USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.608 (180deg=0.215) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 151:sc= -0.519 (180deg=-1.93!) USER MOD Single : A 13 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.013) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.0371 X(o=-0.037,f=-0.041) USER MOD Single : B 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 111 MET CE :methyl 148:sc= -0.535 (180deg=-1.93!) USER MOD Single : B 113 ASN : amide:sc= -0.265 X(o=-0.26,f=-0.0034) USER MOD Single : B 114 THR OG1 : rot 180:sc= 0 USER MOD Single : B 115 SER OG : rot 180:sc= 0 USER MOD Single : B 128 HIS : no HD1:sc= -0.845 K(o=-0.84,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.711 2.495 -2.996 1.00 0.00 N ATOM 2 CA MET A 1 2.517 3.485 -3.701 1.00 0.00 C ATOM 3 C MET A 1 3.990 3.088 -3.700 1.00 0.00 C ATOM 4 O MET A 1 4.872 3.941 -3.795 1.00 0.00 O ATOM 5 CB MET A 1 2.348 4.863 -3.057 1.00 0.00 C ATOM 6 CG MET A 1 1.132 5.624 -3.561 1.00 0.00 C ATOM 7 SD MET A 1 -0.418 4.953 -2.930 1.00 0.00 S ATOM 8 CE MET A 1 -0.684 6.000 -1.502 1.00 0.00 C ATOM 0 H1 MET A 1 0.793 2.912 -2.742 1.00 0.00 H new ATOM 0 H2 MET A 1 1.558 1.670 -3.611 1.00 0.00 H new ATOM 0 H3 MET A 1 2.206 2.196 -2.132 1.00 0.00 H new ATOM 0 HA MET A 1 2.172 3.529 -4.734 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.269 4.743 -1.977 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.242 5.456 -3.247 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.216 6.671 -3.268 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.118 5.598 -4.651 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.608 5.708 -1.004 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.151 5.891 -0.810 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.757 7.040 -1.822 1.00 0.00 H new ATOM 18 N ASP A 2 4.247 1.789 -3.591 1.00 0.00 N ATOM 19 CA ASP A 2 5.613 1.279 -3.579 1.00 0.00 C ATOM 20 C ASP A 2 5.658 -0.166 -4.064 1.00 0.00 C ATOM 21 O ASP A 2 5.081 -1.059 -3.443 1.00 0.00 O ATOM 22 CB ASP A 2 6.203 1.376 -2.171 1.00 0.00 C ATOM 23 CG ASP A 2 6.377 2.810 -1.713 1.00 0.00 C ATOM 24 OD1 ASP A 2 7.331 3.470 -2.176 1.00 0.00 O ATOM 25 OD2 ASP A 2 5.558 3.274 -0.893 1.00 0.00 O ATOM 0 H ASP A 2 3.528 1.070 -3.510 1.00 0.00 H new ATOM 0 HA ASP A 2 6.209 1.889 -4.258 1.00 0.00 H new ATOM 0 HB2 ASP A 2 5.553 0.851 -1.471 1.00 0.00 H new ATOM 0 HB3 ASP A 2 7.169 0.871 -2.150 1.00 0.00 H new ATOM 30 N SER A 3 6.346 -0.390 -5.180 1.00 0.00 N ATOM 31 CA SER A 3 6.462 -1.726 -5.752 1.00 0.00 C ATOM 32 C SER A 3 7.874 -2.273 -5.572 1.00 0.00 C ATOM 33 O SER A 3 8.412 -2.938 -6.457 1.00 0.00 O ATOM 34 CB SER A 3 6.098 -1.701 -7.237 1.00 0.00 C ATOM 35 OG SER A 3 4.695 -1.615 -7.417 1.00 0.00 O ATOM 0 H SER A 3 6.831 0.337 -5.706 1.00 0.00 H new ATOM 0 HA SER A 3 5.768 -2.381 -5.226 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.582 -0.852 -7.719 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.476 -2.601 -7.722 1.00 0.00 H new ATOM 0 HG SER A 3 4.488 -1.599 -8.375 1.00 0.00 H new ATOM 41 N ALA A 4 8.470 -1.988 -4.418 1.00 0.00 N ATOM 42 CA ALA A 4 9.819 -2.453 -4.120 1.00 0.00 C ATOM 43 C ALA A 4 9.845 -3.963 -3.907 1.00 0.00 C ATOM 44 O ALA A 4 10.521 -4.703 -4.621 1.00 0.00 O ATOM 45 CB ALA A 4 10.365 -1.735 -2.894 1.00 0.00 C ATOM 0 H ALA A 4 8.040 -1.438 -3.675 1.00 0.00 H new ATOM 0 HA ALA A 4 10.454 -2.223 -4.976 1.00 0.00 H new ATOM 0 HB1 ALA A 4 11.373 -2.092 -2.682 1.00 0.00 H new ATOM 0 HB2 ALA A 4 10.392 -0.662 -3.083 1.00 0.00 H new ATOM 0 HB3 ALA A 4 9.722 -1.937 -2.038 1.00 0.00 H new ATOM 51 N PRO A 5 9.093 -4.432 -2.900 1.00 0.00 N ATOM 52 CA PRO A 5 9.014 -5.858 -2.570 1.00 0.00 C ATOM 53 C PRO A 5 8.266 -6.658 -3.631 1.00 0.00 C ATOM 54 O PRO A 5 8.501 -7.855 -3.800 1.00 0.00 O ATOM 55 CB PRO A 5 8.243 -5.873 -1.247 1.00 0.00 C ATOM 56 CG PRO A 5 7.436 -4.620 -1.264 1.00 0.00 C ATOM 57 CD PRO A 5 8.262 -3.607 -2.007 1.00 0.00 C ATOM 0 HA PRO A 5 10.000 -6.318 -2.510 1.00 0.00 H new ATOM 0 HB2 PRO A 5 7.605 -6.754 -1.171 1.00 0.00 H new ATOM 0 HB3 PRO A 5 8.921 -5.896 -0.394 1.00 0.00 H new ATOM 0 HG2 PRO A 5 6.477 -4.780 -1.757 1.00 0.00 H new ATOM 0 HG3 PRO A 5 7.220 -4.281 -0.251 1.00 0.00 H new ATOM 0 HD2 PRO A 5 7.637 -2.913 -2.568 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.872 -3.010 -1.329 1.00 0.00 H new ATOM 65 N PHE A 6 7.367 -5.990 -4.345 1.00 0.00 N ATOM 66 CA PHE A 6 6.585 -6.639 -5.390 1.00 0.00 C ATOM 67 C PHE A 6 7.428 -6.862 -6.642 1.00 0.00 C ATOM 68 O PHE A 6 7.256 -7.853 -7.351 1.00 0.00 O ATOM 69 CB PHE A 6 5.354 -5.797 -5.734 1.00 0.00 C ATOM 70 CG PHE A 6 4.187 -6.041 -4.821 1.00 0.00 C ATOM 71 CD1 PHE A 6 3.494 -7.240 -4.866 1.00 0.00 C ATOM 72 CD2 PHE A 6 3.782 -5.071 -3.918 1.00 0.00 C ATOM 73 CE1 PHE A 6 2.419 -7.467 -4.027 1.00 0.00 C ATOM 74 CE2 PHE A 6 2.708 -5.292 -3.076 1.00 0.00 C ATOM 75 CZ PHE A 6 2.026 -6.492 -3.131 1.00 0.00 C ATOM 0 H PHE A 6 7.162 -4.999 -4.219 1.00 0.00 H new ATOM 0 HA PHE A 6 6.260 -7.609 -5.015 1.00 0.00 H new ATOM 0 HB2 PHE A 6 5.623 -4.741 -5.693 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.053 -6.010 -6.760 1.00 0.00 H new ATOM 0 HD1 PHE A 6 3.797 -8.006 -5.564 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.312 -4.131 -3.871 1.00 0.00 H new ATOM 0 HE1 PHE A 6 1.887 -8.406 -4.072 1.00 0.00 H new ATOM 0 HE2 PHE A 6 2.403 -4.528 -2.377 1.00 0.00 H new ATOM 0 HZ PHE A 6 1.187 -6.668 -2.474 1.00 0.00 H new ATOM 85 N GLU A 7 8.341 -5.932 -6.907 1.00 0.00 N ATOM 86 CA GLU A 7 9.210 -6.026 -8.073 1.00 0.00 C ATOM 87 C GLU A 7 10.022 -7.318 -8.044 1.00 0.00 C ATOM 88 O GLU A 7 10.300 -7.914 -9.086 1.00 0.00 O ATOM 89 CB GLU A 7 10.151 -4.821 -8.134 1.00 0.00 C ATOM 90 CG GLU A 7 9.840 -3.863 -9.272 1.00 0.00 C ATOM 91 CD GLU A 7 10.471 -2.498 -9.075 1.00 0.00 C ATOM 92 OE1 GLU A 7 10.248 -1.891 -8.006 1.00 0.00 O ATOM 93 OE2 GLU A 7 11.186 -2.037 -9.988 1.00 0.00 O ATOM 0 H GLU A 7 8.497 -5.106 -6.330 1.00 0.00 H new ATOM 0 HA GLU A 7 8.581 -6.032 -8.963 1.00 0.00 H new ATOM 0 HB2 GLU A 7 10.096 -4.280 -7.189 1.00 0.00 H new ATOM 0 HB3 GLU A 7 11.176 -5.176 -8.239 1.00 0.00 H new ATOM 0 HG2 GLU A 7 10.195 -4.291 -10.210 1.00 0.00 H new ATOM 0 HG3 GLU A 7 8.760 -3.750 -9.362 1.00 0.00 H new ATOM 100 N LEU A 8 10.401 -7.744 -6.844 1.00 0.00 N ATOM 101 CA LEU A 8 11.182 -8.965 -6.678 1.00 0.00 C ATOM 102 C LEU A 8 10.531 -10.133 -7.412 1.00 0.00 C ATOM 103 O LEU A 8 11.216 -10.973 -7.995 1.00 0.00 O ATOM 104 CB LEU A 8 11.331 -9.300 -5.193 1.00 0.00 C ATOM 105 CG LEU A 8 12.750 -9.609 -4.713 1.00 0.00 C ATOM 106 CD1 LEU A 8 13.683 -8.450 -5.027 1.00 0.00 C ATOM 107 CD2 LEU A 8 12.754 -9.911 -3.221 1.00 0.00 C ATOM 0 H LEU A 8 10.180 -7.262 -5.972 1.00 0.00 H new ATOM 0 HA LEU A 8 12.170 -8.796 -7.107 1.00 0.00 H new ATOM 0 HB2 LEU A 8 10.947 -8.462 -4.612 1.00 0.00 H new ATOM 0 HB3 LEU A 8 10.698 -10.159 -4.970 1.00 0.00 H new ATOM 0 HG LEU A 8 13.109 -10.491 -5.243 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.688 -8.687 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.703 -8.280 -6.104 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.328 -7.550 -4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 8 13.772 -10.129 -2.897 1.00 0.00 H new ATOM 0 HD22 LEU A 8 12.376 -9.047 -2.674 1.00 0.00 H new ATOM 0 HD23 LEU A 8 12.118 -10.773 -3.023 1.00 0.00 H new ATOM 119 N PHE A 9 9.203 -10.178 -7.380 1.00 0.00 N ATOM 120 CA PHE A 9 8.458 -11.241 -8.043 1.00 0.00 C ATOM 121 C PHE A 9 8.921 -11.411 -9.487 1.00 0.00 C ATOM 122 O PHE A 9 9.107 -12.531 -9.964 1.00 0.00 O ATOM 123 CB PHE A 9 6.958 -10.941 -8.008 1.00 0.00 C ATOM 124 CG PHE A 9 6.330 -11.179 -6.665 1.00 0.00 C ATOM 125 CD1 PHE A 9 6.466 -12.403 -6.029 1.00 0.00 C ATOM 126 CD2 PHE A 9 5.604 -10.180 -6.038 1.00 0.00 C ATOM 127 CE1 PHE A 9 5.889 -12.625 -4.793 1.00 0.00 C ATOM 128 CE2 PHE A 9 5.026 -10.396 -4.801 1.00 0.00 C ATOM 129 CZ PHE A 9 5.168 -11.621 -4.179 1.00 0.00 C ATOM 0 H PHE A 9 8.621 -9.490 -6.902 1.00 0.00 H new ATOM 0 HA PHE A 9 8.647 -12.171 -7.507 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.797 -9.902 -8.297 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.454 -11.560 -8.750 1.00 0.00 H new ATOM 0 HD1 PHE A 9 7.029 -13.192 -6.505 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.488 -9.221 -6.521 1.00 0.00 H new ATOM 0 HE1 PHE A 9 6.002 -13.583 -4.308 1.00 0.00 H new ATOM 0 HE2 PHE A 9 4.464 -9.608 -4.322 1.00 0.00 H new ATOM 0 HZ PHE A 9 4.715 -11.793 -3.214 1.00 0.00 H new ATOM 139 N PHE A 10 9.103 -10.291 -10.179 1.00 0.00 N ATOM 140 CA PHE A 10 9.543 -10.314 -11.569 1.00 0.00 C ATOM 141 C PHE A 10 11.029 -10.647 -11.665 1.00 0.00 C ATOM 142 O PHE A 10 11.492 -11.184 -12.670 1.00 0.00 O ATOM 143 CB PHE A 10 9.267 -8.965 -12.236 1.00 0.00 C ATOM 144 CG PHE A 10 9.870 -8.838 -13.606 1.00 0.00 C ATOM 145 CD1 PHE A 10 11.156 -8.349 -13.769 1.00 0.00 C ATOM 146 CD2 PHE A 10 9.150 -9.209 -14.731 1.00 0.00 C ATOM 147 CE1 PHE A 10 11.713 -8.232 -15.028 1.00 0.00 C ATOM 148 CE2 PHE A 10 9.703 -9.094 -15.992 1.00 0.00 C ATOM 149 CZ PHE A 10 10.986 -8.604 -16.141 1.00 0.00 C ATOM 0 H PHE A 10 8.953 -9.356 -9.800 1.00 0.00 H new ATOM 0 HA PHE A 10 8.981 -11.090 -12.088 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.189 -8.818 -12.307 1.00 0.00 H new ATOM 0 HB3 PHE A 10 9.656 -8.169 -11.601 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.730 -8.056 -12.902 1.00 0.00 H new ATOM 0 HD2 PHE A 10 8.146 -9.592 -14.621 1.00 0.00 H new ATOM 0 HE1 PHE A 10 12.717 -7.850 -15.141 1.00 0.00 H new ATOM 0 HE2 PHE A 10 9.132 -9.387 -16.861 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.419 -8.512 -17.126 1.00 0.00 H new ATOM 159 N MET A 11 11.771 -10.322 -10.611 1.00 0.00 N ATOM 160 CA MET A 11 13.204 -10.587 -10.575 1.00 0.00 C ATOM 161 C MET A 11 13.478 -12.083 -10.462 1.00 0.00 C ATOM 162 O MET A 11 14.426 -12.596 -11.058 1.00 0.00 O ATOM 163 CB MET A 11 13.852 -9.848 -9.402 1.00 0.00 C ATOM 164 CG MET A 11 14.340 -8.453 -9.757 1.00 0.00 C ATOM 165 SD MET A 11 14.646 -7.433 -8.303 1.00 0.00 S ATOM 166 CE MET A 11 13.724 -5.957 -8.724 1.00 0.00 C ATOM 0 H MET A 11 11.403 -9.875 -9.771 1.00 0.00 H new ATOM 0 HA MET A 11 13.638 -10.226 -11.507 1.00 0.00 H new ATOM 0 HB2 MET A 11 13.132 -9.776 -8.587 1.00 0.00 H new ATOM 0 HB3 MET A 11 14.693 -10.435 -9.033 1.00 0.00 H new ATOM 0 HG2 MET A 11 15.257 -8.531 -10.341 1.00 0.00 H new ATOM 0 HG3 MET A 11 13.600 -7.964 -10.390 1.00 0.00 H new ATOM 0 HE1 MET A 11 13.376 -5.473 -7.812 1.00 0.00 H new ATOM 0 HE2 MET A 11 14.367 -5.272 -9.277 1.00 0.00 H new ATOM 0 HE3 MET A 11 12.867 -6.227 -9.341 1.00 0.00 H new ATOM 176 N ILE A 12 12.643 -12.777 -9.696 1.00 0.00 N ATOM 177 CA ILE A 12 12.796 -14.214 -9.507 1.00 0.00 C ATOM 178 C ILE A 12 12.146 -14.991 -10.646 1.00 0.00 C ATOM 179 O ILE A 12 12.721 -15.944 -11.169 1.00 0.00 O ATOM 180 CB ILE A 12 12.183 -14.674 -8.171 1.00 0.00 C ATOM 181 CG1 ILE A 12 12.947 -14.060 -6.996 1.00 0.00 C ATOM 182 CG2 ILE A 12 12.192 -16.193 -8.080 1.00 0.00 C ATOM 183 CD1 ILE A 12 12.140 -13.046 -6.215 1.00 0.00 C ATOM 0 H ILE A 12 11.854 -12.367 -9.196 1.00 0.00 H new ATOM 0 HA ILE A 12 13.867 -14.419 -9.496 1.00 0.00 H new ATOM 0 HB ILE A 12 11.149 -14.333 -8.126 1.00 0.00 H new ATOM 0 HG12 ILE A 12 13.264 -14.857 -6.323 1.00 0.00 H new ATOM 0 HG13 ILE A 12 13.851 -13.581 -7.371 1.00 0.00 H new ATOM 0 HG21 ILE A 12 11.756 -16.503 -7.130 1.00 0.00 H new ATOM 0 HG22 ILE A 12 11.609 -16.610 -8.901 1.00 0.00 H new ATOM 0 HG23 ILE A 12 13.218 -16.555 -8.143 1.00 0.00 H new ATOM 0 HD11 ILE A 12 12.744 -12.652 -5.397 1.00 0.00 H new ATOM 0 HD12 ILE A 12 11.845 -12.230 -6.874 1.00 0.00 H new ATOM 0 HD13 ILE A 12 11.249 -13.525 -5.810 1.00 0.00 H new ATOM 195 N ASN A 13 10.942 -14.574 -11.027 1.00 0.00 N ATOM 196 CA ASN A 13 10.213 -15.230 -12.107 1.00 0.00 C ATOM 197 C ASN A 13 11.000 -15.166 -13.412 1.00 0.00 C ATOM 198 O ASN A 13 11.204 -16.182 -14.078 1.00 0.00 O ATOM 199 CB ASN A 13 8.841 -14.579 -12.293 1.00 0.00 C ATOM 200 CG ASN A 13 7.876 -15.471 -13.049 1.00 0.00 C ATOM 201 OD1 ASN A 13 7.303 -15.067 -14.061 1.00 0.00 O ATOM 202 ND2 ASN A 13 7.690 -16.691 -12.558 1.00 0.00 N ATOM 0 H ASN A 13 10.451 -13.786 -10.604 1.00 0.00 H new ATOM 0 HA ASN A 13 10.077 -16.277 -11.837 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.420 -14.339 -11.317 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.958 -13.638 -12.830 1.00 0.00 H new ATOM 0 HD21 ASN A 13 7.051 -17.336 -13.023 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.187 -16.983 -11.716 1.00 0.00 H new ATOM 209 N THR A 14 11.442 -13.965 -13.773 1.00 0.00 N ATOM 210 CA THR A 14 12.206 -13.768 -14.998 1.00 0.00 C ATOM 211 C THR A 14 13.405 -14.707 -15.055 1.00 0.00 C ATOM 212 O THR A 14 13.860 -15.084 -16.135 1.00 0.00 O ATOM 213 CB THR A 14 12.699 -12.314 -15.124 1.00 0.00 C ATOM 214 OG1 THR A 14 13.150 -12.064 -16.460 1.00 0.00 O ATOM 215 CG2 THR A 14 13.829 -12.039 -14.143 1.00 0.00 C ATOM 0 H THR A 14 11.284 -13.114 -13.234 1.00 0.00 H new ATOM 0 HA THR A 14 11.536 -13.990 -15.828 1.00 0.00 H new ATOM 0 HB THR A 14 11.867 -11.650 -14.891 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.460 -11.137 -16.532 1.00 0.00 H new ATOM 0 HG21 THR A 14 14.161 -11.006 -14.250 1.00 0.00 H new ATOM 0 HG22 THR A 14 13.475 -12.202 -13.125 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.662 -12.711 -14.350 1.00 0.00 H new ATOM 223 N SER A 15 13.914 -15.081 -13.886 1.00 0.00 N ATOM 224 CA SER A 15 15.064 -15.974 -13.803 1.00 0.00 C ATOM 225 C SER A 15 14.682 -17.392 -14.219 1.00 0.00 C ATOM 226 O SER A 15 15.183 -17.914 -15.215 1.00 0.00 O ATOM 227 CB SER A 15 15.629 -15.983 -12.381 1.00 0.00 C ATOM 228 OG SER A 15 17.022 -16.244 -12.387 1.00 0.00 O ATOM 0 H SER A 15 13.548 -14.780 -12.983 1.00 0.00 H new ATOM 0 HA SER A 15 15.828 -15.606 -14.488 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.438 -15.021 -11.904 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.117 -16.740 -11.788 1.00 0.00 H new ATOM 0 HG SER A 15 17.359 -16.243 -11.467 1.00 0.00 H new ATOM 234 N ILE A 16 13.792 -18.008 -13.448 1.00 0.00 N ATOM 235 CA ILE A 16 13.342 -19.364 -13.737 1.00 0.00 C ATOM 236 C ILE A 16 12.838 -19.483 -15.171 1.00 0.00 C ATOM 237 O ILE A 16 12.886 -20.558 -15.770 1.00 0.00 O ATOM 238 CB ILE A 16 12.222 -19.802 -12.774 1.00 0.00 C ATOM 239 CG1 ILE A 16 12.706 -19.722 -11.324 1.00 0.00 C ATOM 240 CG2 ILE A 16 11.760 -21.213 -13.106 1.00 0.00 C ATOM 241 CD1 ILE A 16 11.583 -19.721 -10.311 1.00 0.00 C ATOM 0 H ILE A 16 13.369 -17.590 -12.619 1.00 0.00 H new ATOM 0 HA ILE A 16 14.204 -20.018 -13.602 1.00 0.00 H new ATOM 0 HB ILE A 16 11.376 -19.126 -12.893 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.365 -20.566 -11.123 1.00 0.00 H new ATOM 0 HG13 ILE A 16 13.300 -18.817 -11.197 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.969 -21.508 -12.417 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.381 -21.241 -14.128 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.599 -21.902 -13.012 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.000 -19.663 -9.306 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.936 -18.862 -10.486 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.003 -20.638 -10.410 1.00 0.00 H new ATOM 253 N LEU A 17 12.358 -18.371 -15.717 1.00 0.00 N ATOM 254 CA LEU A 17 11.847 -18.349 -17.084 1.00 0.00 C ATOM 255 C LEU A 17 12.984 -18.189 -18.088 1.00 0.00 C ATOM 256 O LEU A 17 13.127 -18.989 -19.013 1.00 0.00 O ATOM 257 CB LEU A 17 10.837 -17.213 -17.253 1.00 0.00 C ATOM 258 CG LEU A 17 9.451 -17.616 -17.759 1.00 0.00 C ATOM 259 CD1 LEU A 17 8.459 -16.482 -17.558 1.00 0.00 C ATOM 260 CD2 LEU A 17 9.515 -18.018 -19.226 1.00 0.00 C ATOM 0 H LEU A 17 12.312 -17.473 -15.235 1.00 0.00 H new ATOM 0 HA LEU A 17 11.350 -19.300 -17.276 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.719 -16.712 -16.292 1.00 0.00 H new ATOM 0 HB3 LEU A 17 11.256 -16.482 -17.944 1.00 0.00 H new ATOM 0 HG LEU A 17 9.110 -18.476 -17.182 1.00 0.00 H new ATOM 0 HD11 LEU A 17 7.479 -16.787 -17.924 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.392 -16.241 -16.497 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.794 -15.603 -18.109 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.520 -18.302 -19.569 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.877 -17.178 -19.818 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.194 -18.863 -19.342 1.00 0.00 H new ATOM 272 N LEU A 18 13.791 -17.151 -17.898 1.00 0.00 N ATOM 273 CA LEU A 18 14.918 -16.886 -18.786 1.00 0.00 C ATOM 274 C LEU A 18 15.791 -18.127 -18.943 1.00 0.00 C ATOM 275 O LEU A 18 16.174 -18.491 -20.055 1.00 0.00 O ATOM 276 CB LEU A 18 15.755 -15.725 -18.246 1.00 0.00 C ATOM 277 CG LEU A 18 15.273 -14.322 -18.616 1.00 0.00 C ATOM 278 CD1 LEU A 18 16.298 -13.278 -18.199 1.00 0.00 C ATOM 279 CD2 LEU A 18 14.992 -14.230 -20.108 1.00 0.00 C ATOM 0 H LEU A 18 13.686 -16.479 -17.138 1.00 0.00 H new ATOM 0 HA LEU A 18 14.522 -16.617 -19.765 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.788 -15.801 -17.159 1.00 0.00 H new ATOM 0 HB3 LEU A 18 16.778 -15.843 -18.605 1.00 0.00 H new ATOM 0 HG LEU A 18 14.345 -14.125 -18.080 1.00 0.00 H new ATOM 0 HD11 LEU A 18 15.938 -12.286 -18.470 1.00 0.00 H new ATOM 0 HD12 LEU A 18 16.449 -13.327 -17.121 1.00 0.00 H new ATOM 0 HD13 LEU A 18 17.243 -13.472 -18.707 1.00 0.00 H new ATOM 0 HD21 LEU A 18 14.650 -13.224 -20.352 1.00 0.00 H new ATOM 0 HD22 LEU A 18 15.904 -14.448 -20.664 1.00 0.00 H new ATOM 0 HD23 LEU A 18 14.221 -14.951 -20.378 1.00 0.00 H new ATOM 291 N ILE A 19 16.099 -18.773 -17.824 1.00 0.00 N ATOM 292 CA ILE A 19 16.923 -19.975 -17.838 1.00 0.00 C ATOM 293 C ILE A 19 16.398 -20.990 -18.848 1.00 0.00 C ATOM 294 O ILE A 19 17.065 -21.302 -19.835 1.00 0.00 O ATOM 295 CB ILE A 19 16.981 -20.635 -16.448 1.00 0.00 C ATOM 296 CG1 ILE A 19 17.543 -19.653 -15.417 1.00 0.00 C ATOM 297 CG2 ILE A 19 17.825 -21.900 -16.497 1.00 0.00 C ATOM 298 CD1 ILE A 19 16.948 -19.822 -14.036 1.00 0.00 C ATOM 0 H ILE A 19 15.790 -18.484 -16.896 1.00 0.00 H new ATOM 0 HA ILE A 19 17.927 -19.665 -18.126 1.00 0.00 H new ATOM 0 HB ILE A 19 15.969 -20.908 -16.149 1.00 0.00 H new ATOM 0 HG12 ILE A 19 18.624 -19.781 -15.357 1.00 0.00 H new ATOM 0 HG13 ILE A 19 17.361 -18.635 -15.760 1.00 0.00 H new ATOM 0 HG21 ILE A 19 17.856 -22.355 -15.507 1.00 0.00 H new ATOM 0 HG22 ILE A 19 17.387 -22.603 -17.206 1.00 0.00 H new ATOM 0 HG23 ILE A 19 18.838 -21.650 -16.814 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.392 -19.094 -13.357 1.00 0.00 H new ATOM 0 HD12 ILE A 19 15.870 -19.665 -14.082 1.00 0.00 H new ATOM 0 HD13 ILE A 19 17.153 -20.829 -13.672 1.00 0.00 H new ATOM 310 N PHE A 20 15.197 -21.500 -18.596 1.00 0.00 N ATOM 311 CA PHE A 20 14.580 -22.479 -19.484 1.00 0.00 C ATOM 312 C PHE A 20 14.397 -21.904 -20.885 1.00 0.00 C ATOM 313 O PHE A 20 14.491 -22.623 -21.880 1.00 0.00 O ATOM 314 CB PHE A 20 13.229 -22.927 -18.924 1.00 0.00 C ATOM 315 CG PHE A 20 12.662 -24.132 -19.618 1.00 0.00 C ATOM 316 CD1 PHE A 20 13.227 -25.384 -19.434 1.00 0.00 C ATOM 317 CD2 PHE A 20 11.564 -24.013 -20.455 1.00 0.00 C ATOM 318 CE1 PHE A 20 12.707 -26.495 -20.072 1.00 0.00 C ATOM 319 CE2 PHE A 20 11.040 -25.121 -21.095 1.00 0.00 C ATOM 320 CZ PHE A 20 11.613 -26.363 -20.904 1.00 0.00 C ATOM 0 H PHE A 20 14.632 -21.252 -17.784 1.00 0.00 H new ATOM 0 HA PHE A 20 15.243 -23.342 -19.549 1.00 0.00 H new ATOM 0 HB2 PHE A 20 13.340 -23.148 -17.862 1.00 0.00 H new ATOM 0 HB3 PHE A 20 12.520 -22.103 -19.006 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.083 -25.493 -18.785 1.00 0.00 H new ATOM 0 HD2 PHE A 20 11.113 -23.044 -20.609 1.00 0.00 H new ATOM 0 HE1 PHE A 20 13.156 -27.465 -19.920 1.00 0.00 H new ATOM 0 HE2 PHE A 20 10.183 -25.015 -21.744 1.00 0.00 H new ATOM 0 HZ PHE A 20 11.206 -27.229 -21.404 1.00 0.00 H new ATOM 330 N ILE A 21 14.135 -20.603 -20.954 1.00 0.00 N ATOM 331 CA ILE A 21 13.939 -19.930 -22.232 1.00 0.00 C ATOM 332 C ILE A 21 15.183 -20.040 -23.108 1.00 0.00 C ATOM 333 O ILE A 21 15.105 -20.441 -24.269 1.00 0.00 O ATOM 334 CB ILE A 21 13.592 -18.442 -22.038 1.00 0.00 C ATOM 335 CG1 ILE A 21 12.078 -18.262 -21.910 1.00 0.00 C ATOM 336 CG2 ILE A 21 14.133 -17.617 -23.196 1.00 0.00 C ATOM 337 CD1 ILE A 21 11.673 -16.902 -21.388 1.00 0.00 C ATOM 0 H ILE A 21 14.054 -19.994 -20.140 1.00 0.00 H new ATOM 0 HA ILE A 21 13.104 -20.428 -22.726 1.00 0.00 H new ATOM 0 HB ILE A 21 14.060 -18.091 -21.118 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.618 -18.419 -22.886 1.00 0.00 H new ATOM 0 HG13 ILE A 21 11.684 -19.030 -21.244 1.00 0.00 H new ATOM 0 HG21 ILE A 21 13.880 -16.568 -23.045 1.00 0.00 H new ATOM 0 HG22 ILE A 21 15.216 -17.725 -23.245 1.00 0.00 H new ATOM 0 HG23 ILE A 21 13.691 -17.966 -24.129 1.00 0.00 H new ATOM 0 HD11 ILE A 21 10.586 -16.846 -21.323 1.00 0.00 H new ATOM 0 HD12 ILE A 21 12.104 -16.749 -20.398 1.00 0.00 H new ATOM 0 HD13 ILE A 21 12.036 -16.129 -22.065 1.00 0.00 H new ATOM 349 N PHE A 22 16.332 -19.684 -22.542 1.00 0.00 N ATOM 350 CA PHE A 22 17.594 -19.743 -23.270 1.00 0.00 C ATOM 351 C PHE A 22 18.046 -21.188 -23.457 1.00 0.00 C ATOM 352 O PHE A 22 18.380 -21.607 -24.566 1.00 0.00 O ATOM 353 CB PHE A 22 18.672 -18.950 -22.529 1.00 0.00 C ATOM 354 CG PHE A 22 18.370 -17.483 -22.421 1.00 0.00 C ATOM 355 CD1 PHE A 22 18.223 -16.707 -23.559 1.00 0.00 C ATOM 356 CD2 PHE A 22 18.233 -16.880 -21.181 1.00 0.00 C ATOM 357 CE1 PHE A 22 17.945 -15.356 -23.462 1.00 0.00 C ATOM 358 CE2 PHE A 22 17.956 -15.530 -21.078 1.00 0.00 C ATOM 359 CZ PHE A 22 17.811 -14.768 -22.220 1.00 0.00 C ATOM 0 H PHE A 22 16.415 -19.352 -21.581 1.00 0.00 H new ATOM 0 HA PHE A 22 17.439 -19.299 -24.254 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.791 -19.363 -21.527 1.00 0.00 H new ATOM 0 HB3 PHE A 22 19.625 -19.080 -23.043 1.00 0.00 H new ATOM 0 HD1 PHE A 22 18.327 -17.162 -24.533 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.344 -17.472 -20.285 1.00 0.00 H new ATOM 0 HE1 PHE A 22 17.833 -14.761 -24.357 1.00 0.00 H new ATOM 0 HE2 PHE A 22 17.853 -15.072 -20.105 1.00 0.00 H new ATOM 0 HZ PHE A 22 17.593 -13.713 -22.142 1.00 0.00 H new ATOM 369 N ILE A 23 18.056 -21.945 -22.365 1.00 0.00 N ATOM 370 CA ILE A 23 18.467 -23.342 -22.408 1.00 0.00 C ATOM 371 C ILE A 23 17.753 -24.091 -23.528 1.00 0.00 C ATOM 372 O ILE A 23 18.334 -24.962 -24.176 1.00 0.00 O ATOM 373 CB ILE A 23 18.186 -24.053 -21.071 1.00 0.00 C ATOM 374 CG1 ILE A 23 19.398 -23.940 -20.144 1.00 0.00 C ATOM 375 CG2 ILE A 23 17.831 -25.513 -21.311 1.00 0.00 C ATOM 376 CD1 ILE A 23 19.586 -22.558 -19.560 1.00 0.00 C ATOM 0 H ILE A 23 17.784 -21.614 -21.439 1.00 0.00 H new ATOM 0 HA ILE A 23 19.541 -23.349 -22.596 1.00 0.00 H new ATOM 0 HB ILE A 23 17.337 -23.567 -20.590 1.00 0.00 H new ATOM 0 HG12 ILE A 23 19.291 -24.658 -19.331 1.00 0.00 H new ATOM 0 HG13 ILE A 23 20.295 -24.217 -20.697 1.00 0.00 H new ATOM 0 HG21 ILE A 23 17.635 -26.002 -20.356 1.00 0.00 H new ATOM 0 HG22 ILE A 23 16.942 -25.573 -21.938 1.00 0.00 H new ATOM 0 HG23 ILE A 23 18.661 -26.012 -21.810 1.00 0.00 H new ATOM 0 HD11 ILE A 23 20.464 -22.553 -18.913 1.00 0.00 H new ATOM 0 HD12 ILE A 23 19.725 -21.838 -20.366 1.00 0.00 H new ATOM 0 HD13 ILE A 23 18.705 -22.286 -18.978 1.00 0.00 H new ATOM 388 N VAL A 24 16.489 -23.745 -23.753 1.00 0.00 N ATOM 389 CA VAL A 24 15.696 -24.382 -24.797 1.00 0.00 C ATOM 390 C VAL A 24 15.993 -23.771 -26.162 1.00 0.00 C ATOM 391 O VAL A 24 15.895 -24.443 -27.190 1.00 0.00 O ATOM 392 CB VAL A 24 14.188 -24.260 -24.509 1.00 0.00 C ATOM 393 CG1 VAL A 24 13.376 -24.726 -25.708 1.00 0.00 C ATOM 394 CG2 VAL A 24 13.818 -25.052 -23.264 1.00 0.00 C ATOM 0 H VAL A 24 15.993 -23.027 -23.226 1.00 0.00 H new ATOM 0 HA VAL A 24 15.972 -25.436 -24.806 1.00 0.00 H new ATOM 0 HB VAL A 24 13.954 -23.211 -24.328 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.313 -24.633 -25.486 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.621 -24.112 -26.574 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.611 -25.768 -25.924 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.749 -24.955 -23.075 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.066 -26.103 -23.414 1.00 0.00 H new ATOM 0 HG23 VAL A 24 14.374 -24.667 -22.409 1.00 0.00 H new ATOM 404 N LEU A 25 16.356 -22.493 -26.166 1.00 0.00 N ATOM 405 CA LEU A 25 16.669 -21.790 -27.405 1.00 0.00 C ATOM 406 C LEU A 25 17.989 -22.279 -27.991 1.00 0.00 C ATOM 407 O LEU A 25 18.107 -22.484 -29.200 1.00 0.00 O ATOM 408 CB LEU A 25 16.735 -20.282 -27.157 1.00 0.00 C ATOM 409 CG LEU A 25 15.407 -19.528 -27.244 1.00 0.00 C ATOM 410 CD1 LEU A 25 15.634 -18.031 -27.102 1.00 0.00 C ATOM 411 CD2 LEU A 25 14.702 -19.841 -28.555 1.00 0.00 C ATOM 0 H LEU A 25 16.441 -21.922 -25.325 1.00 0.00 H new ATOM 0 HA LEU A 25 15.875 -21.999 -28.122 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.160 -20.115 -26.167 1.00 0.00 H new ATOM 0 HB3 LEU A 25 17.426 -19.845 -27.878 1.00 0.00 H new ATOM 0 HG LEU A 25 14.769 -19.857 -26.424 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.679 -17.510 -27.166 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.096 -17.823 -26.137 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.290 -17.685 -27.901 1.00 0.00 H new ATOM 0 HD21 LEU A 25 13.759 -19.296 -28.600 1.00 0.00 H new ATOM 0 HD22 LEU A 25 15.335 -19.540 -29.390 1.00 0.00 H new ATOM 0 HD23 LEU A 25 14.506 -20.911 -28.616 1.00 0.00 H new ATOM 423 N LEU A 26 18.981 -22.466 -27.126 1.00 0.00 N ATOM 424 CA LEU A 26 20.294 -22.934 -27.557 1.00 0.00 C ATOM 425 C LEU A 26 20.171 -24.193 -28.408 1.00 0.00 C ATOM 426 O LEU A 26 20.782 -24.297 -29.472 1.00 0.00 O ATOM 427 CB LEU A 26 21.182 -23.209 -26.343 1.00 0.00 C ATOM 428 CG LEU A 26 22.007 -22.027 -25.832 1.00 0.00 C ATOM 429 CD1 LEU A 26 22.807 -21.405 -26.966 1.00 0.00 C ATOM 430 CD2 LEU A 26 21.105 -20.989 -25.181 1.00 0.00 C ATOM 0 H LEU A 26 18.901 -22.301 -26.123 1.00 0.00 H new ATOM 0 HA LEU A 26 20.751 -22.152 -28.164 1.00 0.00 H new ATOM 0 HB2 LEU A 26 20.550 -23.564 -25.529 1.00 0.00 H new ATOM 0 HB3 LEU A 26 21.865 -24.021 -26.594 1.00 0.00 H new ATOM 0 HG LEU A 26 22.706 -22.394 -25.080 1.00 0.00 H new ATOM 0 HD11 LEU A 26 23.388 -20.566 -26.584 1.00 0.00 H new ATOM 0 HD12 LEU A 26 23.481 -22.151 -27.387 1.00 0.00 H new ATOM 0 HD13 LEU A 26 22.126 -21.052 -27.741 1.00 0.00 H new ATOM 0 HD21 LEU A 26 21.709 -20.155 -24.823 1.00 0.00 H new ATOM 0 HD22 LEU A 26 20.382 -20.626 -25.911 1.00 0.00 H new ATOM 0 HD23 LEU A 26 20.577 -21.441 -24.341 1.00 0.00 H new ATOM 442 N ILE A 27 19.376 -25.147 -27.933 1.00 0.00 N ATOM 443 CA ILE A 27 19.170 -26.397 -28.653 1.00 0.00 C ATOM 444 C ILE A 27 18.409 -26.165 -29.953 1.00 0.00 C ATOM 445 O ILE A 27 18.833 -26.609 -31.021 1.00 0.00 O ATOM 446 CB ILE A 27 18.400 -27.420 -27.796 1.00 0.00 C ATOM 447 CG1 ILE A 27 19.376 -28.286 -26.996 1.00 0.00 C ATOM 448 CG2 ILE A 27 17.512 -28.287 -28.676 1.00 0.00 C ATOM 449 CD1 ILE A 27 19.259 -28.103 -25.499 1.00 0.00 C ATOM 0 H ILE A 27 18.865 -25.077 -27.053 1.00 0.00 H new ATOM 0 HA ILE A 27 20.159 -26.796 -28.881 1.00 0.00 H new ATOM 0 HB ILE A 27 17.765 -26.879 -27.094 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.203 -29.334 -27.240 1.00 0.00 H new ATOM 0 HG13 ILE A 27 20.395 -28.050 -27.304 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.975 -29.005 -28.056 1.00 0.00 H new ATOM 0 HG22 ILE A 27 16.797 -27.657 -29.204 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.128 -28.822 -29.399 1.00 0.00 H new ATOM 0 HD11 ILE A 27 19.980 -28.747 -24.996 1.00 0.00 H new ATOM 0 HD12 ILE A 27 19.461 -27.063 -25.243 1.00 0.00 H new ATOM 0 HD13 ILE A 27 18.251 -28.367 -25.178 1.00 0.00 H new ATOM 461 N HIS A 28 17.283 -25.465 -29.857 1.00 0.00 N ATOM 462 CA HIS A 28 16.463 -25.171 -31.026 1.00 0.00 C ATOM 463 C HIS A 28 17.315 -24.611 -32.161 1.00 0.00 C ATOM 464 O HIS A 28 17.030 -24.839 -33.337 1.00 0.00 O ATOM 465 CB HIS A 28 15.358 -24.178 -30.664 1.00 0.00 C ATOM 466 CG HIS A 28 14.578 -23.693 -31.847 1.00 0.00 C ATOM 467 ND1 HIS A 28 13.484 -24.363 -32.353 1.00 0.00 N ATOM 468 CD2 HIS A 28 14.737 -22.595 -32.623 1.00 0.00 C ATOM 469 CE1 HIS A 28 13.006 -23.699 -33.391 1.00 0.00 C ATOM 470 NE2 HIS A 28 13.748 -22.622 -33.575 1.00 0.00 N ATOM 0 H HIS A 28 16.918 -25.091 -28.981 1.00 0.00 H new ATOM 0 HA HIS A 28 16.008 -26.102 -31.363 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.675 -24.649 -29.957 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.802 -23.322 -30.156 1.00 0.00 H new ATOM 0 HD2 HIS A 28 15.500 -21.838 -32.514 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.153 -23.988 -33.988 1.00 0.00 H new ATOM 0 HE2 HIS A 28 13.609 -21.924 -34.306 1.00 0.00 H new ATOM 478 N PHE A 29 18.362 -23.875 -31.800 1.00 0.00 N ATOM 479 CA PHE A 29 19.255 -23.281 -32.788 1.00 0.00 C ATOM 480 C PHE A 29 20.493 -24.149 -32.994 1.00 0.00 C ATOM 481 O PHE A 29 21.156 -24.066 -34.027 1.00 0.00 O ATOM 482 CB PHE A 29 19.671 -21.875 -32.349 1.00 0.00 C ATOM 483 CG PHE A 29 18.624 -20.831 -32.612 1.00 0.00 C ATOM 484 CD1 PHE A 29 18.192 -20.573 -33.903 1.00 0.00 C ATOM 485 CD2 PHE A 29 18.072 -20.106 -31.568 1.00 0.00 C ATOM 486 CE1 PHE A 29 17.229 -19.613 -34.148 1.00 0.00 C ATOM 487 CE2 PHE A 29 17.108 -19.145 -31.807 1.00 0.00 C ATOM 488 CZ PHE A 29 16.687 -18.897 -33.098 1.00 0.00 C ATOM 0 H PHE A 29 18.612 -23.676 -30.831 1.00 0.00 H new ATOM 0 HA PHE A 29 18.718 -23.215 -33.734 1.00 0.00 H new ATOM 0 HB2 PHE A 29 19.900 -21.888 -31.283 1.00 0.00 H new ATOM 0 HB3 PHE A 29 20.588 -21.597 -32.868 1.00 0.00 H new ATOM 0 HD1 PHE A 29 18.613 -21.129 -34.728 1.00 0.00 H new ATOM 0 HD2 PHE A 29 18.399 -20.294 -30.556 1.00 0.00 H new ATOM 0 HE1 PHE A 29 16.900 -19.423 -35.159 1.00 0.00 H new ATOM 0 HE2 PHE A 29 16.684 -18.588 -30.984 1.00 0.00 H new ATOM 0 HZ PHE A 29 15.935 -18.145 -33.287 1.00 0.00 H new ATOM 498 N GLU A 30 20.797 -24.980 -32.002 1.00 0.00 N ATOM 499 CA GLU A 30 21.956 -25.862 -32.075 1.00 0.00 C ATOM 500 C GLU A 30 21.723 -26.986 -33.080 1.00 0.00 C ATOM 501 O GLU A 30 22.597 -27.820 -33.310 1.00 0.00 O ATOM 502 CB GLU A 30 22.262 -26.452 -30.696 1.00 0.00 C ATOM 503 CG GLU A 30 23.408 -25.759 -29.979 1.00 0.00 C ATOM 504 CD GLU A 30 24.764 -26.315 -30.370 1.00 0.00 C ATOM 505 OE1 GLU A 30 25.150 -27.373 -29.830 1.00 0.00 O ATOM 506 OE2 GLU A 30 25.438 -25.692 -31.217 1.00 0.00 O ATOM 0 H GLU A 30 20.258 -25.061 -31.140 1.00 0.00 H new ATOM 0 HA GLU A 30 22.809 -25.272 -32.408 1.00 0.00 H new ATOM 0 HB2 GLU A 30 21.367 -26.391 -30.077 1.00 0.00 H new ATOM 0 HB3 GLU A 30 22.501 -27.510 -30.807 1.00 0.00 H new ATOM 0 HG2 GLU A 30 23.379 -24.692 -30.202 1.00 0.00 H new ATOM 0 HG3 GLU A 30 23.274 -25.863 -28.902 1.00 0.00 H new ATOM 513 N GLY A 31 20.535 -27.000 -33.678 1.00 0.00 N ATOM 514 CA GLY A 31 20.206 -28.025 -34.651 1.00 0.00 C ATOM 515 C GLY A 31 18.932 -28.768 -34.303 1.00 0.00 C ATOM 516 O GLY A 31 18.905 -29.999 -34.297 1.00 0.00 O ATOM 0 H GLY A 31 19.795 -26.320 -33.506 1.00 0.00 H new ATOM 0 HA2 GLY A 31 20.099 -27.567 -35.634 1.00 0.00 H new ATOM 0 HA3 GLY A 31 21.030 -28.735 -34.719 1.00 0.00 H new ATOM 520 N TRP A 32 17.874 -28.020 -34.012 1.00 0.00 N ATOM 521 CA TRP A 32 16.590 -28.616 -33.660 1.00 0.00 C ATOM 522 C TRP A 32 15.461 -27.999 -34.478 1.00 0.00 C ATOM 523 O TRP A 32 14.296 -28.051 -34.083 1.00 0.00 O ATOM 524 CB TRP A 32 16.313 -28.434 -32.167 1.00 0.00 C ATOM 525 CG TRP A 32 16.187 -29.730 -31.424 1.00 0.00 C ATOM 526 CD1 TRP A 32 15.043 -30.274 -30.912 1.00 0.00 C ATOM 527 CD2 TRP A 32 17.244 -30.643 -31.109 1.00 0.00 C ATOM 528 NE1 TRP A 32 15.326 -31.470 -30.298 1.00 0.00 N ATOM 529 CE2 TRP A 32 16.668 -31.719 -30.405 1.00 0.00 C ATOM 530 CE3 TRP A 32 18.619 -30.658 -31.353 1.00 0.00 C ATOM 531 CZ2 TRP A 32 17.422 -32.795 -29.945 1.00 0.00 C ATOM 532 CZ3 TRP A 32 19.366 -31.726 -30.895 1.00 0.00 C ATOM 533 CH2 TRP A 32 18.767 -32.783 -30.198 1.00 0.00 C ATOM 0 H TRP A 32 17.880 -27.000 -34.013 1.00 0.00 H new ATOM 0 HA TRP A 32 16.637 -29.681 -33.887 1.00 0.00 H new ATOM 0 HB2 TRP A 32 17.117 -27.846 -31.724 1.00 0.00 H new ATOM 0 HB3 TRP A 32 15.394 -27.861 -32.042 1.00 0.00 H new ATOM 0 HD1 TRP A 32 14.061 -29.829 -30.980 1.00 0.00 H new ATOM 0 HE1 TRP A 32 14.646 -32.075 -29.837 1.00 0.00 H new ATOM 0 HE3 TRP A 32 19.090 -29.848 -31.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 16.962 -33.611 -29.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 20.430 -31.746 -31.078 1.00 0.00 H new ATOM 0 HH2 TRP A 32 19.378 -33.604 -29.854 1.00 0.00 H new ATOM 544 N ARG A 33 15.813 -27.416 -35.619 1.00 0.00 N ATOM 545 CA ARG A 33 14.828 -26.789 -36.492 1.00 0.00 C ATOM 546 C ARG A 33 14.849 -27.422 -37.880 1.00 0.00 C ATOM 547 O ARG A 33 14.693 -26.735 -38.889 1.00 0.00 O ATOM 548 CB ARG A 33 15.096 -25.286 -36.602 1.00 0.00 C ATOM 549 CG ARG A 33 13.840 -24.458 -36.818 1.00 0.00 C ATOM 550 CD ARG A 33 13.656 -24.096 -38.283 1.00 0.00 C ATOM 551 NE ARG A 33 12.984 -22.811 -38.450 1.00 0.00 N ATOM 552 CZ ARG A 33 13.605 -21.640 -38.358 1.00 0.00 C ATOM 553 NH1 ARG A 33 14.906 -21.593 -38.104 1.00 0.00 N ATOM 554 NH2 ARG A 33 12.925 -20.512 -38.523 1.00 0.00 N ATOM 0 H ARG A 33 16.773 -27.365 -35.961 1.00 0.00 H new ATOM 0 HA ARG A 33 13.842 -26.945 -36.055 1.00 0.00 H new ATOM 0 HB2 ARG A 33 15.593 -24.947 -35.693 1.00 0.00 H new ATOM 0 HB3 ARG A 33 15.785 -25.108 -37.428 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.971 -25.015 -36.468 1.00 0.00 H new ATOM 0 HG3 ARG A 33 13.896 -23.547 -36.221 1.00 0.00 H new ATOM 0 HD2 ARG A 33 14.629 -24.062 -38.773 1.00 0.00 H new ATOM 0 HD3 ARG A 33 13.077 -24.875 -38.779 1.00 0.00 H new ATOM 0 HE ARG A 33 11.983 -22.812 -38.648 1.00 0.00 H new ATOM 0 HH11 ARG A 33 15.433 -22.457 -37.979 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.380 -20.692 -38.034 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.925 -20.544 -38.721 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.403 -19.614 -38.452 1.00 0.00 H new ATOM 568 N ILE A 34 15.043 -28.736 -37.922 1.00 0.00 N ATOM 569 CA ILE A 34 15.084 -29.462 -39.185 1.00 0.00 C ATOM 570 C ILE A 34 13.749 -29.367 -39.917 1.00 0.00 C ATOM 571 O ILE A 34 13.523 -28.394 -40.634 1.00 0.00 O ATOM 572 CB ILE A 34 15.434 -30.946 -38.970 1.00 0.00 C ATOM 573 CG1 ILE A 34 16.776 -31.076 -38.247 1.00 0.00 C ATOM 574 CG2 ILE A 34 15.471 -31.680 -40.303 1.00 0.00 C ATOM 575 CD1 ILE A 34 17.019 -32.452 -37.666 1.00 0.00 C ATOM 0 H ILE A 34 15.174 -29.319 -37.096 1.00 0.00 H new ATOM 0 HA ILE A 34 15.862 -28.998 -39.791 1.00 0.00 H new ATOM 0 HB ILE A 34 14.662 -31.400 -38.349 1.00 0.00 H new ATOM 0 HG12 ILE A 34 17.580 -30.838 -38.944 1.00 0.00 H new ATOM 0 HG13 ILE A 34 16.820 -30.339 -37.445 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.720 -32.728 -40.135 1.00 0.00 H new ATOM 0 HG22 ILE A 34 14.495 -31.611 -40.783 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.225 -31.227 -40.947 1.00 0.00 H new ATOM 0 HD11 ILE A 34 17.989 -32.471 -37.169 1.00 0.00 H new ATOM 0 HD12 ILE A 34 16.236 -32.686 -36.944 1.00 0.00 H new ATOM 0 HD13 ILE A 34 17.007 -33.192 -38.466 1.00 0.00 H new TER 587 ILE A 34 ATOM 588 N MET B 101 14.789 8.222 -2.181 1.00 0.00 N ATOM 589 CA MET B 101 13.970 7.269 -1.441 1.00 0.00 C ATOM 590 C MET B 101 13.085 6.463 -2.387 1.00 0.00 C ATOM 591 O MET B 101 12.021 5.983 -1.998 1.00 0.00 O ATOM 592 CB MET B 101 13.105 7.998 -0.411 1.00 0.00 C ATOM 593 CG MET B 101 13.824 8.274 0.899 1.00 0.00 C ATOM 594 SD MET B 101 15.053 9.585 0.755 1.00 0.00 S ATOM 595 CE MET B 101 14.098 11.004 1.286 1.00 0.00 C ATOM 0 HA MET B 101 14.637 6.581 -0.922 1.00 0.00 H new ATOM 0 HB2 MET B 101 12.766 8.943 -0.836 1.00 0.00 H new ATOM 0 HB3 MET B 101 12.215 7.402 -0.209 1.00 0.00 H new ATOM 0 HG2 MET B 101 13.093 8.549 1.659 1.00 0.00 H new ATOM 0 HG3 MET B 101 14.311 7.361 1.241 1.00 0.00 H new ATOM 0 HE1 MET B 101 14.723 11.897 1.252 1.00 0.00 H new ATOM 0 HE2 MET B 101 13.242 11.135 0.624 1.00 0.00 H new ATOM 0 HE3 MET B 101 13.747 10.846 2.306 1.00 0.00 H new ATOM 605 N ASP B 102 13.532 6.320 -3.630 1.00 0.00 N ATOM 606 CA ASP B 102 12.780 5.572 -4.631 1.00 0.00 C ATOM 607 C ASP B 102 13.708 5.029 -5.714 1.00 0.00 C ATOM 608 O ASP B 102 14.343 5.793 -6.441 1.00 0.00 O ATOM 609 CB ASP B 102 11.706 6.460 -5.261 1.00 0.00 C ATOM 610 CG ASP B 102 10.633 6.864 -4.269 1.00 0.00 C ATOM 611 OD1 ASP B 102 9.771 6.019 -3.950 1.00 0.00 O ATOM 612 OD2 ASP B 102 10.658 8.025 -3.810 1.00 0.00 O ATOM 0 H ASP B 102 14.411 6.712 -3.968 1.00 0.00 H new ATOM 0 HA ASP B 102 12.299 4.730 -4.134 1.00 0.00 H new ATOM 0 HB2 ASP B 102 12.174 7.355 -5.671 1.00 0.00 H new ATOM 0 HB3 ASP B 102 11.245 5.931 -6.095 1.00 0.00 H new ATOM 617 N SER B 103 13.782 3.706 -5.813 1.00 0.00 N ATOM 618 CA SER B 103 14.636 3.060 -6.803 1.00 0.00 C ATOM 619 C SER B 103 13.800 2.411 -7.901 1.00 0.00 C ATOM 620 O SER B 103 14.124 1.328 -8.386 1.00 0.00 O ATOM 621 CB SER B 103 15.524 2.009 -6.134 1.00 0.00 C ATOM 622 OG SER B 103 16.594 2.618 -5.431 1.00 0.00 O ATOM 0 H SER B 103 13.261 3.060 -5.220 1.00 0.00 H new ATOM 0 HA SER B 103 15.268 3.824 -7.255 1.00 0.00 H new ATOM 0 HB2 SER B 103 14.928 1.409 -5.447 1.00 0.00 H new ATOM 0 HB3 SER B 103 15.920 1.330 -6.889 1.00 0.00 H new ATOM 0 HG SER B 103 17.146 1.925 -5.011 1.00 0.00 H new ATOM 628 N ALA B 104 12.720 3.083 -8.289 1.00 0.00 N ATOM 629 CA ALA B 104 11.838 2.574 -9.332 1.00 0.00 C ATOM 630 C ALA B 104 12.517 2.617 -10.696 1.00 0.00 C ATOM 631 O ALA B 104 12.703 1.595 -11.357 1.00 0.00 O ATOM 632 CB ALA B 104 10.541 3.369 -9.360 1.00 0.00 C ATOM 0 H ALA B 104 12.436 3.981 -7.897 1.00 0.00 H new ATOM 0 HA ALA B 104 11.609 1.533 -9.103 1.00 0.00 H new ATOM 0 HB1 ALA B 104 9.892 2.978 -10.143 1.00 0.00 H new ATOM 0 HB2 ALA B 104 10.040 3.282 -8.396 1.00 0.00 H new ATOM 0 HB3 ALA B 104 10.761 4.418 -9.561 1.00 0.00 H new ATOM 638 N PRO B 105 12.896 3.828 -11.131 1.00 0.00 N ATOM 639 CA PRO B 105 13.561 4.033 -12.421 1.00 0.00 C ATOM 640 C PRO B 105 14.979 3.475 -12.438 1.00 0.00 C ATOM 641 O PRO B 105 15.501 3.109 -13.492 1.00 0.00 O ATOM 642 CB PRO B 105 13.584 5.557 -12.570 1.00 0.00 C ATOM 643 CG PRO B 105 13.535 6.074 -11.174 1.00 0.00 C ATOM 644 CD PRO B 105 12.706 5.090 -10.396 1.00 0.00 C ATOM 0 HA PRO B 105 13.044 3.519 -13.232 1.00 0.00 H new ATOM 0 HB2 PRO B 105 14.485 5.891 -13.085 1.00 0.00 H new ATOM 0 HB3 PRO B 105 12.734 5.911 -13.153 1.00 0.00 H new ATOM 0 HG2 PRO B 105 14.537 6.158 -10.754 1.00 0.00 H new ATOM 0 HG3 PRO B 105 13.091 7.069 -11.142 1.00 0.00 H new ATOM 0 HD2 PRO B 105 13.044 5.008 -9.363 1.00 0.00 H new ATOM 0 HD3 PRO B 105 11.657 5.384 -10.366 1.00 0.00 H new ATOM 652 N PHE B 106 15.600 3.412 -11.264 1.00 0.00 N ATOM 653 CA PHE B 106 16.959 2.899 -11.145 1.00 0.00 C ATOM 654 C PHE B 106 16.976 1.376 -11.246 1.00 0.00 C ATOM 655 O PHE B 106 17.921 0.790 -11.774 1.00 0.00 O ATOM 656 CB PHE B 106 17.578 3.339 -9.817 1.00 0.00 C ATOM 657 CG PHE B 106 18.189 4.711 -9.866 1.00 0.00 C ATOM 658 CD1 PHE B 106 19.346 4.942 -10.593 1.00 0.00 C ATOM 659 CD2 PHE B 106 17.606 5.768 -9.186 1.00 0.00 C ATOM 660 CE1 PHE B 106 19.910 6.203 -10.639 1.00 0.00 C ATOM 661 CE2 PHE B 106 18.166 7.031 -9.229 1.00 0.00 C ATOM 662 CZ PHE B 106 19.319 7.249 -9.957 1.00 0.00 C ATOM 0 H PHE B 106 15.183 3.710 -10.382 1.00 0.00 H new ATOM 0 HA PHE B 106 17.548 3.307 -11.966 1.00 0.00 H new ATOM 0 HB2 PHE B 106 16.811 3.319 -9.043 1.00 0.00 H new ATOM 0 HB3 PHE B 106 18.343 2.619 -9.526 1.00 0.00 H new ATOM 0 HD1 PHE B 106 19.812 4.128 -11.129 1.00 0.00 H new ATOM 0 HD2 PHE B 106 16.704 5.603 -8.616 1.00 0.00 H new ATOM 0 HE1 PHE B 106 20.813 6.371 -11.208 1.00 0.00 H new ATOM 0 HE2 PHE B 106 17.702 7.846 -8.694 1.00 0.00 H new ATOM 0 HZ PHE B 106 19.758 8.235 -9.993 1.00 0.00 H new ATOM 672 N GLU B 107 15.924 0.743 -10.736 1.00 0.00 N ATOM 673 CA GLU B 107 15.819 -0.711 -10.768 1.00 0.00 C ATOM 674 C GLU B 107 15.880 -1.229 -12.202 1.00 0.00 C ATOM 675 O GLU B 107 16.424 -2.303 -12.464 1.00 0.00 O ATOM 676 CB GLU B 107 14.518 -1.165 -10.105 1.00 0.00 C ATOM 677 CG GLU B 107 14.726 -1.868 -8.773 1.00 0.00 C ATOM 678 CD GLU B 107 13.458 -1.937 -7.946 1.00 0.00 C ATOM 679 OE1 GLU B 107 12.850 -0.874 -7.701 1.00 0.00 O ATOM 680 OE2 GLU B 107 13.072 -3.055 -7.542 1.00 0.00 O ATOM 0 H GLU B 107 15.133 1.214 -10.296 1.00 0.00 H new ATOM 0 HA GLU B 107 16.663 -1.123 -10.215 1.00 0.00 H new ATOM 0 HB2 GLU B 107 13.876 -0.297 -9.952 1.00 0.00 H new ATOM 0 HB3 GLU B 107 13.990 -1.837 -10.782 1.00 0.00 H new ATOM 0 HG2 GLU B 107 15.093 -2.878 -8.953 1.00 0.00 H new ATOM 0 HG3 GLU B 107 15.497 -1.345 -8.207 1.00 0.00 H new ATOM 687 N LEU B 108 15.317 -0.460 -13.127 1.00 0.00 N ATOM 688 CA LEU B 108 15.305 -0.840 -14.536 1.00 0.00 C ATOM 689 C LEU B 108 16.707 -1.203 -15.013 1.00 0.00 C ATOM 690 O LEU B 108 16.886 -2.134 -15.799 1.00 0.00 O ATOM 691 CB LEU B 108 14.743 0.299 -15.387 1.00 0.00 C ATOM 692 CG LEU B 108 13.655 -0.086 -16.391 1.00 0.00 C ATOM 693 CD1 LEU B 108 12.489 -0.758 -15.682 1.00 0.00 C ATOM 694 CD2 LEU B 108 13.181 1.138 -17.159 1.00 0.00 C ATOM 0 H LEU B 108 14.862 0.431 -12.927 1.00 0.00 H new ATOM 0 HA LEU B 108 14.666 -1.716 -14.646 1.00 0.00 H new ATOM 0 HB2 LEU B 108 14.340 1.060 -14.719 1.00 0.00 H new ATOM 0 HB3 LEU B 108 15.567 0.758 -15.933 1.00 0.00 H new ATOM 0 HG LEU B 108 14.078 -0.795 -17.103 1.00 0.00 H new ATOM 0 HD11 LEU B 108 11.725 -1.025 -16.412 1.00 0.00 H new ATOM 0 HD12 LEU B 108 12.840 -1.659 -15.178 1.00 0.00 H new ATOM 0 HD13 LEU B 108 12.066 -0.073 -14.948 1.00 0.00 H new ATOM 0 HD21 LEU B 108 12.407 0.845 -17.869 1.00 0.00 H new ATOM 0 HD22 LEU B 108 12.775 1.871 -16.461 1.00 0.00 H new ATOM 0 HD23 LEU B 108 14.020 1.577 -17.698 1.00 0.00 H new ATOM 706 N PHE B 109 17.701 -0.463 -14.531 1.00 0.00 N ATOM 707 CA PHE B 109 19.088 -0.708 -14.908 1.00 0.00 C ATOM 708 C PHE B 109 19.448 -2.181 -14.734 1.00 0.00 C ATOM 709 O PHE B 109 20.102 -2.777 -15.590 1.00 0.00 O ATOM 710 CB PHE B 109 20.028 0.160 -14.068 1.00 0.00 C ATOM 711 CG PHE B 109 20.042 1.603 -14.484 1.00 0.00 C ATOM 712 CD1 PHE B 109 20.294 1.956 -15.800 1.00 0.00 C ATOM 713 CD2 PHE B 109 19.805 2.607 -13.559 1.00 0.00 C ATOM 714 CE1 PHE B 109 20.308 3.283 -16.186 1.00 0.00 C ATOM 715 CE2 PHE B 109 19.817 3.936 -13.939 1.00 0.00 C ATOM 716 CZ PHE B 109 20.070 4.274 -15.254 1.00 0.00 C ATOM 0 H PHE B 109 17.571 0.311 -13.879 1.00 0.00 H new ATOM 0 HA PHE B 109 19.204 -0.446 -15.960 1.00 0.00 H new ATOM 0 HB2 PHE B 109 19.732 0.095 -13.021 1.00 0.00 H new ATOM 0 HB3 PHE B 109 21.039 -0.240 -14.139 1.00 0.00 H new ATOM 0 HD1 PHE B 109 20.482 1.185 -16.533 1.00 0.00 H new ATOM 0 HD2 PHE B 109 19.609 2.348 -12.529 1.00 0.00 H new ATOM 0 HE1 PHE B 109 20.505 3.545 -17.215 1.00 0.00 H new ATOM 0 HE2 PHE B 109 19.629 4.709 -13.209 1.00 0.00 H new ATOM 0 HZ PHE B 109 20.082 5.312 -15.553 1.00 0.00 H new ATOM 726 N PHE B 110 19.014 -2.762 -13.620 1.00 0.00 N ATOM 727 CA PHE B 110 19.291 -4.164 -13.333 1.00 0.00 C ATOM 728 C PHE B 110 18.406 -5.077 -14.176 1.00 0.00 C ATOM 729 O PHE B 110 18.774 -6.213 -14.475 1.00 0.00 O ATOM 730 CB PHE B 110 19.073 -4.454 -11.846 1.00 0.00 C ATOM 731 CG PHE B 110 19.121 -5.917 -11.507 1.00 0.00 C ATOM 732 CD1 PHE B 110 17.974 -6.691 -11.557 1.00 0.00 C ATOM 733 CD2 PHE B 110 20.315 -6.517 -11.139 1.00 0.00 C ATOM 734 CE1 PHE B 110 18.014 -8.037 -11.246 1.00 0.00 C ATOM 735 CE2 PHE B 110 20.362 -7.863 -10.828 1.00 0.00 C ATOM 736 CZ PHE B 110 19.210 -8.624 -10.880 1.00 0.00 C ATOM 0 H PHE B 110 18.470 -2.284 -12.902 1.00 0.00 H new ATOM 0 HA PHE B 110 20.332 -4.362 -13.586 1.00 0.00 H new ATOM 0 HB2 PHE B 110 19.833 -3.930 -11.267 1.00 0.00 H new ATOM 0 HB3 PHE B 110 18.107 -4.051 -11.543 1.00 0.00 H new ATOM 0 HD1 PHE B 110 17.036 -6.237 -11.843 1.00 0.00 H new ATOM 0 HD2 PHE B 110 21.218 -5.927 -11.095 1.00 0.00 H new ATOM 0 HE1 PHE B 110 17.112 -8.629 -11.289 1.00 0.00 H new ATOM 0 HE2 PHE B 110 21.299 -8.320 -10.544 1.00 0.00 H new ATOM 0 HZ PHE B 110 19.244 -9.675 -10.635 1.00 0.00 H new ATOM 746 N MET B 111 17.236 -4.572 -14.555 1.00 0.00 N ATOM 747 CA MET B 111 16.298 -5.342 -15.363 1.00 0.00 C ATOM 748 C MET B 111 16.831 -5.533 -16.780 1.00 0.00 C ATOM 749 O MET B 111 16.646 -6.589 -17.385 1.00 0.00 O ATOM 750 CB MET B 111 14.937 -4.643 -15.408 1.00 0.00 C ATOM 751 CG MET B 111 13.996 -5.075 -14.295 1.00 0.00 C ATOM 752 SD MET B 111 12.609 -3.944 -14.081 1.00 0.00 S ATOM 753 CE MET B 111 12.682 -3.649 -12.316 1.00 0.00 C ATOM 0 H MET B 111 16.916 -3.634 -14.316 1.00 0.00 H new ATOM 0 HA MET B 111 16.180 -6.323 -14.902 1.00 0.00 H new ATOM 0 HB2 MET B 111 15.089 -3.565 -15.347 1.00 0.00 H new ATOM 0 HB3 MET B 111 14.466 -4.844 -16.370 1.00 0.00 H new ATOM 0 HG2 MET B 111 13.616 -6.073 -14.513 1.00 0.00 H new ATOM 0 HG3 MET B 111 14.552 -5.143 -13.360 1.00 0.00 H new ATOM 0 HE1 MET B 111 12.339 -2.637 -12.102 1.00 0.00 H new ATOM 0 HE2 MET B 111 12.042 -4.365 -11.801 1.00 0.00 H new ATOM 0 HE3 MET B 111 13.709 -3.765 -11.970 1.00 0.00 H new ATOM 763 N ILE B 112 17.492 -4.505 -17.302 1.00 0.00 N ATOM 764 CA ILE B 112 18.052 -4.562 -18.647 1.00 0.00 C ATOM 765 C ILE B 112 19.424 -5.226 -18.643 1.00 0.00 C ATOM 766 O ILE B 112 19.722 -6.062 -19.495 1.00 0.00 O ATOM 767 CB ILE B 112 18.176 -3.156 -19.264 1.00 0.00 C ATOM 768 CG1 ILE B 112 16.790 -2.541 -19.467 1.00 0.00 C ATOM 769 CG2 ILE B 112 18.930 -3.222 -20.584 1.00 0.00 C ATOM 770 CD1 ILE B 112 16.513 -1.362 -18.561 1.00 0.00 C ATOM 0 H ILE B 112 17.653 -3.624 -16.815 1.00 0.00 H new ATOM 0 HA ILE B 112 17.366 -5.156 -19.251 1.00 0.00 H new ATOM 0 HB ILE B 112 18.738 -2.522 -18.578 1.00 0.00 H new ATOM 0 HG12 ILE B 112 16.691 -2.222 -20.505 1.00 0.00 H new ATOM 0 HG13 ILE B 112 16.033 -3.306 -19.295 1.00 0.00 H new ATOM 0 HG21 ILE B 112 19.010 -2.221 -21.008 1.00 0.00 H new ATOM 0 HG22 ILE B 112 19.929 -3.624 -20.413 1.00 0.00 H new ATOM 0 HG23 ILE B 112 18.393 -3.868 -21.278 1.00 0.00 H new ATOM 0 HD11 ILE B 112 15.513 -0.977 -18.760 1.00 0.00 H new ATOM 0 HD12 ILE B 112 16.579 -1.679 -17.520 1.00 0.00 H new ATOM 0 HD13 ILE B 112 17.247 -0.579 -18.749 1.00 0.00 H new ATOM 782 N ASN B 113 20.256 -4.849 -17.678 1.00 0.00 N ATOM 783 CA ASN B 113 21.597 -5.409 -17.562 1.00 0.00 C ATOM 784 C ASN B 113 21.540 -6.919 -17.354 1.00 0.00 C ATOM 785 O ASN B 113 22.218 -7.680 -18.046 1.00 0.00 O ATOM 786 CB ASN B 113 22.349 -4.751 -16.403 1.00 0.00 C ATOM 787 CG ASN B 113 23.851 -4.931 -16.512 1.00 0.00 C ATOM 788 OD1 ASN B 113 24.497 -5.428 -15.589 1.00 0.00 O ATOM 789 ND2 ASN B 113 24.415 -4.526 -17.645 1.00 0.00 N ATOM 0 H ASN B 113 20.025 -4.158 -16.965 1.00 0.00 H new ATOM 0 HA ASN B 113 22.129 -5.208 -18.492 1.00 0.00 H new ATOM 0 HB2 ASN B 113 22.114 -3.687 -16.379 1.00 0.00 H new ATOM 0 HB3 ASN B 113 22.002 -5.176 -15.461 1.00 0.00 H new ATOM 0 HD21 ASN B 113 25.422 -4.622 -17.776 1.00 0.00 H new ATOM 0 HD22 ASN B 113 23.841 -4.120 -18.384 1.00 0.00 H new ATOM 796 N THR B 114 20.726 -7.349 -16.394 1.00 0.00 N ATOM 797 CA THR B 114 20.579 -8.767 -16.094 1.00 0.00 C ATOM 798 C THR B 114 20.218 -9.560 -17.344 1.00 0.00 C ATOM 799 O THR B 114 20.552 -10.739 -17.461 1.00 0.00 O ATOM 800 CB THR B 114 19.502 -9.005 -15.019 1.00 0.00 C ATOM 801 OG1 THR B 114 19.608 -10.338 -14.506 1.00 0.00 O ATOM 802 CG2 THR B 114 18.109 -8.787 -15.592 1.00 0.00 C ATOM 0 H THR B 114 20.158 -6.734 -15.811 1.00 0.00 H new ATOM 0 HA THR B 114 21.542 -9.111 -15.716 1.00 0.00 H new ATOM 0 HB THR B 114 19.662 -8.291 -14.211 1.00 0.00 H new ATOM 0 HG1 THR B 114 18.921 -10.481 -13.822 1.00 0.00 H new ATOM 0 HG21 THR B 114 17.365 -8.961 -14.815 1.00 0.00 H new ATOM 0 HG22 THR B 114 18.021 -7.763 -15.956 1.00 0.00 H new ATOM 0 HG23 THR B 114 17.942 -9.481 -16.416 1.00 0.00 H new ATOM 810 N SER B 115 19.535 -8.905 -18.278 1.00 0.00 N ATOM 811 CA SER B 115 19.126 -9.550 -19.520 1.00 0.00 C ATOM 812 C SER B 115 20.331 -9.813 -20.418 1.00 0.00 C ATOM 813 O SER B 115 20.669 -10.963 -20.700 1.00 0.00 O ATOM 814 CB SER B 115 18.105 -8.682 -20.258 1.00 0.00 C ATOM 815 OG SER B 115 17.223 -9.478 -21.031 1.00 0.00 O ATOM 0 H SER B 115 19.253 -7.928 -18.198 1.00 0.00 H new ATOM 0 HA SER B 115 18.666 -10.506 -19.270 1.00 0.00 H new ATOM 0 HB2 SER B 115 17.534 -8.095 -19.538 1.00 0.00 H new ATOM 0 HB3 SER B 115 18.624 -7.975 -20.905 1.00 0.00 H new ATOM 0 HG SER B 115 16.579 -8.900 -21.491 1.00 0.00 H new ATOM 821 N ILE B 116 20.974 -8.740 -20.864 1.00 0.00 N ATOM 822 CA ILE B 116 22.141 -8.854 -21.729 1.00 0.00 C ATOM 823 C ILE B 116 23.187 -9.783 -21.122 1.00 0.00 C ATOM 824 O ILE B 116 23.963 -10.415 -21.840 1.00 0.00 O ATOM 825 CB ILE B 116 22.783 -7.479 -21.992 1.00 0.00 C ATOM 826 CG1 ILE B 116 21.769 -6.532 -22.637 1.00 0.00 C ATOM 827 CG2 ILE B 116 24.012 -7.629 -22.876 1.00 0.00 C ATOM 828 CD1 ILE B 116 22.157 -5.074 -22.542 1.00 0.00 C ATOM 0 H ILE B 116 20.706 -7.781 -20.641 1.00 0.00 H new ATOM 0 HA ILE B 116 21.793 -9.271 -22.674 1.00 0.00 H new ATOM 0 HB ILE B 116 23.094 -7.052 -21.039 1.00 0.00 H new ATOM 0 HG12 ILE B 116 21.651 -6.800 -23.687 1.00 0.00 H new ATOM 0 HG13 ILE B 116 20.799 -6.673 -22.161 1.00 0.00 H new ATOM 0 HG21 ILE B 116 24.455 -6.649 -23.053 1.00 0.00 H new ATOM 0 HG22 ILE B 116 24.740 -8.272 -22.381 1.00 0.00 H new ATOM 0 HG23 ILE B 116 23.723 -8.074 -23.828 1.00 0.00 H new ATOM 0 HD11 ILE B 116 21.392 -4.462 -23.020 1.00 0.00 H new ATOM 0 HD12 ILE B 116 22.247 -4.789 -21.494 1.00 0.00 H new ATOM 0 HD13 ILE B 116 23.112 -4.918 -23.044 1.00 0.00 H new ATOM 840 N LEU B 117 23.200 -9.863 -19.796 1.00 0.00 N ATOM 841 CA LEU B 117 24.150 -10.717 -19.091 1.00 0.00 C ATOM 842 C LEU B 117 23.657 -12.160 -19.049 1.00 0.00 C ATOM 843 O LEU B 117 24.363 -13.081 -19.461 1.00 0.00 O ATOM 844 CB LEU B 117 24.371 -10.201 -17.668 1.00 0.00 C ATOM 845 CG LEU B 117 25.820 -9.895 -17.283 1.00 0.00 C ATOM 846 CD1 LEU B 117 25.871 -9.093 -15.992 1.00 0.00 C ATOM 847 CD2 LEU B 117 26.617 -11.184 -17.145 1.00 0.00 C ATOM 0 H LEU B 117 22.564 -9.347 -19.188 1.00 0.00 H new ATOM 0 HA LEU B 117 25.096 -10.690 -19.632 1.00 0.00 H new ATOM 0 HB2 LEU B 117 23.782 -9.294 -17.536 1.00 0.00 H new ATOM 0 HB3 LEU B 117 23.979 -10.940 -16.970 1.00 0.00 H new ATOM 0 HG LEU B 117 26.269 -9.296 -18.076 1.00 0.00 H new ATOM 0 HD11 LEU B 117 26.909 -8.885 -15.734 1.00 0.00 H new ATOM 0 HD12 LEU B 117 25.335 -8.153 -16.126 1.00 0.00 H new ATOM 0 HD13 LEU B 117 25.405 -9.665 -15.190 1.00 0.00 H new ATOM 0 HD21 LEU B 117 27.645 -10.948 -16.871 1.00 0.00 H new ATOM 0 HD22 LEU B 117 26.169 -11.808 -16.371 1.00 0.00 H new ATOM 0 HD23 LEU B 117 26.608 -11.721 -18.094 1.00 0.00 H new ATOM 859 N LEU B 118 22.440 -12.350 -18.551 1.00 0.00 N ATOM 860 CA LEU B 118 21.851 -13.681 -18.457 1.00 0.00 C ATOM 861 C LEU B 118 21.940 -14.412 -19.793 1.00 0.00 C ATOM 862 O LEU B 118 22.321 -15.581 -19.848 1.00 0.00 O ATOM 863 CB LEU B 118 20.390 -13.584 -18.014 1.00 0.00 C ATOM 864 CG LEU B 118 20.151 -13.501 -16.506 1.00 0.00 C ATOM 865 CD1 LEU B 118 18.667 -13.622 -16.193 1.00 0.00 C ATOM 866 CD2 LEU B 118 20.940 -14.581 -15.781 1.00 0.00 C ATOM 0 H LEU B 118 21.842 -11.599 -18.206 1.00 0.00 H new ATOM 0 HA LEU B 118 22.413 -14.248 -17.715 1.00 0.00 H new ATOM 0 HB2 LEU B 118 19.947 -12.704 -18.481 1.00 0.00 H new ATOM 0 HB3 LEU B 118 19.856 -14.452 -18.399 1.00 0.00 H new ATOM 0 HG LEU B 118 20.497 -12.529 -16.156 1.00 0.00 H new ATOM 0 HD11 LEU B 118 18.516 -13.561 -15.115 1.00 0.00 H new ATOM 0 HD12 LEU B 118 18.125 -12.812 -16.682 1.00 0.00 H new ATOM 0 HD13 LEU B 118 18.295 -14.580 -16.557 1.00 0.00 H new ATOM 0 HD21 LEU B 118 20.758 -14.507 -14.709 1.00 0.00 H new ATOM 0 HD22 LEU B 118 20.624 -15.562 -16.136 1.00 0.00 H new ATOM 0 HD23 LEU B 118 22.004 -14.449 -15.978 1.00 0.00 H new ATOM 878 N ILE B 119 21.590 -13.713 -20.868 1.00 0.00 N ATOM 879 CA ILE B 119 21.634 -14.295 -22.204 1.00 0.00 C ATOM 880 C ILE B 119 22.993 -14.928 -22.483 1.00 0.00 C ATOM 881 O ILE B 119 23.101 -16.141 -22.660 1.00 0.00 O ATOM 882 CB ILE B 119 21.339 -13.240 -23.287 1.00 0.00 C ATOM 883 CG1 ILE B 119 19.960 -12.618 -23.062 1.00 0.00 C ATOM 884 CG2 ILE B 119 21.425 -13.865 -24.672 1.00 0.00 C ATOM 885 CD1 ILE B 119 19.888 -11.155 -23.439 1.00 0.00 C ATOM 0 H ILE B 119 21.273 -12.744 -20.840 1.00 0.00 H new ATOM 0 HA ILE B 119 20.863 -15.065 -22.239 1.00 0.00 H new ATOM 0 HB ILE B 119 22.088 -12.451 -23.218 1.00 0.00 H new ATOM 0 HG12 ILE B 119 19.222 -13.171 -23.643 1.00 0.00 H new ATOM 0 HG13 ILE B 119 19.688 -12.728 -22.012 1.00 0.00 H new ATOM 0 HG21 ILE B 119 21.214 -13.107 -25.427 1.00 0.00 H new ATOM 0 HG22 ILE B 119 22.427 -14.265 -24.829 1.00 0.00 H new ATOM 0 HG23 ILE B 119 20.696 -14.671 -24.753 1.00 0.00 H new ATOM 0 HD11 ILE B 119 18.881 -10.780 -23.253 1.00 0.00 H new ATOM 0 HD12 ILE B 119 20.602 -10.589 -22.840 1.00 0.00 H new ATOM 0 HD13 ILE B 119 20.129 -11.039 -24.496 1.00 0.00 H new ATOM 897 N PHE B 120 24.030 -14.097 -22.519 1.00 0.00 N ATOM 898 CA PHE B 120 25.384 -14.575 -22.776 1.00 0.00 C ATOM 899 C PHE B 120 25.821 -15.570 -21.705 1.00 0.00 C ATOM 900 O PHE B 120 26.602 -16.484 -21.974 1.00 0.00 O ATOM 901 CB PHE B 120 26.362 -13.400 -22.826 1.00 0.00 C ATOM 902 CG PHE B 120 27.396 -13.525 -23.908 1.00 0.00 C ATOM 903 CD1 PHE B 120 28.268 -14.602 -23.929 1.00 0.00 C ATOM 904 CD2 PHE B 120 27.496 -12.567 -24.904 1.00 0.00 C ATOM 905 CE1 PHE B 120 29.221 -14.719 -24.923 1.00 0.00 C ATOM 906 CE2 PHE B 120 28.446 -12.680 -25.901 1.00 0.00 C ATOM 907 CZ PHE B 120 29.309 -13.758 -25.911 1.00 0.00 C ATOM 0 H PHE B 120 23.959 -13.090 -22.374 1.00 0.00 H new ATOM 0 HA PHE B 120 25.387 -15.082 -23.741 1.00 0.00 H new ATOM 0 HB2 PHE B 120 25.801 -12.477 -22.976 1.00 0.00 H new ATOM 0 HB3 PHE B 120 26.865 -13.315 -21.863 1.00 0.00 H new ATOM 0 HD1 PHE B 120 28.202 -15.358 -23.160 1.00 0.00 H new ATOM 0 HD2 PHE B 120 26.823 -11.722 -24.901 1.00 0.00 H new ATOM 0 HE1 PHE B 120 29.897 -15.562 -24.927 1.00 0.00 H new ATOM 0 HE2 PHE B 120 28.514 -11.926 -26.671 1.00 0.00 H new ATOM 0 HZ PHE B 120 30.051 -13.849 -26.690 1.00 0.00 H new ATOM 917 N ILE B 121 25.313 -15.386 -20.492 1.00 0.00 N ATOM 918 CA ILE B 121 25.650 -16.267 -19.381 1.00 0.00 C ATOM 919 C ILE B 121 25.181 -17.693 -19.648 1.00 0.00 C ATOM 920 O ILE B 121 25.961 -18.642 -19.561 1.00 0.00 O ATOM 921 CB ILE B 121 25.029 -15.773 -18.061 1.00 0.00 C ATOM 922 CG1 ILE B 121 25.984 -14.811 -17.351 1.00 0.00 C ATOM 923 CG2 ILE B 121 24.690 -16.951 -17.161 1.00 0.00 C ATOM 924 CD1 ILE B 121 25.335 -14.036 -16.225 1.00 0.00 C ATOM 0 H ILE B 121 24.666 -14.634 -20.253 1.00 0.00 H new ATOM 0 HA ILE B 121 26.736 -16.255 -19.288 1.00 0.00 H new ATOM 0 HB ILE B 121 24.107 -15.238 -18.289 1.00 0.00 H new ATOM 0 HG12 ILE B 121 26.827 -15.376 -16.953 1.00 0.00 H new ATOM 0 HG13 ILE B 121 26.387 -14.108 -18.080 1.00 0.00 H new ATOM 0 HG21 ILE B 121 24.252 -16.585 -16.232 1.00 0.00 H new ATOM 0 HG22 ILE B 121 23.977 -17.602 -17.667 1.00 0.00 H new ATOM 0 HG23 ILE B 121 25.598 -17.512 -16.938 1.00 0.00 H new ATOM 0 HD11 ILE B 121 26.071 -13.374 -15.767 1.00 0.00 H new ATOM 0 HD12 ILE B 121 24.510 -13.443 -16.620 1.00 0.00 H new ATOM 0 HD13 ILE B 121 24.957 -14.731 -15.476 1.00 0.00 H new ATOM 936 N PHE B 122 23.901 -17.837 -19.975 1.00 0.00 N ATOM 937 CA PHE B 122 23.326 -19.148 -20.256 1.00 0.00 C ATOM 938 C PHE B 122 23.867 -19.708 -21.568 1.00 0.00 C ATOM 939 O PHE B 122 24.302 -20.859 -21.631 1.00 0.00 O ATOM 940 CB PHE B 122 21.800 -19.057 -20.318 1.00 0.00 C ATOM 941 CG PHE B 122 21.168 -18.690 -19.005 1.00 0.00 C ATOM 942 CD1 PHE B 122 21.284 -19.528 -17.908 1.00 0.00 C ATOM 943 CD2 PHE B 122 20.459 -17.508 -18.869 1.00 0.00 C ATOM 944 CE1 PHE B 122 20.703 -19.193 -16.699 1.00 0.00 C ATOM 945 CE2 PHE B 122 19.875 -17.167 -17.663 1.00 0.00 C ATOM 946 CZ PHE B 122 19.999 -18.011 -16.577 1.00 0.00 C ATOM 0 H PHE B 122 23.242 -17.062 -20.052 1.00 0.00 H new ATOM 0 HA PHE B 122 23.610 -19.823 -19.448 1.00 0.00 H new ATOM 0 HB2 PHE B 122 21.518 -18.317 -21.067 1.00 0.00 H new ATOM 0 HB3 PHE B 122 21.400 -20.015 -20.650 1.00 0.00 H new ATOM 0 HD1 PHE B 122 21.834 -20.453 -17.998 1.00 0.00 H new ATOM 0 HD2 PHE B 122 20.361 -16.844 -19.715 1.00 0.00 H new ATOM 0 HE1 PHE B 122 20.800 -19.855 -15.851 1.00 0.00 H new ATOM 0 HE2 PHE B 122 19.323 -16.243 -17.571 1.00 0.00 H new ATOM 0 HZ PHE B 122 19.546 -17.747 -15.633 1.00 0.00 H new ATOM 956 N ILE B 123 23.835 -18.888 -22.613 1.00 0.00 N ATOM 957 CA ILE B 123 24.322 -19.301 -23.923 1.00 0.00 C ATOM 958 C ILE B 123 25.701 -19.943 -23.820 1.00 0.00 C ATOM 959 O ILE B 123 26.005 -20.904 -24.526 1.00 0.00 O ATOM 960 CB ILE B 123 24.394 -18.111 -24.898 1.00 0.00 C ATOM 961 CG1 ILE B 123 23.087 -17.987 -25.684 1.00 0.00 C ATOM 962 CG2 ILE B 123 25.574 -18.272 -25.844 1.00 0.00 C ATOM 963 CD1 ILE B 123 21.933 -17.461 -24.858 1.00 0.00 C ATOM 0 H ILE B 123 23.477 -17.934 -22.578 1.00 0.00 H new ATOM 0 HA ILE B 123 23.611 -20.033 -24.307 1.00 0.00 H new ATOM 0 HB ILE B 123 24.537 -17.197 -24.322 1.00 0.00 H new ATOM 0 HG12 ILE B 123 23.246 -17.325 -26.535 1.00 0.00 H new ATOM 0 HG13 ILE B 123 22.820 -18.964 -26.086 1.00 0.00 H new ATOM 0 HG21 ILE B 123 25.611 -17.423 -26.527 1.00 0.00 H new ATOM 0 HG22 ILE B 123 26.499 -18.316 -25.268 1.00 0.00 H new ATOM 0 HG23 ILE B 123 25.459 -19.193 -26.416 1.00 0.00 H new ATOM 0 HD11 ILE B 123 21.039 -17.399 -25.479 1.00 0.00 H new ATOM 0 HD12 ILE B 123 21.748 -18.135 -24.021 1.00 0.00 H new ATOM 0 HD13 ILE B 123 22.180 -16.470 -24.478 1.00 0.00 H new ATOM 975 N VAL B 124 26.533 -19.406 -22.932 1.00 0.00 N ATOM 976 CA VAL B 124 27.880 -19.928 -22.734 1.00 0.00 C ATOM 977 C VAL B 124 27.867 -21.147 -21.819 1.00 0.00 C ATOM 978 O VAL B 124 28.704 -22.042 -21.946 1.00 0.00 O ATOM 979 CB VAL B 124 28.813 -18.859 -22.134 1.00 0.00 C ATOM 980 CG1 VAL B 124 30.127 -19.485 -21.691 1.00 0.00 C ATOM 981 CG2 VAL B 124 29.057 -17.742 -23.137 1.00 0.00 C ATOM 0 H VAL B 124 26.298 -18.610 -22.339 1.00 0.00 H new ATOM 0 HA VAL B 124 28.255 -20.218 -23.715 1.00 0.00 H new ATOM 0 HB VAL B 124 28.329 -18.430 -21.257 1.00 0.00 H new ATOM 0 HG11 VAL B 124 30.773 -18.715 -21.270 1.00 0.00 H new ATOM 0 HG12 VAL B 124 29.931 -20.247 -20.936 1.00 0.00 H new ATOM 0 HG13 VAL B 124 30.620 -19.943 -22.549 1.00 0.00 H new ATOM 0 HG21 VAL B 124 29.718 -16.996 -22.697 1.00 0.00 H new ATOM 0 HG22 VAL B 124 29.520 -18.153 -24.034 1.00 0.00 H new ATOM 0 HG23 VAL B 124 28.108 -17.276 -23.400 1.00 0.00 H new ATOM 991 N LEU B 125 26.912 -21.177 -20.896 1.00 0.00 N ATOM 992 CA LEU B 125 26.789 -22.288 -19.958 1.00 0.00 C ATOM 993 C LEU B 125 26.329 -23.555 -20.672 1.00 0.00 C ATOM 994 O LEU B 125 26.824 -24.649 -20.398 1.00 0.00 O ATOM 995 CB LEU B 125 25.805 -21.932 -18.842 1.00 0.00 C ATOM 996 CG LEU B 125 26.378 -21.131 -17.673 1.00 0.00 C ATOM 997 CD1 LEU B 125 25.329 -20.949 -16.586 1.00 0.00 C ATOM 998 CD2 LEU B 125 27.616 -21.815 -17.113 1.00 0.00 C ATOM 0 H LEU B 125 26.212 -20.445 -20.777 1.00 0.00 H new ATOM 0 HA LEU B 125 27.771 -22.474 -19.523 1.00 0.00 H new ATOM 0 HB2 LEU B 125 24.983 -21.364 -19.277 1.00 0.00 H new ATOM 0 HB3 LEU B 125 25.381 -22.857 -18.450 1.00 0.00 H new ATOM 0 HG LEU B 125 26.667 -20.146 -18.040 1.00 0.00 H new ATOM 0 HD11 LEU B 125 25.755 -20.377 -15.762 1.00 0.00 H new ATOM 0 HD12 LEU B 125 24.471 -20.415 -16.994 1.00 0.00 H new ATOM 0 HD13 LEU B 125 25.009 -21.925 -16.222 1.00 0.00 H new ATOM 0 HD21 LEU B 125 28.010 -21.230 -16.282 1.00 0.00 H new ATOM 0 HD22 LEU B 125 27.353 -22.813 -16.762 1.00 0.00 H new ATOM 0 HD23 LEU B 125 28.373 -21.892 -17.893 1.00 0.00 H new ATOM 1010 N LEU B 126 25.381 -23.400 -21.590 1.00 0.00 N ATOM 1011 CA LEU B 126 24.856 -24.531 -22.346 1.00 0.00 C ATOM 1012 C LEU B 126 25.987 -25.337 -22.978 1.00 0.00 C ATOM 1013 O LEU B 126 26.017 -26.564 -22.881 1.00 0.00 O ATOM 1014 CB LEU B 126 23.895 -24.043 -23.431 1.00 0.00 C ATOM 1015 CG LEU B 126 22.425 -23.926 -23.023 1.00 0.00 C ATOM 1016 CD1 LEU B 126 21.937 -25.229 -22.410 1.00 0.00 C ATOM 1017 CD2 LEU B 126 22.232 -22.772 -22.051 1.00 0.00 C ATOM 0 H LEU B 126 24.960 -22.502 -21.828 1.00 0.00 H new ATOM 0 HA LEU B 126 24.316 -25.178 -21.655 1.00 0.00 H new ATOM 0 HB2 LEU B 126 24.234 -23.066 -23.776 1.00 0.00 H new ATOM 0 HB3 LEU B 126 23.963 -24.723 -24.281 1.00 0.00 H new ATOM 0 HG LEU B 126 21.834 -23.725 -23.916 1.00 0.00 H new ATOM 0 HD11 LEU B 126 20.890 -25.128 -22.126 1.00 0.00 H new ATOM 0 HD12 LEU B 126 22.039 -26.034 -23.138 1.00 0.00 H new ATOM 0 HD13 LEU B 126 22.532 -25.461 -21.527 1.00 0.00 H new ATOM 0 HD21 LEU B 126 21.181 -22.704 -21.772 1.00 0.00 H new ATOM 0 HD22 LEU B 126 22.834 -22.943 -21.159 1.00 0.00 H new ATOM 0 HD23 LEU B 126 22.543 -21.841 -22.525 1.00 0.00 H new ATOM 1029 N ILE B 127 26.915 -24.638 -23.622 1.00 0.00 N ATOM 1030 CA ILE B 127 28.050 -25.288 -24.266 1.00 0.00 C ATOM 1031 C ILE B 127 28.982 -25.915 -23.235 1.00 0.00 C ATOM 1032 O ILE B 127 29.342 -27.088 -23.339 1.00 0.00 O ATOM 1033 CB ILE B 127 28.851 -24.296 -25.130 1.00 0.00 C ATOM 1034 CG1 ILE B 127 28.311 -24.281 -26.561 1.00 0.00 C ATOM 1035 CG2 ILE B 127 30.329 -24.658 -25.119 1.00 0.00 C ATOM 1036 CD1 ILE B 127 27.707 -22.954 -26.965 1.00 0.00 C ATOM 0 H ILE B 127 26.904 -23.622 -23.712 1.00 0.00 H new ATOM 0 HA ILE B 127 27.644 -26.070 -24.908 1.00 0.00 H new ATOM 0 HB ILE B 127 28.739 -23.297 -24.709 1.00 0.00 H new ATOM 0 HG12 ILE B 127 29.120 -24.527 -27.249 1.00 0.00 H new ATOM 0 HG13 ILE B 127 27.557 -25.061 -26.664 1.00 0.00 H new ATOM 0 HG21 ILE B 127 30.882 -23.948 -25.734 1.00 0.00 H new ATOM 0 HG22 ILE B 127 30.705 -24.622 -24.096 1.00 0.00 H new ATOM 0 HG23 ILE B 127 30.460 -25.664 -25.519 1.00 0.00 H new ATOM 0 HD11 ILE B 127 27.345 -23.016 -27.991 1.00 0.00 H new ATOM 0 HD12 ILE B 127 26.876 -22.715 -26.301 1.00 0.00 H new ATOM 0 HD13 ILE B 127 28.464 -22.173 -26.894 1.00 0.00 H new ATOM 1048 N HIS B 128 29.370 -25.126 -22.238 1.00 0.00 N ATOM 1049 CA HIS B 128 30.259 -25.604 -21.185 1.00 0.00 C ATOM 1050 C HIS B 128 29.757 -26.925 -20.609 1.00 0.00 C ATOM 1051 O HIS B 128 30.547 -27.771 -20.189 1.00 0.00 O ATOM 1052 CB HIS B 128 30.375 -24.561 -20.074 1.00 0.00 C ATOM 1053 CG HIS B 128 31.116 -25.051 -18.868 1.00 0.00 C ATOM 1054 ND1 HIS B 128 32.491 -25.012 -18.762 1.00 0.00 N ATOM 1055 CD2 HIS B 128 30.666 -25.591 -17.711 1.00 0.00 C ATOM 1056 CE1 HIS B 128 32.854 -25.509 -17.593 1.00 0.00 C ATOM 1057 NE2 HIS B 128 31.766 -25.867 -16.936 1.00 0.00 N ATOM 0 H HIS B 128 29.083 -24.153 -22.137 1.00 0.00 H new ATOM 0 HA HIS B 128 31.244 -25.769 -21.622 1.00 0.00 H new ATOM 0 HB2 HIS B 128 30.880 -23.678 -20.467 1.00 0.00 H new ATOM 0 HB3 HIS B 128 29.375 -24.249 -19.774 1.00 0.00 H new ATOM 0 HD2 HIS B 128 29.634 -25.771 -17.447 1.00 0.00 H new ATOM 0 HE1 HIS B 128 33.868 -25.606 -17.235 1.00 0.00 H new ATOM 0 HE2 HIS B 128 31.746 -26.281 -16.004 1.00 0.00 H new ATOM 1065 N PHE B 129 28.439 -27.095 -20.592 1.00 0.00 N ATOM 1066 CA PHE B 129 27.832 -28.311 -20.065 1.00 0.00 C ATOM 1067 C PHE B 129 27.503 -29.287 -21.192 1.00 0.00 C ATOM 1068 O PHE B 129 27.373 -30.489 -20.967 1.00 0.00 O ATOM 1069 CB PHE B 129 26.562 -27.975 -19.280 1.00 0.00 C ATOM 1070 CG PHE B 129 26.831 -27.505 -17.879 1.00 0.00 C ATOM 1071 CD1 PHE B 129 27.469 -28.330 -16.968 1.00 0.00 C ATOM 1072 CD2 PHE B 129 26.444 -26.237 -17.474 1.00 0.00 C ATOM 1073 CE1 PHE B 129 27.718 -27.900 -15.678 1.00 0.00 C ATOM 1074 CE2 PHE B 129 26.691 -25.802 -16.185 1.00 0.00 C ATOM 1075 CZ PHE B 129 27.327 -26.635 -15.286 1.00 0.00 C ATOM 0 H PHE B 129 27.771 -26.406 -20.937 1.00 0.00 H new ATOM 0 HA PHE B 129 28.550 -28.784 -19.395 1.00 0.00 H new ATOM 0 HB2 PHE B 129 26.008 -27.203 -19.814 1.00 0.00 H new ATOM 0 HB3 PHE B 129 25.923 -28.857 -19.243 1.00 0.00 H new ATOM 0 HD1 PHE B 129 27.776 -29.321 -17.269 1.00 0.00 H new ATOM 0 HD2 PHE B 129 25.944 -25.582 -18.173 1.00 0.00 H new ATOM 0 HE1 PHE B 129 28.218 -28.553 -14.978 1.00 0.00 H new ATOM 0 HE2 PHE B 129 26.387 -24.811 -15.881 1.00 0.00 H new ATOM 0 HZ PHE B 129 27.518 -26.298 -14.278 1.00 0.00 H new ATOM 1085 N GLU B 130 27.371 -28.758 -22.404 1.00 0.00 N ATOM 1086 CA GLU B 130 27.056 -29.581 -23.566 1.00 0.00 C ATOM 1087 C GLU B 130 28.264 -30.413 -23.987 1.00 0.00 C ATOM 1088 O GLU B 130 28.198 -31.183 -24.943 1.00 0.00 O ATOM 1089 CB GLU B 130 26.596 -28.704 -24.731 1.00 0.00 C ATOM 1090 CG GLU B 130 25.086 -28.650 -24.894 1.00 0.00 C ATOM 1091 CD GLU B 130 24.550 -29.786 -25.743 1.00 0.00 C ATOM 1092 OE1 GLU B 130 24.632 -29.689 -26.985 1.00 0.00 O ATOM 1093 OE2 GLU B 130 24.048 -30.773 -25.165 1.00 0.00 O ATOM 0 H GLU B 130 27.477 -27.764 -22.607 1.00 0.00 H new ATOM 0 HA GLU B 130 26.248 -30.259 -23.290 1.00 0.00 H new ATOM 0 HB2 GLU B 130 26.973 -27.692 -24.584 1.00 0.00 H new ATOM 0 HB3 GLU B 130 27.039 -29.079 -25.654 1.00 0.00 H new ATOM 0 HG2 GLU B 130 24.617 -28.684 -23.911 1.00 0.00 H new ATOM 0 HG3 GLU B 130 24.807 -27.699 -25.348 1.00 0.00 H new ATOM 1100 N GLY B 131 29.369 -30.249 -23.265 1.00 0.00 N ATOM 1101 CA GLY B 131 30.577 -30.990 -23.578 1.00 0.00 C ATOM 1102 C GLY B 131 31.777 -30.085 -23.772 1.00 0.00 C ATOM 1103 O GLY B 131 32.502 -30.207 -24.760 1.00 0.00 O ATOM 0 H GLY B 131 29.449 -29.616 -22.469 1.00 0.00 H new ATOM 0 HA2 GLY B 131 30.785 -31.697 -22.775 1.00 0.00 H new ATOM 0 HA3 GLY B 131 30.417 -31.575 -24.484 1.00 0.00 H new ATOM 1107 N TRP B 132 31.988 -29.175 -22.829 1.00 0.00 N ATOM 1108 CA TRP B 132 33.109 -28.244 -22.901 1.00 0.00 C ATOM 1109 C TRP B 132 33.797 -28.114 -21.547 1.00 0.00 C ATOM 1110 O TRP B 132 34.479 -27.124 -21.280 1.00 0.00 O ATOM 1111 CB TRP B 132 32.630 -26.872 -23.378 1.00 0.00 C ATOM 1112 CG TRP B 132 33.176 -26.485 -24.719 1.00 0.00 C ATOM 1113 CD1 TRP B 132 34.168 -25.580 -24.969 1.00 0.00 C ATOM 1114 CD2 TRP B 132 32.759 -26.989 -25.992 1.00 0.00 C ATOM 1115 NE1 TRP B 132 34.393 -25.492 -26.322 1.00 0.00 N ATOM 1116 CE2 TRP B 132 33.542 -26.346 -26.971 1.00 0.00 C ATOM 1117 CE3 TRP B 132 31.801 -27.921 -26.401 1.00 0.00 C ATOM 1118 CZ2 TRP B 132 33.394 -26.607 -28.331 1.00 0.00 C ATOM 1119 CZ3 TRP B 132 31.656 -28.179 -27.750 1.00 0.00 C ATOM 1120 CH2 TRP B 132 32.449 -27.525 -28.702 1.00 0.00 C ATOM 0 H TRP B 132 31.398 -29.061 -22.005 1.00 0.00 H new ATOM 0 HA TRP B 132 33.830 -28.638 -23.617 1.00 0.00 H new ATOM 0 HB2 TRP B 132 31.541 -26.871 -23.423 1.00 0.00 H new ATOM 0 HB3 TRP B 132 32.919 -26.119 -22.645 1.00 0.00 H new ATOM 0 HD1 TRP B 132 34.697 -25.017 -24.215 1.00 0.00 H new ATOM 0 HE1 TRP B 132 35.082 -24.888 -26.770 1.00 0.00 H new ATOM 0 HE3 TRP B 132 31.185 -28.430 -25.675 1.00 0.00 H new ATOM 0 HZ2 TRP B 132 34.003 -26.103 -29.067 1.00 0.00 H new ATOM 0 HZ3 TRP B 132 30.919 -28.897 -28.077 1.00 0.00 H new ATOM 0 HH2 TRP B 132 32.312 -27.750 -29.749 1.00 0.00 H new ATOM 1131 N ARG B 133 33.614 -29.118 -20.696 1.00 0.00 N ATOM 1132 CA ARG B 133 34.217 -29.114 -19.369 1.00 0.00 C ATOM 1133 C ARG B 133 35.263 -30.219 -19.243 1.00 0.00 C ATOM 1134 O ARG B 133 35.355 -30.885 -18.212 1.00 0.00 O ATOM 1135 CB ARG B 133 33.141 -29.292 -18.296 1.00 0.00 C ATOM 1136 CG ARG B 133 33.498 -28.651 -16.964 1.00 0.00 C ATOM 1137 CD ARG B 133 34.008 -29.681 -15.969 1.00 0.00 C ATOM 1138 NE ARG B 133 33.699 -29.310 -14.591 1.00 0.00 N ATOM 1139 CZ ARG B 133 32.515 -29.511 -14.023 1.00 0.00 C ATOM 1140 NH1 ARG B 133 31.534 -30.077 -14.711 1.00 0.00 N ATOM 1141 NH2 ARG B 133 32.311 -29.146 -12.764 1.00 0.00 N ATOM 0 H ARG B 133 33.053 -29.945 -20.902 1.00 0.00 H new ATOM 0 HA ARG B 133 34.710 -28.152 -19.225 1.00 0.00 H new ATOM 0 HB2 ARG B 133 32.206 -28.864 -18.657 1.00 0.00 H new ATOM 0 HB3 ARG B 133 32.966 -30.357 -18.142 1.00 0.00 H new ATOM 0 HG2 ARG B 133 34.259 -27.886 -17.119 1.00 0.00 H new ATOM 0 HG3 ARG B 133 32.621 -28.150 -16.554 1.00 0.00 H new ATOM 0 HD2 ARG B 133 33.564 -30.651 -16.192 1.00 0.00 H new ATOM 0 HD3 ARG B 133 35.087 -29.791 -16.082 1.00 0.00 H new ATOM 0 HE ARG B 133 34.433 -28.872 -14.034 1.00 0.00 H new ATOM 0 HH11 ARG B 133 31.687 -30.360 -15.679 1.00 0.00 H new ATOM 0 HH12 ARG B 133 30.626 -30.230 -14.272 1.00 0.00 H new ATOM 0 HH21 ARG B 133 33.064 -28.710 -12.231 1.00 0.00 H new ATOM 0 HH22 ARG B 133 31.401 -29.301 -12.329 1.00 0.00 H new ATOM 1155 N ILE B 134 36.046 -30.408 -20.299 1.00 0.00 N ATOM 1156 CA ILE B 134 37.085 -31.431 -20.307 1.00 0.00 C ATOM 1157 C ILE B 134 38.073 -31.219 -19.165 1.00 0.00 C ATOM 1158 O ILE B 134 37.856 -31.686 -18.047 1.00 0.00 O ATOM 1159 CB ILE B 134 37.854 -31.443 -21.641 1.00 0.00 C ATOM 1160 CG1 ILE B 134 36.888 -31.651 -22.809 1.00 0.00 C ATOM 1161 CG2 ILE B 134 38.920 -32.528 -21.628 1.00 0.00 C ATOM 1162 CD1 ILE B 134 37.491 -31.324 -24.157 1.00 0.00 C ATOM 0 H ILE B 134 35.981 -29.866 -21.161 1.00 0.00 H new ATOM 0 HA ILE B 134 36.584 -32.390 -20.178 1.00 0.00 H new ATOM 0 HB ILE B 134 38.347 -30.479 -21.769 1.00 0.00 H new ATOM 0 HG12 ILE B 134 36.552 -32.688 -22.812 1.00 0.00 H new ATOM 0 HG13 ILE B 134 36.005 -31.031 -22.655 1.00 0.00 H new ATOM 0 HG21 ILE B 134 39.455 -32.524 -22.578 1.00 0.00 H new ATOM 0 HG22 ILE B 134 39.622 -32.339 -20.816 1.00 0.00 H new ATOM 0 HG23 ILE B 134 38.448 -33.500 -21.481 1.00 0.00 H new ATOM 0 HD11 ILE B 134 36.750 -31.494 -24.938 1.00 0.00 H new ATOM 0 HD12 ILE B 134 37.801 -30.279 -24.173 1.00 0.00 H new ATOM 0 HD13 ILE B 134 38.357 -31.962 -24.333 1.00 0.00 H new TER 1174 ILE B 134