA TRP A 157 8.352 3.290 0.643 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.590 2.868 0.173 1.00 0.00 H new ATOM 0 HB3 TRP A 157 6.018 1.739 1.443 1.00 0.00 H new ATOM 0 HD1 TRP A 157 8.337 3.910 2.633 1.00 0.00 H new ATOM 0 HE1 TRP A 157 7.476 5.820 4.149 1.00 0.00 H new ATOM 0 HE3 TRP A 157 3.422 3.813 1.237 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 5.011 7.084 4.649 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 1.866 5.412 2.282 1.00 0.00 H new ATOM 0 HH2 TRP A 157 2.653 7.024 3.967 1.00 0.00 H new ATOM 2527 N MET A 158 8.792 1.139 2.026 1.00 0.00 N ATOM 2528 CA MET A 158 9.404 -0.059 2.590 1.00 0.00 C ATOM 2529 C MET A 158 8.522 -0.658 3.680 1.00 0.00 C ATOM 2530 O MET A 158 7.954 0.064 4.499 1.00 0.00 O ATOM 2531 CB MET A 158 10.786 0.268 3.157 1.00 0.00 C ATOM 2532 CG MET A 158 11.916 0.070 2.159 1.00 0.00 C ATOM 2533 SD MET A 158 12.345 -1.666 1.931 1.00 0.00 S ATOM 2534 CE MET A 158 14.133 -1.567 1.865 1.00 0.00 C ATOM 0 H MET A 158 8.768 1.938 2.659 1.00 0.00 H new ATOM 0 HA MET A 158 9.512 -0.793 1.791 1.00 0.00 H new ATOM 0 HB2 MET A 158 10.793 1.302 3.501 1.00 0.00 H new ATOM 0 HB3 MET A 158 10.969 -0.359 4.030 1.00 0.00 H new ATOM 0 HG2 MET A 158 11.627 0.498 1.199 1.00 0.00 H new ATOM 0 HG3 MET A 158 12.796 0.616 2.499 1.00 0.00 H new ATOM 0 HE1 MET A 158 14.548 -2.565 1.727 1.00 0.00 H new ATOM 0 HE2 MET A 158 14.432 -0.931 1.032 1.00 0.00 H new ATOM 0 HE3 MET A 158 14.509 -1.144 2.797 1.00 0.00 H new ATOM 2544 N ARG A 159 8.412 -1.983 3.683 1.00 0.00 N ATOM 2545 CA ARG A 159 7.600 -2.680 4.673 1.00 0.00 C ATOM 2546 C ARG A 159 8.392 -3.804 5.333 1.00 0.00 C ATOM 2547 O ARG A 159 9.309 -4.365 4.734 1.00 0.00 O ATOM 2548 CB ARG A 159 6.336 -3.245 4.020 1.00 0.00 C ATOM 2549 CG ARG A 159 5.118 -3.220 4.930 1.00 0.00 C ATOM 2550 CD ARG A 159 3.968 -4.021 4.341 1.00 0.00 C ATOM 2551 NE ARG A 159 4.174 -5.461 4.484 1.00 0.00 N ATOM 2552 CZ ARG A 159 3.222 -6.369 4.284 1.00 0.00 C ATOM 2553 NH1 ARG A 159 1.999 -5.993 3.933 1.00 0.00 N ATOM 2554 NH2 ARG A 159 3.494 -7.658 4.435 1.00 0.00 N ATOM 0 H ARG A 159 8.875 -2.595 3.011 1.00 0.00 H new ATOM 0 HA ARG A 159 7.314 -1.962 5.442 1.00 0.00 H new ATOM 0 HB2 ARG A 159 6.117 -2.674 3.118 1.00 0.00 H new ATOM 0 HB3 ARG A 159 6.526 -4.272 3.709 1.00 0.00 H new ATOM 0 HG2 ARG A 159 5.383 -3.626 5.906 1.00 0.00 H new ATOM 0 HG3 ARG A 159 4.802 -2.189 5.088 1.00 0.00 H new ATOM 0 HD2 ARG A 159 3.038 -3.737 4.834 1.00 0.00 H new ATOM 0 HD3 ARG A 159 3.857 -3.774 3.285 1.00 0.00 H new ATOM 0 HE ARG A 159 5.102 -5.789 4.753 1.00 0.00 H new ATOM 0 HH11 ARG A 159 1.784 -5.003 3.815 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.274 -6.694 3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 159 4.433 -7.953 4.704 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.765 -8.354 4.282 1.00 0.00 H new ATOM 2568 N PHE A 160 8.030 -4.127 6.571 1.00 0.00 N ATOM 2569 CA PHE A 160 8.707 -5.184 7.312 1.00 0.00 C ATOM 2570 C PHE A 160 7.698 -6.099 7.999 1.00 0.00 C ATOM 2571 O PHE A 160 6.674 -5.641 8.505 1.00 0.00 O ATOM 2572 CB PHE A 160 9.657 -4.581 8.349 1.00 0.00 C ATOM 2573 CG PHE A 160 10.954 -5.326 8.482 1.00 0.00 C ATOM 2574 CD1 PHE A 160 11.910 -5.260 7.481 1.00 0.00 C ATOM 2575 CD2 PHE A 160 11.217 -6.093 9.606 1.00 0.00 C ATOM 2576 CE1 PHE A 160 13.105 -5.945 7.599 1.00 0.00 C ATOM 2577 CE2 PHE A 160 12.410 -6.779 9.730 1.00 0.00 C ATOM 2578 CZ PHE A 160 13.355 -6.705 8.725 1.00 0.00 C ATOM 0 H PHE A 160 7.273 -3.672 7.081 1.00 0.00 H new ATOM 0 HA PHE A 160 9.284 -5.778 6.604 1.00 0.00 H new ATOM 0 HB2 PHE A 160 9.868 -3.547 8.078 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.158 -4.561 9.318 1.00 0.00 H new ATOM 0 HD1 PHE A 160 11.719 -4.667 6.599 1.00 0.00 H new ATOM 0 HD2 PHE A 160 10.481 -6.155 10.394 1.00 0.00 H new ATOM 0 HE1 PHE A 160 13.842 -5.886 6.812 1.00 0.00 H new ATOM 0 HE2 PHE A 160 12.603 -7.372 10.611 1.00 0.00 H new ATOM 0 HZ PHE A 160 14.288 -7.241 8.820 1.00 0.00 H new ATOM 2588 N GLN A 161 7.995 -7.395 8.013 1.00 0.00 N ATOM 2589 CA GLN A 161 7.113 -8.373 8.638 1.00 0.00 C ATOM 2590 C GLN A 161 7.564 -8.683 10.062 1.00 0.00 C ATOM 2591 O GLN A 161 8.669 -9.180 10.279 1.00 0.00 O ATOM 2592 CB GLN A 161 7.077 -9.660 7.811 1.00 0.00 C ATOM 2593 CG GLN A 161 5.986 -9.673 6.752 1.00 0.00 C ATOM 2594 CD GLN A 161 5.171 -10.951 6.769 1.00 0.00 C ATOM 2595 OE1 GLN A 161 5.352 -11.828 5.924 1.00 0.00 O ATOM 2596 NE2 GLN A 161 4.265 -11.062 7.734 1.00 0.00 N ATOM 0 H GLN A 161 8.839 -7.791 7.599 1.00 0.00 H new ATOM 0 HA GLN A 161 6.111 -7.946 8.679 1.00 0.00 H new ATOM 0 HB2 GLN A 161 8.044 -9.798 7.326 1.00 0.00 H new ATOM 0 HB3 GLN A 161 6.932 -10.508 8.480 1.00 0.00 H new ATOM 0 HG2 GLN A 161 5.323 -8.822 6.908 1.00 0.00 H new ATOM 0 HG3 GLN A 161 6.438 -9.548 5.768 1.00 0.00 H new ATOM 0 HE21 GLN A 161 4.149 -10.310 8.413 1.00 0.00 H new ATOM 0 HE22 GLN A 161 3.685 -11.899 7.796 1.00 0.00 H new ATOM 2605 N PHE A 162 6.701 -8.385 11.028 1.00 0.00 N ATOM 2606 CA PHE A 162 7.009 -8.633 12.431 1.00 0.00 C ATOM 2607 C PHE A 162 6.245 -9.846 12.950 1.00 0.00 C ATOM 2608 O PHE A 162 5.018 -9.905 12.859 1.00 0.00 O ATOM 2609 CB PHE A 162 6.671 -7.401 13.275 1.00 0.00 C ATOM 2610 CG PHE A 162 7.858 -6.528 13.566 1.00 0.00 C ATOM 2611 CD1 PHE A 162 8.562 -5.927 12.534 1.00 0.00 C ATOM 2612 CD2 PHE A 162 8.270 -6.309 14.869 1.00 0.00 C ATOM 2613 CE1 PHE A 162 9.655 -5.122 12.799 1.00 0.00 C ATOM 2614 CE2 PHE A 162 9.363 -5.507 15.141 1.00 0.00 C ATOM 2615 CZ PHE A 162 10.055 -4.913 14.104 1.00 0.00 C ATOM 0 H PHE A 162 5.783 -7.971 10.864 1.00 0.00 H new ATOM 0 HA PHE A 162 8.076 -8.838 12.512 1.00 0.00 H new ATOM 0 HB2 PHE A 162 5.915 -6.811 12.756 1.00 0.00 H new ATOM 0 HB3 PHE A 162 6.230 -7.726 14.217 1.00 0.00 H new ATOM 0 HD1 PHE A 162 8.254 -6.089 11.512 1.00 0.00 H new ATOM 0 HD2 PHE A 162 7.731 -6.770 15.683 1.00 0.00 H new ATOM 0 HE1 PHE A 162 10.195 -4.658 11.987 1.00 0.00 H new ATOM 0 HE2 PHE A 162 9.675 -5.345 16.162 1.00 0.00 H new ATOM 0 HZ PHE A 162 10.909 -4.285 14.314 1.00 0.00 H new ATOM 2625 N LEU A 163 6.978 -10.813 13.495 1.00 0.00 N ATOM 2626 CA LEU A 163 6.369 -12.025 14.029 1.00 0.00 C ATOM 2627 C LEU A 163 6.612 -12.140 15.530 1.00 0.00 C ATOM 2628 O LEU A 163 7.673 -11.762 16.028 1.00 0.00 O ATOM 2629 CB LEU A 163 6.925 -13.257 13.310 1.00 0.00 C ATOM 2630 CG LEU A 163 5.876 -14.282 12.877 1.00 0.00 C ATOM 2631 CD1 LEU A 163 5.054 -14.743 14.070 1.00 0.00 C ATOM 2632 CD2 LEU A 163 4.975 -13.697 11.800 1.00 0.00 C ATOM 0 H LEU A 163 7.994 -10.780 13.578 1.00 0.00 H new ATOM 0 HA LEU A 163 5.294 -11.969 13.859 1.00 0.00 H new ATOM 0 HB2 LEU A 163 7.474 -12.927 12.428 1.00 0.00 H new ATOM 0 HB3 LEU A 163 7.642 -13.749 13.967 1.00 0.00 H new ATOM 0 HG LEU A 163 6.391 -15.148 12.462 1.00 0.00 H new ATOM 0 HD11 LEU A 163 4.313 -15.472 13.742 1.00 0.00 H new ATOM 0 HD12 LEU A 163 5.711 -15.201 14.809 1.00 0.00 H new ATOM 0 HD13 LEU A 163 4.548 -13.887 14.516 1.00 0.00 H new ATOM 0 HD21 LEU A 163 4.234 -14.439 11.503 1.00 0.00 H new ATOM 0 HD22 LEU A 163 4.468 -12.814 12.190 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.576 -13.418 10.935 1.00 0.00 H new