USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=10 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+ -169:sc= -1.04 (180deg=-1.11) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 148:sc= -1.3 (180deg=-3.25) USER MOD Single : A 13 ASN : amide:sc= -0.283 X(o=-0.28,f=-0.067) 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= -1.71 K(o=-1.7,f=-3.3) 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 154:sc= -0.598 (180deg=-1.82) USER MOD Single : B 113 ASN : amide:sc= -0.243 X(o=-0.24,f=-0.041) 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 HE2:sc= -0.955 K(o=-0.96,f=-2.9) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.402 -1.352 3.639 1.00 0.00 N ATOM 2 CA MET A 1 6.077 -0.145 3.178 1.00 0.00 C ATOM 3 C MET A 1 7.515 -0.449 2.768 1.00 0.00 C ATOM 4 O MET A 1 8.388 0.415 2.842 1.00 0.00 O ATOM 5 CB MET A 1 6.063 0.923 4.273 1.00 0.00 C ATOM 6 CG MET A 1 4.664 1.357 4.680 1.00 0.00 C ATOM 7 SD MET A 1 4.632 2.180 6.284 1.00 0.00 S ATOM 8 CE MET A 1 3.032 1.659 6.900 1.00 0.00 C ATOM 0 H1 MET A 1 4.383 -1.165 3.735 1.00 0.00 H new ATOM 0 H2 MET A 1 5.550 -2.117 2.951 1.00 0.00 H new ATOM 0 H3 MET A 1 5.790 -1.636 4.561 1.00 0.00 H new ATOM 0 HA MET A 1 5.540 0.231 2.307 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.585 0.540 5.150 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.619 1.794 3.927 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.262 2.030 3.923 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.011 0.484 4.710 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.865 2.088 7.888 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.252 2.000 6.220 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.005 0.571 6.968 1.00 0.00 H new ATOM 18 N ASP A 2 7.753 -1.683 2.335 1.00 0.00 N ATOM 19 CA ASP A 2 9.084 -2.101 1.912 1.00 0.00 C ATOM 20 C ASP A 2 9.006 -3.312 0.988 1.00 0.00 C ATOM 21 O ASP A 2 8.550 -4.383 1.390 1.00 0.00 O ATOM 22 CB ASP A 2 9.951 -2.427 3.129 1.00 0.00 C ATOM 23 CG ASP A 2 10.475 -1.182 3.817 1.00 0.00 C ATOM 24 OD1 ASP A 2 11.034 -0.310 3.119 1.00 0.00 O ATOM 25 OD2 ASP A 2 10.328 -1.080 5.053 1.00 0.00 O ATOM 0 H ASP A 2 7.041 -2.411 2.268 1.00 0.00 H new ATOM 0 HA ASP A 2 9.539 -1.277 1.363 1.00 0.00 H new ATOM 0 HB2 ASP A 2 9.369 -3.013 3.840 1.00 0.00 H new ATOM 0 HB3 ASP A 2 10.791 -3.047 2.817 1.00 0.00 H new ATOM 30 N SER A 3 9.452 -3.135 -0.251 1.00 0.00 N ATOM 31 CA SER A 3 9.427 -4.212 -1.234 1.00 0.00 C ATOM 32 C SER A 3 10.806 -4.849 -1.376 1.00 0.00 C ATOM 33 O SER A 3 11.216 -5.232 -2.471 1.00 0.00 O ATOM 34 CB SER A 3 8.955 -3.684 -2.590 1.00 0.00 C ATOM 35 OG SER A 3 8.100 -2.565 -2.431 1.00 0.00 O ATOM 0 H SER A 3 9.835 -2.256 -0.598 1.00 0.00 H new ATOM 0 HA SER A 3 8.728 -4.972 -0.885 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.817 -3.404 -3.195 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.430 -4.473 -3.129 1.00 0.00 H new ATOM 0 HG SER A 3 7.813 -2.245 -3.312 1.00 0.00 H new ATOM 41 N ALA A 4 11.518 -4.960 -0.259 1.00 0.00 N ATOM 42 CA ALA A 4 12.850 -5.552 -0.257 1.00 0.00 C ATOM 43 C ALA A 4 12.784 -7.053 -0.517 1.00 0.00 C ATOM 44 O ALA A 4 13.341 -7.565 -1.488 1.00 0.00 O ATOM 45 CB ALA A 4 13.549 -5.274 1.065 1.00 0.00 C ATOM 0 H ALA A 4 11.194 -4.647 0.656 1.00 0.00 H new ATOM 0 HA ALA A 4 13.425 -5.095 -1.063 1.00 0.00 H new ATOM 0 HB1 ALA A 4 14.543 -5.722 1.052 1.00 0.00 H new ATOM 0 HB2 ALA A 4 13.638 -4.197 1.210 1.00 0.00 H new ATOM 0 HB3 ALA A 4 12.968 -5.703 1.881 1.00 0.00 H new ATOM 51 N PRO A 5 12.087 -7.778 0.371 1.00 0.00 N ATOM 52 CA PRO A 5 11.932 -9.231 0.259 1.00 0.00 C ATOM 53 C PRO A 5 11.041 -9.630 -0.914 1.00 0.00 C ATOM 54 O PRO A 5 11.167 -10.729 -1.455 1.00 0.00 O ATOM 55 CB PRO A 5 11.275 -9.622 1.585 1.00 0.00 C ATOM 56 CG PRO A 5 10.564 -8.391 2.033 1.00 0.00 C ATOM 57 CD PRO A 5 11.396 -7.234 1.552 1.00 0.00 C ATOM 0 HA PRO A 5 12.884 -9.729 0.076 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.583 -10.454 1.454 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.018 -9.939 2.317 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.558 -8.348 1.616 1.00 0.00 H new ATOM 0 HG3 PRO A 5 10.461 -8.373 3.118 1.00 0.00 H new ATOM 0 HD2 PRO A 5 10.778 -6.374 1.295 1.00 0.00 H new ATOM 0 HD3 PRO A 5 12.102 -6.903 2.314 1.00 0.00 H new ATOM 65 N PHE A 6 10.143 -8.731 -1.301 1.00 0.00 N ATOM 66 CA PHE A 6 9.231 -8.990 -2.409 1.00 0.00 C ATOM 67 C PHE A 6 9.960 -8.895 -3.747 1.00 0.00 C ATOM 68 O PHE A 6 9.685 -9.660 -4.670 1.00 0.00 O ATOM 69 CB PHE A 6 8.065 -8.000 -2.380 1.00 0.00 C ATOM 70 CG PHE A 6 6.719 -8.662 -2.299 1.00 0.00 C ATOM 71 CD1 PHE A 6 6.420 -9.530 -1.261 1.00 0.00 C ATOM 72 CD2 PHE A 6 5.753 -8.418 -3.262 1.00 0.00 C ATOM 73 CE1 PHE A 6 5.182 -10.140 -1.183 1.00 0.00 C ATOM 74 CE2 PHE A 6 4.514 -9.025 -3.189 1.00 0.00 C ATOM 75 CZ PHE A 6 4.228 -9.888 -2.150 1.00 0.00 C ATOM 0 H PHE A 6 10.027 -7.817 -0.864 1.00 0.00 H new ATOM 0 HA PHE A 6 8.842 -10.002 -2.298 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.185 -7.334 -1.526 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.103 -7.380 -3.276 1.00 0.00 H new ATOM 0 HD1 PHE A 6 7.163 -9.732 -0.504 1.00 0.00 H new ATOM 0 HD2 PHE A 6 5.971 -7.746 -4.079 1.00 0.00 H new ATOM 0 HE1 PHE A 6 4.961 -10.813 -0.367 1.00 0.00 H new ATOM 0 HE2 PHE A 6 3.769 -8.824 -3.945 1.00 0.00 H new ATOM 0 HZ PHE A 6 3.261 -10.365 -2.093 1.00 0.00 H new ATOM 85 N GLU A 7 10.889 -7.949 -3.842 1.00 0.00 N ATOM 86 CA GLU A 7 11.656 -7.752 -5.066 1.00 0.00 C ATOM 87 C GLU A 7 12.364 -9.040 -5.477 1.00 0.00 C ATOM 88 O GLU A 7 12.410 -9.388 -6.657 1.00 0.00 O ATOM 89 CB GLU A 7 12.680 -6.631 -4.878 1.00 0.00 C ATOM 90 CG GLU A 7 12.434 -5.427 -5.771 1.00 0.00 C ATOM 91 CD GLU A 7 12.743 -5.708 -7.229 1.00 0.00 C ATOM 92 OE1 GLU A 7 13.926 -5.949 -7.548 1.00 0.00 O ATOM 93 OE2 GLU A 7 11.803 -5.686 -8.050 1.00 0.00 O ATOM 0 H GLU A 7 11.128 -7.307 -3.086 1.00 0.00 H new ATOM 0 HA GLU A 7 10.962 -7.470 -5.858 1.00 0.00 H new ATOM 0 HB2 GLU A 7 12.667 -6.309 -3.837 1.00 0.00 H new ATOM 0 HB3 GLU A 7 13.677 -7.024 -5.078 1.00 0.00 H new ATOM 0 HG2 GLU A 7 11.393 -5.117 -5.677 1.00 0.00 H new ATOM 0 HG3 GLU A 7 13.047 -4.594 -5.428 1.00 0.00 H new ATOM 100 N LEU A 8 12.917 -9.743 -4.494 1.00 0.00 N ATOM 101 CA LEU A 8 13.625 -10.993 -4.752 1.00 0.00 C ATOM 102 C LEU A 8 12.736 -11.976 -5.507 1.00 0.00 C ATOM 103 O LEU A 8 13.205 -12.715 -6.373 1.00 0.00 O ATOM 104 CB LEU A 8 14.093 -11.617 -3.436 1.00 0.00 C ATOM 105 CG LEU A 8 15.489 -12.242 -3.449 1.00 0.00 C ATOM 106 CD1 LEU A 8 16.549 -11.174 -3.668 1.00 0.00 C ATOM 107 CD2 LEU A 8 15.747 -12.996 -2.153 1.00 0.00 C ATOM 0 H LEU A 8 12.889 -9.469 -3.512 1.00 0.00 H new ATOM 0 HA LEU A 8 14.494 -10.769 -5.370 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.068 -10.849 -2.663 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.376 -12.385 -3.146 1.00 0.00 H new ATOM 0 HG LEU A 8 15.542 -12.951 -4.275 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.536 -11.637 -3.674 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.374 -10.679 -4.623 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.498 -10.440 -2.864 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.745 -13.434 -2.179 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.675 -12.307 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.006 -13.787 -2.039 1.00 0.00 H new ATOM 119 N PHE A 9 11.449 -11.979 -5.174 1.00 0.00 N ATOM 120 CA PHE A 9 10.494 -12.870 -5.821 1.00 0.00 C ATOM 121 C PHE A 9 10.595 -12.765 -7.340 1.00 0.00 C ATOM 122 O PHE A 9 10.594 -13.775 -8.045 1.00 0.00 O ATOM 123 CB PHE A 9 9.070 -12.541 -5.369 1.00 0.00 C ATOM 124 CG PHE A 9 8.123 -13.702 -5.475 1.00 0.00 C ATOM 125 CD1 PHE A 9 8.380 -14.886 -4.802 1.00 0.00 C ATOM 126 CD2 PHE A 9 6.977 -13.610 -6.248 1.00 0.00 C ATOM 127 CE1 PHE A 9 7.511 -15.956 -4.898 1.00 0.00 C ATOM 128 CE2 PHE A 9 6.104 -14.678 -6.347 1.00 0.00 C ATOM 129 CZ PHE A 9 6.372 -15.852 -5.672 1.00 0.00 C ATOM 0 H PHE A 9 11.044 -11.374 -4.460 1.00 0.00 H new ATOM 0 HA PHE A 9 10.733 -13.892 -5.529 1.00 0.00 H new ATOM 0 HB2 PHE A 9 9.096 -12.197 -4.335 1.00 0.00 H new ATOM 0 HB3 PHE A 9 8.688 -11.715 -5.970 1.00 0.00 H new ATOM 0 HD1 PHE A 9 9.269 -14.973 -4.196 1.00 0.00 H new ATOM 0 HD2 PHE A 9 6.763 -12.694 -6.779 1.00 0.00 H new ATOM 0 HE1 PHE A 9 7.722 -16.873 -4.368 1.00 0.00 H new ATOM 0 HE2 PHE A 9 5.213 -14.594 -6.952 1.00 0.00 H new ATOM 0 HZ PHE A 9 5.692 -16.688 -5.749 1.00 0.00 H new ATOM 139 N PHE A 10 10.680 -11.536 -7.838 1.00 0.00 N ATOM 140 CA PHE A 10 10.780 -11.298 -9.273 1.00 0.00 C ATOM 141 C PHE A 10 12.173 -11.650 -9.787 1.00 0.00 C ATOM 142 O PHE A 10 12.346 -11.992 -10.957 1.00 0.00 O ATOM 143 CB PHE A 10 10.461 -9.836 -9.592 1.00 0.00 C ATOM 144 CG PHE A 10 10.759 -9.454 -11.014 1.00 0.00 C ATOM 145 CD1 PHE A 10 9.807 -9.628 -12.006 1.00 0.00 C ATOM 146 CD2 PHE A 10 11.990 -8.920 -11.358 1.00 0.00 C ATOM 147 CE1 PHE A 10 10.079 -9.278 -13.315 1.00 0.00 C ATOM 148 CE2 PHE A 10 12.268 -8.567 -12.665 1.00 0.00 C ATOM 149 CZ PHE A 10 11.311 -8.746 -13.645 1.00 0.00 C ATOM 0 H PHE A 10 10.682 -10.689 -7.269 1.00 0.00 H new ATOM 0 HA PHE A 10 10.054 -11.939 -9.774 1.00 0.00 H new ATOM 0 HB2 PHE A 10 9.407 -9.649 -9.387 1.00 0.00 H new ATOM 0 HB3 PHE A 10 11.034 -9.193 -8.924 1.00 0.00 H new ATOM 0 HD1 PHE A 10 8.842 -10.042 -11.753 1.00 0.00 H new ATOM 0 HD2 PHE A 10 12.742 -8.778 -10.596 1.00 0.00 H new ATOM 0 HE1 PHE A 10 9.329 -9.420 -14.079 1.00 0.00 H new ATOM 0 HE2 PHE A 10 13.232 -8.152 -12.920 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.525 -8.471 -14.667 1.00 0.00 H new ATOM 159 N MET A 11 13.163 -11.563 -8.904 1.00 0.00 N ATOM 160 CA MET A 11 14.540 -11.872 -9.268 1.00 0.00 C ATOM 161 C MET A 11 14.712 -13.366 -9.526 1.00 0.00 C ATOM 162 O MET A 11 15.518 -13.772 -10.364 1.00 0.00 O ATOM 163 CB MET A 11 15.496 -11.421 -8.163 1.00 0.00 C ATOM 164 CG MET A 11 16.000 -9.998 -8.339 1.00 0.00 C ATOM 165 SD MET A 11 16.788 -9.351 -6.852 1.00 0.00 S ATOM 166 CE MET A 11 15.688 -7.996 -6.448 1.00 0.00 C ATOM 0 H MET A 11 13.037 -11.281 -7.932 1.00 0.00 H new ATOM 0 HA MET A 11 14.776 -11.333 -10.185 1.00 0.00 H new ATOM 0 HB2 MET A 11 14.990 -11.502 -7.201 1.00 0.00 H new ATOM 0 HB3 MET A 11 16.349 -12.099 -8.133 1.00 0.00 H new ATOM 0 HG2 MET A 11 16.711 -9.968 -9.165 1.00 0.00 H new ATOM 0 HG3 MET A 11 15.166 -9.353 -8.613 1.00 0.00 H new ATOM 0 HE1 MET A 11 15.654 -7.865 -5.366 1.00 0.00 H new ATOM 0 HE2 MET A 11 16.052 -7.080 -6.914 1.00 0.00 H new ATOM 0 HE3 MET A 11 14.687 -8.217 -6.818 1.00 0.00 H new ATOM 176 N ILE A 12 13.949 -14.178 -8.802 1.00 0.00 N ATOM 177 CA ILE A 12 14.017 -15.626 -8.954 1.00 0.00 C ATOM 178 C ILE A 12 13.135 -16.101 -10.104 1.00 0.00 C ATOM 179 O ILE A 12 13.569 -16.881 -10.951 1.00 0.00 O ATOM 180 CB ILE A 12 13.590 -16.349 -7.663 1.00 0.00 C ATOM 181 CG1 ILE A 12 14.577 -16.048 -6.533 1.00 0.00 C ATOM 182 CG2 ILE A 12 13.491 -17.848 -7.902 1.00 0.00 C ATOM 183 CD1 ILE A 12 13.954 -15.317 -5.364 1.00 0.00 C ATOM 0 H ILE A 12 13.277 -13.858 -8.105 1.00 0.00 H new ATOM 0 HA ILE A 12 15.057 -15.871 -9.171 1.00 0.00 H new ATOM 0 HB ILE A 12 12.607 -15.983 -7.368 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.007 -16.985 -6.178 1.00 0.00 H new ATOM 0 HG13 ILE A 12 15.398 -15.450 -6.929 1.00 0.00 H new ATOM 0 HG21 ILE A 12 13.188 -18.344 -6.980 1.00 0.00 H new ATOM 0 HG22 ILE A 12 12.752 -18.045 -8.679 1.00 0.00 H new ATOM 0 HG23 ILE A 12 14.461 -18.231 -8.218 1.00 0.00 H new ATOM 0 HD11 ILE A 12 14.712 -15.137 -4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 12 13.549 -14.364 -5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 12 13.151 -15.922 -4.942 1.00 0.00 H new ATOM 195 N ASN A 13 11.896 -15.622 -10.128 1.00 0.00 N ATOM 196 CA ASN A 13 10.952 -15.996 -11.175 1.00 0.00 C ATOM 197 C ASN A 13 11.563 -15.786 -12.558 1.00 0.00 C ATOM 198 O ASN A 13 11.631 -16.713 -13.366 1.00 0.00 O ATOM 199 CB ASN A 13 9.664 -15.180 -11.046 1.00 0.00 C ATOM 200 CG ASN A 13 8.721 -15.751 -10.005 1.00 0.00 C ATOM 201 OD1 ASN A 13 8.293 -15.049 -9.088 1.00 0.00 O ATOM 202 ND2 ASN A 13 8.392 -17.030 -10.142 1.00 0.00 N ATOM 0 H ASN A 13 11.522 -14.974 -9.435 1.00 0.00 H new ATOM 0 HA ASN A 13 10.717 -17.054 -11.057 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.913 -14.152 -10.782 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.159 -15.148 -12.011 1.00 0.00 H new ATOM 0 HD21 ASN A 13 7.761 -17.469 -9.472 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.771 -17.574 -10.917 1.00 0.00 H new ATOM 209 N THR A 14 12.007 -14.562 -12.823 1.00 0.00 N ATOM 210 CA THR A 14 12.612 -14.230 -14.107 1.00 0.00 C ATOM 211 C THR A 14 13.790 -15.147 -14.414 1.00 0.00 C ATOM 212 O THR A 14 14.124 -15.377 -15.576 1.00 0.00 O ATOM 213 CB THR A 14 13.093 -12.767 -14.140 1.00 0.00 C ATOM 214 OG1 THR A 14 13.427 -12.391 -15.481 1.00 0.00 O ATOM 215 CG2 THR A 14 14.303 -12.575 -13.238 1.00 0.00 C ATOM 0 H THR A 14 11.959 -13.784 -12.165 1.00 0.00 H new ATOM 0 HA THR A 14 11.841 -14.369 -14.864 1.00 0.00 H new ATOM 0 HB THR A 14 12.284 -12.133 -13.776 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.730 -11.459 -15.494 1.00 0.00 H new ATOM 0 HG21 THR A 14 14.625 -11.534 -13.278 1.00 0.00 H new ATOM 0 HG22 THR A 14 14.038 -12.834 -12.213 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.115 -13.219 -13.576 1.00 0.00 H new ATOM 223 N SER A 15 14.416 -15.669 -13.364 1.00 0.00 N ATOM 224 CA SER A 15 15.560 -16.560 -13.522 1.00 0.00 C ATOM 225 C SER A 15 15.123 -17.911 -14.080 1.00 0.00 C ATOM 226 O SER A 15 15.516 -18.296 -15.182 1.00 0.00 O ATOM 227 CB SER A 15 16.270 -16.755 -12.181 1.00 0.00 C ATOM 228 OG SER A 15 17.656 -16.984 -12.367 1.00 0.00 O ATOM 0 H SER A 15 14.151 -15.491 -12.395 1.00 0.00 H new ATOM 0 HA SER A 15 16.252 -16.101 -14.228 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.124 -15.873 -11.557 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.827 -17.598 -11.650 1.00 0.00 H new ATOM 0 HG SER A 15 18.088 -17.104 -11.495 1.00 0.00 H new ATOM 234 N ILE A 16 14.309 -18.626 -13.311 1.00 0.00 N ATOM 235 CA ILE A 16 13.817 -19.934 -13.729 1.00 0.00 C ATOM 236 C ILE A 16 13.205 -19.871 -15.124 1.00 0.00 C ATOM 237 O ILE A 16 13.204 -20.860 -15.858 1.00 0.00 O ATOM 238 CB ILE A 16 12.768 -20.481 -12.744 1.00 0.00 C ATOM 239 CG1 ILE A 16 13.362 -20.589 -11.338 1.00 0.00 C ATOM 240 CG2 ILE A 16 12.256 -21.835 -13.213 1.00 0.00 C ATOM 241 CD1 ILE A 16 12.351 -20.976 -10.282 1.00 0.00 C ATOM 0 H ILE A 16 13.976 -18.322 -12.396 1.00 0.00 H new ATOM 0 HA ILE A 16 14.676 -20.605 -13.742 1.00 0.00 H new ATOM 0 HB ILE A 16 11.928 -19.788 -12.711 1.00 0.00 H new ATOM 0 HG12 ILE A 16 14.165 -21.326 -11.348 1.00 0.00 H new ATOM 0 HG13 ILE A 16 13.810 -19.633 -11.067 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.515 -22.209 -12.506 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.798 -21.730 -14.197 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.087 -22.538 -13.273 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.843 -21.033 -9.311 1.00 0.00 H new ATOM 0 HD12 ILE A 16 11.560 -20.227 -10.244 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.921 -21.947 -10.529 1.00 0.00 H new ATOM 253 N LEU A 17 12.687 -18.703 -15.485 1.00 0.00 N ATOM 254 CA LEU A 17 12.072 -18.509 -16.794 1.00 0.00 C ATOM 255 C LEU A 17 13.129 -18.209 -17.852 1.00 0.00 C ATOM 256 O LEU A 17 13.244 -18.922 -18.850 1.00 0.00 O ATOM 257 CB LEU A 17 11.052 -17.371 -16.737 1.00 0.00 C ATOM 258 CG LEU A 17 9.593 -17.765 -16.969 1.00 0.00 C ATOM 259 CD1 LEU A 17 8.665 -16.617 -16.604 1.00 0.00 C ATOM 260 CD2 LEU A 17 9.379 -18.187 -18.416 1.00 0.00 C ATOM 0 H LEU A 17 12.680 -17.875 -14.890 1.00 0.00 H new ATOM 0 HA LEU A 17 11.561 -19.432 -17.069 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.127 -16.891 -15.761 1.00 0.00 H new ATOM 0 HB3 LEU A 17 11.329 -16.624 -17.481 1.00 0.00 H new ATOM 0 HG LEU A 17 9.359 -18.613 -16.325 1.00 0.00 H new ATOM 0 HD11 LEU A 17 7.631 -16.916 -16.776 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.799 -16.361 -15.553 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.899 -15.750 -17.221 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.335 -18.464 -18.564 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.632 -17.359 -19.078 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.017 -19.041 -18.644 1.00 0.00 H new ATOM 272 N LEU A 18 13.899 -17.151 -17.627 1.00 0.00 N ATOM 273 CA LEU A 18 14.949 -16.756 -18.560 1.00 0.00 C ATOM 274 C LEU A 18 15.836 -17.945 -18.916 1.00 0.00 C ATOM 275 O LEU A 18 16.311 -18.061 -20.046 1.00 0.00 O ATOM 276 CB LEU A 18 15.798 -15.634 -17.959 1.00 0.00 C ATOM 277 CG LEU A 18 15.226 -14.221 -18.082 1.00 0.00 C ATOM 278 CD1 LEU A 18 16.266 -13.188 -17.678 1.00 0.00 C ATOM 279 CD2 LEU A 18 14.738 -13.964 -19.500 1.00 0.00 C ATOM 0 H LEU A 18 13.816 -16.551 -16.807 1.00 0.00 H new ATOM 0 HA LEU A 18 14.473 -16.394 -19.472 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.955 -15.850 -16.902 1.00 0.00 H new ATOM 0 HB3 LEU A 18 16.778 -15.651 -18.437 1.00 0.00 H new ATOM 0 HG LEU A 18 14.375 -14.134 -17.406 1.00 0.00 H new ATOM 0 HD11 LEU A 18 15.842 -12.188 -17.772 1.00 0.00 H new ATOM 0 HD12 LEU A 18 16.566 -13.359 -16.644 1.00 0.00 H new ATOM 0 HD13 LEU A 18 17.137 -13.275 -18.328 1.00 0.00 H new ATOM 0 HD21 LEU A 18 14.334 -12.954 -19.568 1.00 0.00 H new ATOM 0 HD22 LEU A 18 15.570 -14.070 -20.196 1.00 0.00 H new ATOM 0 HD23 LEU A 18 13.959 -14.684 -19.753 1.00 0.00 H new ATOM 291 N ILE A 19 16.053 -18.826 -17.945 1.00 0.00 N ATOM 292 CA ILE A 19 16.880 -20.007 -18.157 1.00 0.00 C ATOM 293 C ILE A 19 16.311 -20.884 -19.267 1.00 0.00 C ATOM 294 O ILE A 19 16.943 -21.076 -20.307 1.00 0.00 O ATOM 295 CB ILE A 19 17.006 -20.845 -16.871 1.00 0.00 C ATOM 296 CG1 ILE A 19 17.736 -20.049 -15.787 1.00 0.00 C ATOM 297 CG2 ILE A 19 17.734 -22.150 -17.157 1.00 0.00 C ATOM 298 CD1 ILE A 19 17.309 -20.408 -14.381 1.00 0.00 C ATOM 0 H ILE A 19 15.668 -18.744 -17.004 1.00 0.00 H new ATOM 0 HA ILE A 19 17.869 -19.651 -18.448 1.00 0.00 H new ATOM 0 HB ILE A 19 16.005 -21.082 -16.511 1.00 0.00 H new ATOM 0 HG12 ILE A 19 18.809 -20.216 -15.886 1.00 0.00 H new ATOM 0 HG13 ILE A 19 17.562 -18.985 -15.950 1.00 0.00 H new ATOM 0 HG21 ILE A 19 17.815 -22.731 -16.238 1.00 0.00 H new ATOM 0 HG22 ILE A 19 17.178 -22.722 -17.900 1.00 0.00 H new ATOM 0 HG23 ILE A 19 18.732 -21.934 -17.539 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.868 -19.805 -13.666 1.00 0.00 H new ATOM 0 HD12 ILE A 19 16.243 -20.215 -14.264 1.00 0.00 H new ATOM 0 HD13 ILE A 19 17.508 -21.464 -14.199 1.00 0.00 H new ATOM 310 N PHE A 20 15.114 -21.414 -19.041 1.00 0.00 N ATOM 311 CA PHE A 20 14.458 -22.270 -20.023 1.00 0.00 C ATOM 312 C PHE A 20 14.102 -21.482 -21.280 1.00 0.00 C ATOM 313 O PHE A 20 13.967 -22.051 -22.364 1.00 0.00 O ATOM 314 CB PHE A 20 13.196 -22.894 -19.424 1.00 0.00 C ATOM 315 CG PHE A 20 12.498 -23.845 -20.355 1.00 0.00 C ATOM 316 CD1 PHE A 20 13.118 -25.014 -20.765 1.00 0.00 C ATOM 317 CD2 PHE A 20 11.223 -23.568 -20.820 1.00 0.00 C ATOM 318 CE1 PHE A 20 12.479 -25.891 -21.621 1.00 0.00 C ATOM 319 CE2 PHE A 20 10.578 -24.441 -21.676 1.00 0.00 C ATOM 320 CZ PHE A 20 11.207 -25.603 -22.078 1.00 0.00 C ATOM 0 H PHE A 20 14.578 -21.266 -18.186 1.00 0.00 H new ATOM 0 HA PHE A 20 15.152 -23.064 -20.298 1.00 0.00 H new ATOM 0 HB2 PHE A 20 13.461 -23.423 -18.509 1.00 0.00 H new ATOM 0 HB3 PHE A 20 12.505 -22.099 -19.144 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.113 -25.243 -20.412 1.00 0.00 H new ATOM 0 HD2 PHE A 20 10.727 -22.660 -20.510 1.00 0.00 H new ATOM 0 HE1 PHE A 20 12.973 -26.800 -21.932 1.00 0.00 H new ATOM 0 HE2 PHE A 20 9.583 -24.215 -22.030 1.00 0.00 H new ATOM 0 HZ PHE A 20 10.706 -26.285 -22.748 1.00 0.00 H new ATOM 330 N ILE A 21 13.952 -20.171 -21.127 1.00 0.00 N ATOM 331 CA ILE A 21 13.612 -19.305 -22.249 1.00 0.00 C ATOM 332 C ILE A 21 14.796 -19.144 -23.197 1.00 0.00 C ATOM 333 O ILE A 21 14.646 -19.234 -24.415 1.00 0.00 O ATOM 334 CB ILE A 21 13.160 -17.913 -21.769 1.00 0.00 C ATOM 335 CG1 ILE A 21 11.649 -17.900 -21.525 1.00 0.00 C ATOM 336 CG2 ILE A 21 13.547 -16.851 -22.787 1.00 0.00 C ATOM 337 CD1 ILE A 21 11.172 -16.689 -20.755 1.00 0.00 C ATOM 0 H ILE A 21 14.061 -19.685 -20.237 1.00 0.00 H new ATOM 0 HA ILE A 21 12.788 -19.783 -22.778 1.00 0.00 H new ATOM 0 HB ILE A 21 13.663 -17.687 -20.829 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.134 -17.936 -22.485 1.00 0.00 H new ATOM 0 HG13 ILE A 21 11.370 -18.801 -20.979 1.00 0.00 H new ATOM 0 HG21 ILE A 21 13.221 -15.873 -22.434 1.00 0.00 H new ATOM 0 HG22 ILE A 21 14.629 -16.848 -22.916 1.00 0.00 H new ATOM 0 HG23 ILE A 21 13.068 -17.070 -23.741 1.00 0.00 H new ATOM 0 HD11 ILE A 21 10.092 -16.747 -20.619 1.00 0.00 H new ATOM 0 HD12 ILE A 21 11.660 -16.662 -19.780 1.00 0.00 H new ATOM 0 HD13 ILE A 21 11.420 -15.784 -21.310 1.00 0.00 H new ATOM 349 N PHE A 22 15.974 -18.906 -22.628 1.00 0.00 N ATOM 350 CA PHE A 22 17.185 -18.733 -23.422 1.00 0.00 C ATOM 351 C PHE A 22 17.719 -20.080 -23.900 1.00 0.00 C ATOM 352 O PHE A 22 17.975 -20.272 -25.089 1.00 0.00 O ATOM 353 CB PHE A 22 18.256 -18.007 -22.606 1.00 0.00 C ATOM 354 CG PHE A 22 17.885 -16.596 -22.250 1.00 0.00 C ATOM 355 CD1 PHE A 22 17.260 -15.776 -23.175 1.00 0.00 C ATOM 356 CD2 PHE A 22 18.161 -16.090 -20.990 1.00 0.00 C ATOM 357 CE1 PHE A 22 16.916 -14.477 -22.851 1.00 0.00 C ATOM 358 CE2 PHE A 22 17.820 -14.792 -20.660 1.00 0.00 C ATOM 359 CZ PHE A 22 17.198 -13.984 -21.592 1.00 0.00 C ATOM 0 H PHE A 22 16.115 -18.829 -21.621 1.00 0.00 H new ATOM 0 HA PHE A 22 16.934 -18.131 -24.295 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.445 -18.567 -21.690 1.00 0.00 H new ATOM 0 HB3 PHE A 22 19.188 -17.997 -23.171 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.039 -16.156 -24.161 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.648 -16.717 -20.258 1.00 0.00 H new ATOM 0 HE1 PHE A 22 16.428 -13.849 -23.581 1.00 0.00 H new ATOM 0 HE2 PHE A 22 18.040 -14.410 -19.674 1.00 0.00 H new ATOM 0 HZ PHE A 22 16.933 -12.969 -21.337 1.00 0.00 H new ATOM 369 N ILE A 23 17.886 -21.009 -22.965 1.00 0.00 N ATOM 370 CA ILE A 23 18.389 -22.338 -23.289 1.00 0.00 C ATOM 371 C ILE A 23 17.619 -22.947 -24.456 1.00 0.00 C ATOM 372 O ILE A 23 18.203 -23.578 -25.338 1.00 0.00 O ATOM 373 CB ILE A 23 18.299 -23.286 -22.079 1.00 0.00 C ATOM 374 CG1 ILE A 23 19.590 -23.227 -21.260 1.00 0.00 C ATOM 375 CG2 ILE A 23 18.022 -24.709 -22.539 1.00 0.00 C ATOM 376 CD1 ILE A 23 19.484 -22.357 -20.027 1.00 0.00 C ATOM 0 H ILE A 23 17.680 -20.866 -21.976 1.00 0.00 H new ATOM 0 HA ILE A 23 19.436 -22.219 -23.569 1.00 0.00 H new ATOM 0 HB ILE A 23 17.473 -22.963 -21.445 1.00 0.00 H new ATOM 0 HG12 ILE A 23 19.866 -24.238 -20.959 1.00 0.00 H new ATOM 0 HG13 ILE A 23 20.395 -22.851 -21.892 1.00 0.00 H new ATOM 0 HG21 ILE A 23 17.961 -25.366 -21.672 1.00 0.00 H new ATOM 0 HG22 ILE A 23 17.078 -24.738 -23.083 1.00 0.00 H new ATOM 0 HG23 ILE A 23 18.828 -25.044 -23.192 1.00 0.00 H new ATOM 0 HD11 ILE A 23 20.436 -22.362 -19.495 1.00 0.00 H new ATOM 0 HD12 ILE A 23 19.238 -21.337 -20.322 1.00 0.00 H new ATOM 0 HD13 ILE A 23 18.702 -22.745 -19.374 1.00 0.00 H new ATOM 388 N VAL A 24 16.304 -22.754 -24.456 1.00 0.00 N ATOM 389 CA VAL A 24 15.453 -23.281 -25.516 1.00 0.00 C ATOM 390 C VAL A 24 15.688 -22.542 -26.828 1.00 0.00 C ATOM 391 O VAL A 24 15.956 -23.157 -27.861 1.00 0.00 O ATOM 392 CB VAL A 24 13.963 -23.180 -25.142 1.00 0.00 C ATOM 393 CG1 VAL A 24 13.092 -23.273 -26.386 1.00 0.00 C ATOM 394 CG2 VAL A 24 13.591 -24.262 -24.139 1.00 0.00 C ATOM 0 H VAL A 24 15.805 -22.236 -23.733 1.00 0.00 H new ATOM 0 HA VAL A 24 15.718 -24.331 -25.642 1.00 0.00 H new ATOM 0 HB VAL A 24 13.788 -22.210 -24.677 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.042 -23.200 -26.102 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.341 -22.459 -27.066 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.268 -24.227 -26.883 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.534 -24.176 -23.886 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.781 -25.243 -24.575 1.00 0.00 H new ATOM 0 HG23 VAL A 24 14.191 -24.144 -23.237 1.00 0.00 H new ATOM 404 N LEU A 25 15.586 -21.218 -26.781 1.00 0.00 N ATOM 405 CA LEU A 25 15.788 -20.393 -27.967 1.00 0.00 C ATOM 406 C LEU A 25 17.163 -20.645 -28.578 1.00 0.00 C ATOM 407 O LEU A 25 17.329 -20.601 -29.798 1.00 0.00 O ATOM 408 CB LEU A 25 15.638 -18.912 -27.614 1.00 0.00 C ATOM 409 CG LEU A 25 14.208 -18.415 -27.399 1.00 0.00 C ATOM 410 CD1 LEU A 25 14.195 -16.913 -27.161 1.00 0.00 C ATOM 411 CD2 LEU A 25 13.333 -18.776 -28.590 1.00 0.00 C ATOM 0 H LEU A 25 15.365 -20.693 -25.935 1.00 0.00 H new ATOM 0 HA LEU A 25 15.029 -20.664 -28.701 1.00 0.00 H new ATOM 0 HB2 LEU A 25 16.210 -18.715 -26.707 1.00 0.00 H new ATOM 0 HB3 LEU A 25 16.091 -18.322 -28.411 1.00 0.00 H new ATOM 0 HG LEU A 25 13.803 -18.906 -26.514 1.00 0.00 H new ATOM 0 HD11 LEU A 25 13.169 -16.577 -27.010 1.00 0.00 H new ATOM 0 HD12 LEU A 25 14.787 -16.680 -26.276 1.00 0.00 H new ATOM 0 HD13 LEU A 25 14.620 -16.404 -28.026 1.00 0.00 H new ATOM 0 HD21 LEU A 25 12.319 -18.414 -28.419 1.00 0.00 H new ATOM 0 HD22 LEU A 25 13.736 -18.314 -29.491 1.00 0.00 H new ATOM 0 HD23 LEU A 25 13.316 -19.859 -28.714 1.00 0.00 H new ATOM 423 N LEU A 26 18.145 -20.909 -27.724 1.00 0.00 N ATOM 424 CA LEU A 26 19.505 -21.171 -28.179 1.00 0.00 C ATOM 425 C LEU A 26 19.532 -22.316 -29.187 1.00 0.00 C ATOM 426 O LEU A 26 20.188 -22.227 -30.225 1.00 0.00 O ATOM 427 CB LEU A 26 20.408 -21.502 -26.990 1.00 0.00 C ATOM 428 CG LEU A 26 21.684 -22.281 -27.311 1.00 0.00 C ATOM 429 CD1 LEU A 26 22.607 -21.453 -28.191 1.00 0.00 C ATOM 430 CD2 LEU A 26 22.393 -22.695 -26.030 1.00 0.00 C ATOM 0 H LEU A 26 18.025 -20.947 -26.712 1.00 0.00 H new ATOM 0 HA LEU A 26 19.876 -20.271 -28.669 1.00 0.00 H new ATOM 0 HB2 LEU A 26 20.689 -20.569 -26.503 1.00 0.00 H new ATOM 0 HB3 LEU A 26 19.828 -22.076 -26.268 1.00 0.00 H new ATOM 0 HG LEU A 26 21.409 -23.183 -27.857 1.00 0.00 H new ATOM 0 HD11 LEU A 26 23.510 -22.023 -28.409 1.00 0.00 H new ATOM 0 HD12 LEU A 26 22.098 -21.208 -29.123 1.00 0.00 H new ATOM 0 HD13 LEU A 26 22.876 -20.533 -27.672 1.00 0.00 H new ATOM 0 HD21 LEU A 26 23.299 -23.248 -26.278 1.00 0.00 H new ATOM 0 HD22 LEU A 26 22.656 -21.806 -25.456 1.00 0.00 H new ATOM 0 HD23 LEU A 26 21.733 -23.327 -25.437 1.00 0.00 H new ATOM 442 N ILE A 27 18.813 -23.389 -28.874 1.00 0.00 N ATOM 443 CA ILE A 27 18.752 -24.550 -29.753 1.00 0.00 C ATOM 444 C ILE A 27 17.970 -24.236 -31.024 1.00 0.00 C ATOM 445 O ILE A 27 18.437 -24.496 -32.134 1.00 0.00 O ATOM 446 CB ILE A 27 18.103 -25.756 -29.049 1.00 0.00 C ATOM 447 CG1 ILE A 27 19.171 -26.605 -28.357 1.00 0.00 C ATOM 448 CG2 ILE A 27 17.318 -26.593 -30.048 1.00 0.00 C ATOM 449 CD1 ILE A 27 19.337 -26.287 -26.888 1.00 0.00 C ATOM 0 H ILE A 27 18.265 -23.478 -28.018 1.00 0.00 H new ATOM 0 HA ILE A 27 19.780 -24.803 -30.014 1.00 0.00 H new ATOM 0 HB ILE A 27 17.412 -25.387 -28.291 1.00 0.00 H new ATOM 0 HG12 ILE A 27 18.913 -27.658 -28.466 1.00 0.00 H new ATOM 0 HG13 ILE A 27 20.125 -26.457 -28.863 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.865 -27.442 -29.535 1.00 0.00 H new ATOM 0 HG22 ILE A 27 16.536 -25.982 -30.499 1.00 0.00 H new ATOM 0 HG23 ILE A 27 17.990 -26.956 -30.826 1.00 0.00 H new ATOM 0 HD11 ILE A 27 20.110 -26.927 -26.462 1.00 0.00 H new ATOM 0 HD12 ILE A 27 19.626 -25.242 -26.772 1.00 0.00 H new ATOM 0 HD13 ILE A 27 18.395 -26.462 -26.369 1.00 0.00 H new ATOM 461 N HIS A 28 16.778 -23.673 -30.855 1.00 0.00 N ATOM 462 CA HIS A 28 15.931 -23.321 -31.989 1.00 0.00 C ATOM 463 C HIS A 28 16.713 -22.514 -33.021 1.00 0.00 C ATOM 464 O HIS A 28 16.453 -22.604 -34.221 1.00 0.00 O ATOM 465 CB HIS A 28 14.715 -22.524 -31.516 1.00 0.00 C ATOM 466 CG HIS A 28 13.863 -22.011 -32.636 1.00 0.00 C ATOM 467 ND1 HIS A 28 14.215 -20.928 -33.415 1.00 0.00 N ATOM 468 CD2 HIS A 28 12.668 -22.439 -33.108 1.00 0.00 C ATOM 469 CE1 HIS A 28 13.273 -20.712 -34.316 1.00 0.00 C ATOM 470 NE2 HIS A 28 12.324 -21.615 -34.151 1.00 0.00 N ATOM 0 H HIS A 28 16.377 -23.451 -29.944 1.00 0.00 H new ATOM 0 HA HIS A 28 15.591 -24.244 -32.458 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.107 -23.155 -30.868 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.055 -21.682 -30.914 1.00 0.00 H new ATOM 0 HD2 HIS A 28 12.093 -23.273 -32.734 1.00 0.00 H new ATOM 0 HE1 HIS A 28 13.278 -19.930 -35.061 1.00 0.00 H new ATOM 0 HE2 HIS A 28 11.473 -21.689 -34.708 1.00 0.00 H new ATOM 478 N PHE A 29 17.671 -21.726 -32.546 1.00 0.00 N ATOM 479 CA PHE A 29 18.490 -20.902 -33.428 1.00 0.00 C ATOM 480 C PHE A 29 19.816 -21.590 -33.739 1.00 0.00 C ATOM 481 O PHE A 29 20.456 -21.297 -34.748 1.00 0.00 O ATOM 482 CB PHE A 29 18.749 -19.536 -32.789 1.00 0.00 C ATOM 483 CG PHE A 29 17.634 -18.553 -33.002 1.00 0.00 C ATOM 484 CD1 PHE A 29 17.298 -18.133 -34.279 1.00 0.00 C ATOM 485 CD2 PHE A 29 16.921 -18.048 -31.926 1.00 0.00 C ATOM 486 CE1 PHE A 29 16.271 -17.229 -34.480 1.00 0.00 C ATOM 487 CE2 PHE A 29 15.894 -17.145 -32.121 1.00 0.00 C ATOM 488 CZ PHE A 29 15.569 -16.733 -33.399 1.00 0.00 C ATOM 0 H PHE A 29 17.900 -21.640 -31.556 1.00 0.00 H new ATOM 0 HA PHE A 29 17.946 -20.762 -34.362 1.00 0.00 H new ATOM 0 HB2 PHE A 29 18.906 -19.669 -31.719 1.00 0.00 H new ATOM 0 HB3 PHE A 29 19.671 -19.122 -33.197 1.00 0.00 H new ATOM 0 HD1 PHE A 29 17.845 -18.516 -35.128 1.00 0.00 H new ATOM 0 HD2 PHE A 29 17.171 -18.364 -30.924 1.00 0.00 H new ATOM 0 HE1 PHE A 29 16.018 -16.911 -35.481 1.00 0.00 H new ATOM 0 HE2 PHE A 29 15.345 -16.761 -31.274 1.00 0.00 H new ATOM 0 HZ PHE A 29 14.768 -16.025 -33.552 1.00 0.00 H new ATOM 498 N GLU A 30 20.221 -22.504 -32.863 1.00 0.00 N ATOM 499 CA GLU A 30 21.472 -23.233 -33.044 1.00 0.00 C ATOM 500 C GLU A 30 21.356 -24.236 -34.188 1.00 0.00 C ATOM 501 O GLU A 30 22.315 -24.933 -34.515 1.00 0.00 O ATOM 502 CB GLU A 30 21.857 -23.957 -31.753 1.00 0.00 C ATOM 503 CG GLU A 30 22.838 -23.182 -30.889 1.00 0.00 C ATOM 504 CD GLU A 30 24.243 -23.181 -31.460 1.00 0.00 C ATOM 505 OE1 GLU A 30 24.434 -23.722 -32.568 1.00 0.00 O ATOM 506 OE2 GLU A 30 25.151 -22.638 -30.796 1.00 0.00 O ATOM 0 H GLU A 30 19.702 -22.757 -32.022 1.00 0.00 H new ATOM 0 HA GLU A 30 22.251 -22.512 -33.293 1.00 0.00 H new ATOM 0 HB2 GLU A 30 20.955 -24.155 -31.175 1.00 0.00 H new ATOM 0 HB3 GLU A 30 22.293 -24.924 -32.005 1.00 0.00 H new ATOM 0 HG2 GLU A 30 22.491 -22.154 -30.785 1.00 0.00 H new ATOM 0 HG3 GLU A 30 22.856 -23.615 -29.889 1.00 0.00 H new ATOM 513 N GLY A 31 20.174 -24.303 -34.792 1.00 0.00 N ATOM 514 CA GLY A 31 19.953 -25.223 -35.892 1.00 0.00 C ATOM 515 C GLY A 31 18.757 -26.125 -35.663 1.00 0.00 C ATOM 516 O GLY A 31 18.865 -27.347 -35.760 1.00 0.00 O ATOM 0 H GLY A 31 19.365 -23.736 -34.539 1.00 0.00 H new ATOM 0 HA2 GLY A 31 19.806 -24.656 -36.811 1.00 0.00 H new ATOM 0 HA3 GLY A 31 20.844 -25.835 -36.034 1.00 0.00 H new ATOM 520 N TRP A 32 17.614 -25.521 -35.357 1.00 0.00 N ATOM 521 CA TRP A 32 16.392 -26.279 -35.111 1.00 0.00 C ATOM 522 C TRP A 32 15.199 -25.628 -35.803 1.00 0.00 C ATOM 523 O TRP A 32 14.059 -25.772 -35.362 1.00 0.00 O ATOM 524 CB TRP A 32 16.128 -26.387 -33.608 1.00 0.00 C ATOM 525 CG TRP A 32 16.122 -27.800 -33.107 1.00 0.00 C ATOM 526 CD1 TRP A 32 17.133 -28.712 -33.215 1.00 0.00 C ATOM 527 CD2 TRP A 32 15.054 -28.461 -32.421 1.00 0.00 C ATOM 528 NE1 TRP A 32 16.757 -29.901 -32.637 1.00 0.00 N ATOM 529 CE2 TRP A 32 15.486 -29.772 -32.142 1.00 0.00 C ATOM 530 CE3 TRP A 32 13.775 -28.073 -32.013 1.00 0.00 C ATOM 531 CZ2 TRP A 32 14.684 -30.695 -31.476 1.00 0.00 C ATOM 532 CZ3 TRP A 32 12.979 -28.990 -31.352 1.00 0.00 C ATOM 533 CH2 TRP A 32 13.436 -30.288 -31.088 1.00 0.00 C ATOM 0 H TRP A 32 17.508 -24.510 -35.273 1.00 0.00 H new ATOM 0 HA TRP A 32 16.526 -27.279 -35.522 1.00 0.00 H new ATOM 0 HB2 TRP A 32 16.890 -25.822 -33.071 1.00 0.00 H new ATOM 0 HB3 TRP A 32 15.168 -25.924 -33.381 1.00 0.00 H new ATOM 0 HD1 TRP A 32 18.087 -28.526 -33.685 1.00 0.00 H new ATOM 0 HE1 TRP A 32 17.331 -30.743 -32.585 1.00 0.00 H new ATOM 0 HE3 TRP A 32 13.415 -27.074 -32.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 15.034 -31.696 -31.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 11.988 -28.701 -31.034 1.00 0.00 H new ATOM 0 HH2 TRP A 32 12.791 -30.981 -30.568 1.00 0.00 H new ATOM 544 N ARG A 33 15.470 -24.911 -36.889 1.00 0.00 N ATOM 545 CA ARG A 33 14.419 -24.237 -37.641 1.00 0.00 C ATOM 546 C ARG A 33 14.795 -24.118 -39.115 1.00 0.00 C ATOM 547 O ARG A 33 15.294 -23.082 -39.557 1.00 0.00 O ATOM 548 CB ARG A 33 14.155 -22.847 -37.058 1.00 0.00 C ATOM 549 CG ARG A 33 12.774 -22.303 -37.382 1.00 0.00 C ATOM 550 CD ARG A 33 12.745 -21.635 -38.748 1.00 0.00 C ATOM 551 NE ARG A 33 13.615 -20.464 -38.804 1.00 0.00 N ATOM 552 CZ ARG A 33 13.278 -19.274 -38.319 1.00 0.00 C ATOM 553 NH1 ARG A 33 12.096 -19.099 -37.745 1.00 0.00 N ATOM 554 NH2 ARG A 33 14.125 -18.256 -38.407 1.00 0.00 N ATOM 0 H ARG A 33 16.408 -24.782 -37.267 1.00 0.00 H new ATOM 0 HA ARG A 33 13.511 -24.835 -37.562 1.00 0.00 H new ATOM 0 HB2 ARG A 33 14.275 -22.888 -35.975 1.00 0.00 H new ATOM 0 HB3 ARG A 33 14.907 -22.155 -37.437 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.047 -23.115 -37.357 1.00 0.00 H new ATOM 0 HG3 ARG A 33 12.476 -21.585 -36.618 1.00 0.00 H new ATOM 0 HD2 ARG A 33 13.053 -22.352 -39.509 1.00 0.00 H new ATOM 0 HD3 ARG A 33 11.723 -21.339 -38.985 1.00 0.00 H new ATOM 0 HE ARG A 33 14.532 -20.565 -39.239 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.443 -19.879 -37.675 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.840 -18.184 -37.373 1.00 0.00 H new ATOM 0 HH21 ARG A 33 15.036 -18.387 -38.847 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.865 -17.343 -38.034 1.00 0.00 H new ATOM 568 N ILE A 34 14.554 -25.184 -39.870 1.00 0.00 N ATOM 569 CA ILE A 34 14.867 -25.198 -41.294 1.00 0.00 C ATOM 570 C ILE A 34 14.122 -24.091 -42.032 1.00 0.00 C ATOM 571 O ILE A 34 12.908 -23.973 -41.873 1.00 0.00 O ATOM 572 CB ILE A 34 14.515 -26.554 -41.934 1.00 0.00 C ATOM 573 CG1 ILE A 34 15.284 -27.683 -41.244 1.00 0.00 C ATOM 574 CG2 ILE A 34 14.821 -26.531 -43.424 1.00 0.00 C ATOM 575 CD1 ILE A 34 14.746 -29.061 -41.561 1.00 0.00 C ATOM 0 H ILE A 34 14.143 -26.049 -39.520 1.00 0.00 H new ATOM 0 HA ILE A 34 15.940 -25.031 -41.383 1.00 0.00 H new ATOM 0 HB ILE A 34 13.448 -26.735 -41.805 1.00 0.00 H new ATOM 0 HG12 ILE A 34 16.331 -27.633 -41.542 1.00 0.00 H new ATOM 0 HG13 ILE A 34 15.251 -27.528 -40.166 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.567 -27.496 -43.863 1.00 0.00 H new ATOM 0 HG22 ILE A 34 14.233 -25.748 -43.904 1.00 0.00 H new ATOM 0 HG23 ILE A 34 15.882 -26.332 -43.574 1.00 0.00 H new ATOM 0 HD11 ILE A 34 15.339 -29.812 -41.038 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.707 -29.129 -41.238 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.804 -29.236 -42.635 1.00 0.00 H new TER 587 ILE A 34 ATOM 588 N MET B 101 10.823 11.597 -10.365 1.00 0.00 N ATOM 589 CA MET B 101 9.881 10.995 -9.429 1.00 0.00 C ATOM 590 C MET B 101 9.229 9.757 -10.035 1.00 0.00 C ATOM 591 O MET B 101 8.096 9.412 -9.698 1.00 0.00 O ATOM 592 CB MET B 101 8.807 12.008 -9.030 1.00 0.00 C ATOM 593 CG MET B 101 9.363 13.245 -8.344 1.00 0.00 C ATOM 594 SD MET B 101 8.199 14.623 -8.345 1.00 0.00 S ATOM 595 CE MET B 101 9.321 16.013 -8.470 1.00 0.00 C ATOM 0 HA MET B 101 10.434 10.694 -8.539 1.00 0.00 H new ATOM 0 HB2 MET B 101 8.258 12.313 -9.921 1.00 0.00 H new ATOM 0 HB3 MET B 101 8.092 11.524 -8.365 1.00 0.00 H new ATOM 0 HG2 MET B 101 9.626 12.998 -7.316 1.00 0.00 H new ATOM 0 HG3 MET B 101 10.282 13.551 -8.844 1.00 0.00 H new ATOM 0 HE1 MET B 101 8.750 16.941 -8.482 1.00 0.00 H new ATOM 0 HE2 MET B 101 9.996 16.014 -7.614 1.00 0.00 H new ATOM 0 HE3 MET B 101 9.900 15.931 -9.390 1.00 0.00 H new ATOM 605 N ASP B 102 9.950 9.092 -10.931 1.00 0.00 N ATOM 606 CA ASP B 102 9.441 7.891 -11.584 1.00 0.00 C ATOM 607 C ASP B 102 10.587 7.027 -12.102 1.00 0.00 C ATOM 608 O ASP B 102 11.374 7.462 -12.943 1.00 0.00 O ATOM 609 CB ASP B 102 8.509 8.268 -12.736 1.00 0.00 C ATOM 610 CG ASP B 102 7.134 8.688 -12.255 1.00 0.00 C ATOM 611 OD1 ASP B 102 6.540 7.950 -11.441 1.00 0.00 O ATOM 612 OD2 ASP B 102 6.652 9.754 -12.692 1.00 0.00 O ATOM 0 H ASP B 102 10.889 9.364 -11.222 1.00 0.00 H new ATOM 0 HA ASP B 102 8.881 7.316 -10.847 1.00 0.00 H new ATOM 0 HB2 ASP B 102 8.955 9.082 -13.308 1.00 0.00 H new ATOM 0 HB3 ASP B 102 8.410 7.419 -13.412 1.00 0.00 H new ATOM 617 N SER B 103 10.675 5.803 -11.593 1.00 0.00 N ATOM 618 CA SER B 103 11.727 4.879 -12.000 1.00 0.00 C ATOM 619 C SER B 103 11.208 3.886 -13.035 1.00 0.00 C ATOM 620 O SER B 103 11.583 2.714 -13.029 1.00 0.00 O ATOM 621 CB SER B 103 12.274 4.128 -10.785 1.00 0.00 C ATOM 622 OG SER B 103 11.968 4.812 -9.582 1.00 0.00 O ATOM 0 H SER B 103 10.030 5.428 -10.898 1.00 0.00 H new ATOM 0 HA SER B 103 12.531 5.460 -12.451 1.00 0.00 H new ATOM 0 HB2 SER B 103 11.851 3.124 -10.754 1.00 0.00 H new ATOM 0 HB3 SER B 103 13.354 4.016 -10.879 1.00 0.00 H new ATOM 0 HG SER B 103 12.327 4.311 -8.820 1.00 0.00 H new ATOM 628 N ALA B 104 10.343 4.365 -13.923 1.00 0.00 N ATOM 629 CA ALA B 104 9.772 3.521 -14.966 1.00 0.00 C ATOM 630 C ALA B 104 10.824 3.147 -16.005 1.00 0.00 C ATOM 631 O ALA B 104 11.128 1.974 -16.222 1.00 0.00 O ATOM 632 CB ALA B 104 8.597 4.223 -15.629 1.00 0.00 C ATOM 0 H ALA B 104 10.022 5.333 -13.941 1.00 0.00 H new ATOM 0 HA ALA B 104 9.415 2.602 -14.501 1.00 0.00 H new ATOM 0 HB1 ALA B 104 8.181 3.581 -16.405 1.00 0.00 H new ATOM 0 HB2 ALA B 104 7.831 4.433 -14.883 1.00 0.00 H new ATOM 0 HB3 ALA B 104 8.936 5.158 -16.075 1.00 0.00 H new ATOM 638 N PRO B 105 11.393 4.167 -16.665 1.00 0.00 N ATOM 639 CA PRO B 105 12.419 3.969 -17.693 1.00 0.00 C ATOM 640 C PRO B 105 13.740 3.482 -17.108 1.00 0.00 C ATOM 641 O PRO B 105 14.548 2.865 -17.802 1.00 0.00 O ATOM 642 CB PRO B 105 12.586 5.365 -18.300 1.00 0.00 C ATOM 643 CG PRO B 105 12.163 6.300 -17.221 1.00 0.00 C ATOM 644 CD PRO B 105 11.079 5.590 -16.458 1.00 0.00 C ATOM 0 HA PRO B 105 12.130 3.206 -18.416 1.00 0.00 H new ATOM 0 HB2 PRO B 105 13.619 5.546 -18.598 1.00 0.00 H new ATOM 0 HB3 PRO B 105 11.971 5.485 -19.192 1.00 0.00 H new ATOM 0 HG2 PRO B 105 13.001 6.548 -16.569 1.00 0.00 H new ATOM 0 HG3 PRO B 105 11.796 7.237 -17.639 1.00 0.00 H new ATOM 0 HD2 PRO B 105 11.092 5.855 -15.401 1.00 0.00 H new ATOM 0 HD3 PRO B 105 10.089 5.842 -16.838 1.00 0.00 H new ATOM 652 N PHE B 106 13.954 3.763 -15.827 1.00 0.00 N ATOM 653 CA PHE B 106 15.178 3.353 -15.148 1.00 0.00 C ATOM 654 C PHE B 106 15.139 1.866 -14.807 1.00 0.00 C ATOM 655 O PHE B 106 16.151 1.172 -14.898 1.00 0.00 O ATOM 656 CB PHE B 106 15.379 4.176 -13.874 1.00 0.00 C ATOM 657 CG PHE B 106 16.608 5.039 -13.905 1.00 0.00 C ATOM 658 CD1 PHE B 106 16.756 6.020 -14.872 1.00 0.00 C ATOM 659 CD2 PHE B 106 17.614 4.869 -12.969 1.00 0.00 C ATOM 660 CE1 PHE B 106 17.885 6.817 -14.904 1.00 0.00 C ATOM 661 CE2 PHE B 106 18.745 5.663 -12.995 1.00 0.00 C ATOM 662 CZ PHE B 106 18.881 6.638 -13.965 1.00 0.00 C ATOM 0 H PHE B 106 13.296 4.273 -15.238 1.00 0.00 H new ATOM 0 HA PHE B 106 16.016 3.530 -15.823 1.00 0.00 H new ATOM 0 HB2 PHE B 106 14.505 4.808 -13.718 1.00 0.00 H new ATOM 0 HB3 PHE B 106 15.441 3.501 -13.021 1.00 0.00 H new ATOM 0 HD1 PHE B 106 15.980 6.164 -15.609 1.00 0.00 H new ATOM 0 HD2 PHE B 106 17.514 4.107 -12.210 1.00 0.00 H new ATOM 0 HE1 PHE B 106 17.988 7.579 -15.663 1.00 0.00 H new ATOM 0 HE2 PHE B 106 19.522 5.522 -12.258 1.00 0.00 H new ATOM 0 HZ PHE B 106 19.765 7.259 -13.988 1.00 0.00 H new ATOM 672 N GLU B 107 13.964 1.386 -14.413 1.00 0.00 N ATOM 673 CA GLU B 107 13.793 -0.017 -14.056 1.00 0.00 C ATOM 674 C GLU B 107 14.186 -0.925 -15.218 1.00 0.00 C ATOM 675 O GLU B 107 14.861 -1.938 -15.029 1.00 0.00 O ATOM 676 CB GLU B 107 12.344 -0.291 -13.648 1.00 0.00 C ATOM 677 CG GLU B 107 12.188 -0.705 -12.195 1.00 0.00 C ATOM 678 CD GLU B 107 12.717 -2.101 -11.927 1.00 0.00 C ATOM 679 OE1 GLU B 107 12.158 -3.065 -12.491 1.00 0.00 O ATOM 680 OE2 GLU B 107 13.689 -2.230 -11.153 1.00 0.00 O ATOM 0 H GLU B 107 13.117 1.948 -14.333 1.00 0.00 H new ATOM 0 HA GLU B 107 14.447 -0.232 -13.211 1.00 0.00 H new ATOM 0 HB2 GLU B 107 11.749 0.605 -13.827 1.00 0.00 H new ATOM 0 HB3 GLU B 107 11.938 -1.076 -14.286 1.00 0.00 H new ATOM 0 HG2 GLU B 107 12.714 0.007 -11.559 1.00 0.00 H new ATOM 0 HG3 GLU B 107 11.134 -0.660 -11.919 1.00 0.00 H new ATOM 687 N LEU B 108 13.759 -0.556 -16.420 1.00 0.00 N ATOM 688 CA LEU B 108 14.064 -1.336 -17.614 1.00 0.00 C ATOM 689 C LEU B 108 15.567 -1.559 -17.749 1.00 0.00 C ATOM 690 O LEU B 108 16.012 -2.622 -18.182 1.00 0.00 O ATOM 691 CB LEU B 108 13.528 -0.630 -18.861 1.00 0.00 C ATOM 692 CG LEU B 108 12.911 -1.532 -19.930 1.00 0.00 C ATOM 693 CD1 LEU B 108 11.641 -2.187 -19.408 1.00 0.00 C ATOM 694 CD2 LEU B 108 12.622 -0.738 -21.196 1.00 0.00 C ATOM 0 H LEU B 108 13.200 0.279 -16.594 1.00 0.00 H new ATOM 0 HA LEU B 108 13.578 -2.307 -17.517 1.00 0.00 H new ATOM 0 HB2 LEU B 108 12.777 0.095 -18.549 1.00 0.00 H new ATOM 0 HB3 LEU B 108 14.344 -0.068 -19.315 1.00 0.00 H new ATOM 0 HG LEU B 108 13.627 -2.317 -20.173 1.00 0.00 H new ATOM 0 HD11 LEU B 108 11.216 -2.825 -20.183 1.00 0.00 H new ATOM 0 HD12 LEU B 108 11.876 -2.789 -18.530 1.00 0.00 H new ATOM 0 HD13 LEU B 108 10.919 -1.417 -19.136 1.00 0.00 H new ATOM 0 HD21 LEU B 108 12.183 -1.396 -21.946 1.00 0.00 H new ATOM 0 HD22 LEU B 108 11.925 0.069 -20.968 1.00 0.00 H new ATOM 0 HD23 LEU B 108 13.551 -0.317 -21.581 1.00 0.00 H new ATOM 706 N PHE B 109 16.346 -0.549 -17.374 1.00 0.00 N ATOM 707 CA PHE B 109 17.799 -0.635 -17.451 1.00 0.00 C ATOM 708 C PHE B 109 18.304 -1.921 -16.803 1.00 0.00 C ATOM 709 O PHE B 109 19.157 -2.615 -17.356 1.00 0.00 O ATOM 710 CB PHE B 109 18.440 0.577 -16.772 1.00 0.00 C ATOM 711 CG PHE B 109 19.817 0.892 -17.282 1.00 0.00 C ATOM 712 CD1 PHE B 109 20.033 1.135 -18.629 1.00 0.00 C ATOM 713 CD2 PHE B 109 20.896 0.943 -16.414 1.00 0.00 C ATOM 714 CE1 PHE B 109 21.300 1.426 -19.101 1.00 0.00 C ATOM 715 CE2 PHE B 109 22.165 1.233 -16.881 1.00 0.00 C ATOM 716 CZ PHE B 109 22.367 1.473 -18.226 1.00 0.00 C ATOM 0 H PHE B 109 15.995 0.338 -17.014 1.00 0.00 H new ATOM 0 HA PHE B 109 18.081 -0.645 -18.504 1.00 0.00 H new ATOM 0 HB2 PHE B 109 17.799 1.447 -16.919 1.00 0.00 H new ATOM 0 HB3 PHE B 109 18.491 0.397 -15.698 1.00 0.00 H new ATOM 0 HD1 PHE B 109 19.202 1.097 -19.318 1.00 0.00 H new ATOM 0 HD2 PHE B 109 20.744 0.754 -15.361 1.00 0.00 H new ATOM 0 HE1 PHE B 109 21.455 1.616 -20.153 1.00 0.00 H new ATOM 0 HE2 PHE B 109 22.998 1.272 -16.194 1.00 0.00 H new ATOM 0 HZ PHE B 109 23.358 1.697 -18.593 1.00 0.00 H new ATOM 726 N PHE B 110 17.771 -2.232 -15.626 1.00 0.00 N ATOM 727 CA PHE B 110 18.167 -3.433 -14.900 1.00 0.00 C ATOM 728 C PHE B 110 17.582 -4.681 -15.554 1.00 0.00 C ATOM 729 O PHE B 110 18.136 -5.774 -15.437 1.00 0.00 O ATOM 730 CB PHE B 110 17.713 -3.346 -13.442 1.00 0.00 C ATOM 731 CG PHE B 110 17.863 -4.638 -12.690 1.00 0.00 C ATOM 732 CD1 PHE B 110 16.836 -5.568 -12.672 1.00 0.00 C ATOM 733 CD2 PHE B 110 19.030 -4.922 -12.000 1.00 0.00 C ATOM 734 CE1 PHE B 110 16.971 -6.758 -11.981 1.00 0.00 C ATOM 735 CE2 PHE B 110 19.171 -6.110 -11.308 1.00 0.00 C ATOM 736 CZ PHE B 110 18.140 -7.028 -11.298 1.00 0.00 C ATOM 0 H PHE B 110 17.063 -1.669 -15.155 1.00 0.00 H new ATOM 0 HA PHE B 110 19.254 -3.504 -14.930 1.00 0.00 H new ATOM 0 HB2 PHE B 110 18.289 -2.571 -12.936 1.00 0.00 H new ATOM 0 HB3 PHE B 110 16.668 -3.037 -13.413 1.00 0.00 H new ATOM 0 HD1 PHE B 110 15.919 -5.361 -13.204 1.00 0.00 H new ATOM 0 HD2 PHE B 110 19.839 -4.207 -12.003 1.00 0.00 H new ATOM 0 HE1 PHE B 110 16.163 -7.475 -11.976 1.00 0.00 H new ATOM 0 HE2 PHE B 110 20.087 -6.320 -10.776 1.00 0.00 H new ATOM 0 HZ PHE B 110 18.248 -7.956 -10.757 1.00 0.00 H new ATOM 746 N MET B 111 16.458 -4.510 -16.242 1.00 0.00 N ATOM 747 CA MET B 111 15.798 -5.622 -16.915 1.00 0.00 C ATOM 748 C MET B 111 16.607 -6.085 -18.123 1.00 0.00 C ATOM 749 O MET B 111 16.574 -7.260 -18.490 1.00 0.00 O ATOM 750 CB MET B 111 14.390 -5.217 -17.356 1.00 0.00 C ATOM 751 CG MET B 111 13.322 -5.497 -16.311 1.00 0.00 C ATOM 752 SD MET B 111 11.747 -4.708 -16.699 1.00 0.00 S ATOM 753 CE MET B 111 11.570 -3.601 -15.302 1.00 0.00 C ATOM 0 H MET B 111 15.986 -3.612 -16.348 1.00 0.00 H new ATOM 0 HA MET B 111 15.726 -6.449 -16.209 1.00 0.00 H new ATOM 0 HB2 MET B 111 14.384 -4.153 -17.593 1.00 0.00 H new ATOM 0 HB3 MET B 111 14.138 -5.750 -18.273 1.00 0.00 H new ATOM 0 HG2 MET B 111 13.174 -6.574 -16.228 1.00 0.00 H new ATOM 0 HG3 MET B 111 13.670 -5.147 -15.339 1.00 0.00 H new ATOM 0 HE1 MET B 111 10.948 -2.752 -15.587 1.00 0.00 H new ATOM 0 HE2 MET B 111 11.102 -4.133 -14.474 1.00 0.00 H new ATOM 0 HE3 MET B 111 12.553 -3.243 -14.994 1.00 0.00 H new ATOM 763 N ILE B 112 17.331 -5.155 -18.735 1.00 0.00 N ATOM 764 CA ILE B 112 18.149 -5.469 -19.900 1.00 0.00 C ATOM 765 C ILE B 112 19.510 -6.017 -19.485 1.00 0.00 C ATOM 766 O ILE B 112 19.972 -7.027 -20.015 1.00 0.00 O ATOM 767 CB ILE B 112 18.358 -4.230 -20.792 1.00 0.00 C ATOM 768 CG1 ILE B 112 17.028 -3.785 -21.403 1.00 0.00 C ATOM 769 CG2 ILE B 112 19.375 -4.529 -21.884 1.00 0.00 C ATOM 770 CD1 ILE B 112 16.612 -2.389 -20.993 1.00 0.00 C ATOM 0 H ILE B 112 17.368 -4.178 -18.444 1.00 0.00 H new ATOM 0 HA ILE B 112 17.611 -6.229 -20.467 1.00 0.00 H new ATOM 0 HB ILE B 112 18.744 -3.418 -20.176 1.00 0.00 H new ATOM 0 HG12 ILE B 112 17.104 -3.828 -22.489 1.00 0.00 H new ATOM 0 HG13 ILE B 112 16.249 -4.489 -21.109 1.00 0.00 H new ATOM 0 HG21 ILE B 112 19.512 -3.644 -22.506 1.00 0.00 H new ATOM 0 HG22 ILE B 112 20.327 -4.804 -21.429 1.00 0.00 H new ATOM 0 HG23 ILE B 112 19.016 -5.353 -22.500 1.00 0.00 H new ATOM 0 HD11 ILE B 112 15.661 -2.140 -21.463 1.00 0.00 H new ATOM 0 HD12 ILE B 112 16.504 -2.345 -19.909 1.00 0.00 H new ATOM 0 HD13 ILE B 112 17.372 -1.675 -21.311 1.00 0.00 H new ATOM 782 N ASN B 113 20.147 -5.345 -18.532 1.00 0.00 N ATOM 783 CA ASN B 113 21.455 -5.766 -18.043 1.00 0.00 C ATOM 784 C ASN B 113 21.440 -7.240 -17.648 1.00 0.00 C ATOM 785 O ASN B 113 22.220 -8.041 -18.163 1.00 0.00 O ATOM 786 CB ASN B 113 21.876 -4.910 -16.847 1.00 0.00 C ATOM 787 CG ASN B 113 22.468 -3.579 -17.269 1.00 0.00 C ATOM 788 OD1 ASN B 113 22.013 -2.520 -16.837 1.00 0.00 O ATOM 789 ND2 ASN B 113 23.489 -3.627 -18.117 1.00 0.00 N ATOM 0 H ASN B 113 19.779 -4.507 -18.083 1.00 0.00 H new ATOM 0 HA ASN B 113 22.176 -5.632 -18.849 1.00 0.00 H new ATOM 0 HB2 ASN B 113 21.011 -4.734 -16.207 1.00 0.00 H new ATOM 0 HB3 ASN B 113 22.607 -5.457 -16.251 1.00 0.00 H new ATOM 0 HD21 ASN B 113 23.928 -2.763 -18.436 1.00 0.00 H new ATOM 0 HD22 ASN B 113 23.834 -4.527 -18.450 1.00 0.00 H new ATOM 796 N THR B 114 20.546 -7.591 -16.729 1.00 0.00 N ATOM 797 CA THR B 114 20.429 -8.967 -16.264 1.00 0.00 C ATOM 798 C THR B 114 20.118 -9.913 -17.418 1.00 0.00 C ATOM 799 O THR B 114 20.437 -11.101 -17.362 1.00 0.00 O ATOM 800 CB THR B 114 19.331 -9.106 -15.192 1.00 0.00 C ATOM 801 OG1 THR B 114 19.427 -10.385 -14.555 1.00 0.00 O ATOM 802 CG2 THR B 114 17.949 -8.944 -15.808 1.00 0.00 C ATOM 0 H THR B 114 19.892 -6.941 -16.292 1.00 0.00 H new ATOM 0 HA THR B 114 21.391 -9.235 -15.827 1.00 0.00 H new ATOM 0 HB THR B 114 19.476 -8.319 -14.451 1.00 0.00 H new ATOM 0 HG1 THR B 114 18.727 -10.465 -13.874 1.00 0.00 H new ATOM 0 HG21 THR B 114 17.190 -9.046 -15.032 1.00 0.00 H new ATOM 0 HG22 THR B 114 17.868 -7.959 -16.267 1.00 0.00 H new ATOM 0 HG23 THR B 114 17.797 -9.711 -16.567 1.00 0.00 H new ATOM 810 N SER B 115 19.496 -9.379 -18.464 1.00 0.00 N ATOM 811 CA SER B 115 19.140 -10.178 -19.631 1.00 0.00 C ATOM 812 C SER B 115 20.386 -10.573 -20.419 1.00 0.00 C ATOM 813 O SER B 115 20.712 -11.755 -20.534 1.00 0.00 O ATOM 814 CB SER B 115 18.178 -9.402 -20.532 1.00 0.00 C ATOM 815 OG SER B 115 17.307 -10.280 -21.224 1.00 0.00 O ATOM 0 H SER B 115 19.228 -8.397 -18.527 1.00 0.00 H new ATOM 0 HA SER B 115 18.648 -11.086 -19.283 1.00 0.00 H new ATOM 0 HB2 SER B 115 17.594 -8.705 -19.931 1.00 0.00 H new ATOM 0 HB3 SER B 115 18.745 -8.808 -21.249 1.00 0.00 H new ATOM 0 HG SER B 115 16.701 -9.759 -21.792 1.00 0.00 H new ATOM 821 N ILE B 116 21.077 -9.576 -20.960 1.00 0.00 N ATOM 822 CA ILE B 116 22.287 -9.818 -21.737 1.00 0.00 C ATOM 823 C ILE B 116 23.273 -10.685 -20.961 1.00 0.00 C ATOM 824 O ILE B 116 24.080 -11.405 -21.550 1.00 0.00 O ATOM 825 CB ILE B 116 22.978 -8.499 -22.129 1.00 0.00 C ATOM 826 CG1 ILE B 116 22.024 -7.619 -22.939 1.00 0.00 C ATOM 827 CG2 ILE B 116 24.247 -8.780 -22.918 1.00 0.00 C ATOM 828 CD1 ILE B 116 22.577 -6.243 -23.236 1.00 0.00 C ATOM 0 H ILE B 116 20.820 -8.593 -20.875 1.00 0.00 H new ATOM 0 HA ILE B 116 21.981 -10.341 -22.643 1.00 0.00 H new ATOM 0 HB ILE B 116 23.251 -7.964 -21.219 1.00 0.00 H new ATOM 0 HG12 ILE B 116 21.791 -8.119 -23.879 1.00 0.00 H new ATOM 0 HG13 ILE B 116 21.086 -7.515 -22.393 1.00 0.00 H new ATOM 0 HG21 ILE B 116 24.724 -7.838 -23.188 1.00 0.00 H new ATOM 0 HG22 ILE B 116 24.931 -9.371 -22.309 1.00 0.00 H new ATOM 0 HG23 ILE B 116 23.997 -9.333 -23.824 1.00 0.00 H new ATOM 0 HD11 ILE B 116 21.848 -5.674 -23.813 1.00 0.00 H new ATOM 0 HD12 ILE B 116 22.783 -5.724 -22.300 1.00 0.00 H new ATOM 0 HD13 ILE B 116 23.499 -6.337 -23.809 1.00 0.00 H new ATOM 840 N LEU B 117 23.201 -10.612 -19.637 1.00 0.00 N ATOM 841 CA LEU B 117 24.087 -11.392 -18.779 1.00 0.00 C ATOM 842 C LEU B 117 23.555 -12.809 -18.592 1.00 0.00 C ATOM 843 O LEU B 117 24.234 -13.786 -18.911 1.00 0.00 O ATOM 844 CB LEU B 117 24.242 -10.710 -17.418 1.00 0.00 C ATOM 845 CG LEU B 117 25.646 -10.213 -17.073 1.00 0.00 C ATOM 846 CD1 LEU B 117 25.617 -9.365 -15.811 1.00 0.00 C ATOM 847 CD2 LEU B 117 26.602 -11.385 -16.908 1.00 0.00 C ATOM 0 H LEU B 117 22.539 -10.021 -19.134 1.00 0.00 H new ATOM 0 HA LEU B 117 25.062 -11.450 -19.263 1.00 0.00 H new ATOM 0 HB2 LEU B 117 23.558 -9.862 -17.379 1.00 0.00 H new ATOM 0 HB3 LEU B 117 23.926 -11.410 -16.645 1.00 0.00 H new ATOM 0 HG LEU B 117 26.003 -9.593 -17.895 1.00 0.00 H new ATOM 0 HD11 LEU B 117 26.625 -9.020 -15.581 1.00 0.00 H new ATOM 0 HD12 LEU B 117 24.966 -8.505 -15.966 1.00 0.00 H new ATOM 0 HD13 LEU B 117 25.239 -9.961 -14.980 1.00 0.00 H new ATOM 0 HD21 LEU B 117 27.596 -11.012 -16.663 1.00 0.00 H new ATOM 0 HD22 LEU B 117 26.249 -12.032 -16.105 1.00 0.00 H new ATOM 0 HD23 LEU B 117 26.647 -11.952 -17.838 1.00 0.00 H new ATOM 859 N LEU B 118 22.335 -12.915 -18.076 1.00 0.00 N ATOM 860 CA LEU B 118 21.710 -14.213 -17.849 1.00 0.00 C ATOM 861 C LEU B 118 21.785 -15.080 -19.101 1.00 0.00 C ATOM 862 O LEU B 118 21.942 -16.298 -19.016 1.00 0.00 O ATOM 863 CB LEU B 118 20.251 -14.032 -17.426 1.00 0.00 C ATOM 864 CG LEU B 118 20.015 -13.696 -15.953 1.00 0.00 C ATOM 865 CD1 LEU B 118 18.535 -13.780 -15.617 1.00 0.00 C ATOM 866 CD2 LEU B 118 20.821 -14.627 -15.059 1.00 0.00 C ATOM 0 H LEU B 118 21.759 -12.117 -17.807 1.00 0.00 H new ATOM 0 HA LEU B 118 22.254 -14.715 -17.049 1.00 0.00 H new ATOM 0 HB2 LEU B 118 19.813 -13.240 -18.033 1.00 0.00 H new ATOM 0 HB3 LEU B 118 19.710 -14.949 -17.660 1.00 0.00 H new ATOM 0 HG LEU B 118 20.349 -12.674 -15.775 1.00 0.00 H new ATOM 0 HD11 LEU B 118 18.386 -13.538 -14.565 1.00 0.00 H new ATOM 0 HD12 LEU B 118 17.981 -13.072 -16.234 1.00 0.00 H new ATOM 0 HD13 LEU B 118 18.175 -14.790 -15.811 1.00 0.00 H new ATOM 0 HD21 LEU B 118 20.641 -14.374 -14.014 1.00 0.00 H new ATOM 0 HD22 LEU B 118 20.518 -15.658 -15.240 1.00 0.00 H new ATOM 0 HD23 LEU B 118 21.882 -14.517 -15.282 1.00 0.00 H new ATOM 878 N ILE B 119 21.673 -14.444 -20.262 1.00 0.00 N ATOM 879 CA ILE B 119 21.732 -15.157 -21.532 1.00 0.00 C ATOM 880 C ILE B 119 23.060 -15.890 -21.691 1.00 0.00 C ATOM 881 O ILE B 119 23.098 -17.118 -21.759 1.00 0.00 O ATOM 882 CB ILE B 119 21.541 -14.200 -22.724 1.00 0.00 C ATOM 883 CG1 ILE B 119 20.139 -13.588 -22.696 1.00 0.00 C ATOM 884 CG2 ILE B 119 21.777 -14.934 -24.036 1.00 0.00 C ATOM 885 CD1 ILE B 119 20.068 -12.210 -23.315 1.00 0.00 C ATOM 0 H ILE B 119 21.541 -13.436 -20.350 1.00 0.00 H new ATOM 0 HA ILE B 119 20.918 -15.882 -21.524 1.00 0.00 H new ATOM 0 HB ILE B 119 22.271 -13.394 -22.644 1.00 0.00 H new ATOM 0 HG12 ILE B 119 19.452 -14.250 -23.223 1.00 0.00 H new ATOM 0 HG13 ILE B 119 19.797 -13.531 -21.663 1.00 0.00 H new ATOM 0 HG21 ILE B 119 21.638 -14.244 -24.869 1.00 0.00 H new ATOM 0 HG22 ILE B 119 22.794 -15.327 -24.055 1.00 0.00 H new ATOM 0 HG23 ILE B 119 21.068 -15.757 -24.125 1.00 0.00 H new ATOM 0 HD11 ILE B 119 19.045 -11.839 -23.260 1.00 0.00 H new ATOM 0 HD12 ILE B 119 20.729 -11.533 -22.774 1.00 0.00 H new ATOM 0 HD13 ILE B 119 20.379 -12.263 -24.358 1.00 0.00 H new ATOM 897 N PHE B 120 24.147 -15.127 -21.747 1.00 0.00 N ATOM 898 CA PHE B 120 25.478 -15.704 -21.897 1.00 0.00 C ATOM 899 C PHE B 120 25.855 -16.527 -20.668 1.00 0.00 C ATOM 900 O PHE B 120 26.687 -17.432 -20.746 1.00 0.00 O ATOM 901 CB PHE B 120 26.513 -14.600 -22.122 1.00 0.00 C ATOM 902 CG PHE B 120 27.893 -15.121 -22.402 1.00 0.00 C ATOM 903 CD1 PHE B 120 28.149 -15.871 -23.538 1.00 0.00 C ATOM 904 CD2 PHE B 120 28.936 -14.860 -21.527 1.00 0.00 C ATOM 905 CE1 PHE B 120 29.418 -16.352 -23.798 1.00 0.00 C ATOM 906 CE2 PHE B 120 30.208 -15.338 -21.782 1.00 0.00 C ATOM 907 CZ PHE B 120 30.449 -16.085 -22.919 1.00 0.00 C ATOM 0 H PHE B 120 24.132 -14.109 -21.691 1.00 0.00 H new ATOM 0 HA PHE B 120 25.466 -16.363 -22.765 1.00 0.00 H new ATOM 0 HB2 PHE B 120 26.192 -13.977 -22.957 1.00 0.00 H new ATOM 0 HB3 PHE B 120 26.547 -13.960 -21.241 1.00 0.00 H new ATOM 0 HD1 PHE B 120 27.347 -16.083 -24.229 1.00 0.00 H new ATOM 0 HD2 PHE B 120 28.753 -14.277 -20.636 1.00 0.00 H new ATOM 0 HE1 PHE B 120 29.603 -16.936 -24.687 1.00 0.00 H new ATOM 0 HE2 PHE B 120 31.013 -15.128 -21.093 1.00 0.00 H new ATOM 0 HZ PHE B 120 31.442 -16.459 -23.120 1.00 0.00 H new ATOM 917 N ILE B 121 25.237 -16.206 -19.536 1.00 0.00 N ATOM 918 CA ILE B 121 25.508 -16.915 -18.292 1.00 0.00 C ATOM 919 C ILE B 121 24.917 -18.321 -18.321 1.00 0.00 C ATOM 920 O ILE B 121 25.577 -19.291 -17.948 1.00 0.00 O ATOM 921 CB ILE B 121 24.941 -16.157 -17.077 1.00 0.00 C ATOM 922 CG1 ILE B 121 25.978 -15.173 -16.533 1.00 0.00 C ATOM 923 CG2 ILE B 121 24.512 -17.136 -15.994 1.00 0.00 C ATOM 924 CD1 ILE B 121 25.407 -14.174 -15.551 1.00 0.00 C ATOM 0 H ILE B 121 24.546 -15.460 -19.455 1.00 0.00 H new ATOM 0 HA ILE B 121 26.592 -16.981 -18.196 1.00 0.00 H new ATOM 0 HB ILE B 121 24.065 -15.593 -17.396 1.00 0.00 H new ATOM 0 HG12 ILE B 121 26.777 -15.732 -16.047 1.00 0.00 H new ATOM 0 HG13 ILE B 121 26.428 -14.634 -17.367 1.00 0.00 H new ATOM 0 HG21 ILE B 121 24.114 -16.585 -15.142 1.00 0.00 H new ATOM 0 HG22 ILE B 121 23.743 -17.800 -16.388 1.00 0.00 H new ATOM 0 HG23 ILE B 121 25.372 -17.725 -15.675 1.00 0.00 H new ATOM 0 HD11 ILE B 121 26.199 -13.509 -15.207 1.00 0.00 H new ATOM 0 HD12 ILE B 121 24.628 -13.589 -16.039 1.00 0.00 H new ATOM 0 HD13 ILE B 121 24.982 -14.704 -14.698 1.00 0.00 H new ATOM 936 N PHE B 122 23.669 -18.423 -18.768 1.00 0.00 N ATOM 937 CA PHE B 122 22.989 -19.711 -18.846 1.00 0.00 C ATOM 938 C PHE B 122 23.464 -20.504 -20.060 1.00 0.00 C ATOM 939 O PHE B 122 23.843 -21.670 -19.943 1.00 0.00 O ATOM 940 CB PHE B 122 21.474 -19.507 -18.918 1.00 0.00 C ATOM 941 CG PHE B 122 20.895 -18.878 -17.683 1.00 0.00 C ATOM 942 CD1 PHE B 122 21.334 -19.257 -16.425 1.00 0.00 C ATOM 943 CD2 PHE B 122 19.911 -17.907 -17.780 1.00 0.00 C ATOM 944 CE1 PHE B 122 20.803 -18.680 -15.286 1.00 0.00 C ATOM 945 CE2 PHE B 122 19.377 -17.326 -16.646 1.00 0.00 C ATOM 946 CZ PHE B 122 19.823 -17.714 -15.397 1.00 0.00 C ATOM 0 H PHE B 122 23.109 -17.630 -19.081 1.00 0.00 H new ATOM 0 HA PHE B 122 23.231 -20.277 -17.947 1.00 0.00 H new ATOM 0 HB2 PHE B 122 21.240 -18.881 -19.779 1.00 0.00 H new ATOM 0 HB3 PHE B 122 20.993 -20.471 -19.085 1.00 0.00 H new ATOM 0 HD1 PHE B 122 22.100 -20.012 -16.333 1.00 0.00 H new ATOM 0 HD2 PHE B 122 19.557 -17.601 -18.753 1.00 0.00 H new ATOM 0 HE1 PHE B 122 21.154 -18.985 -14.311 1.00 0.00 H new ATOM 0 HE2 PHE B 122 18.612 -16.569 -16.736 1.00 0.00 H new ATOM 0 HZ PHE B 122 19.406 -17.262 -14.509 1.00 0.00 H new ATOM 956 N ILE B 123 23.441 -19.864 -21.224 1.00 0.00 N ATOM 957 CA ILE B 123 23.870 -20.508 -22.459 1.00 0.00 C ATOM 958 C ILE B 123 25.243 -21.152 -22.295 1.00 0.00 C ATOM 959 O ILE B 123 25.487 -22.253 -22.787 1.00 0.00 O ATOM 960 CB ILE B 123 23.921 -19.508 -23.628 1.00 0.00 C ATOM 961 CG1 ILE B 123 22.576 -19.472 -24.356 1.00 0.00 C ATOM 962 CG2 ILE B 123 25.041 -19.874 -24.591 1.00 0.00 C ATOM 963 CD1 ILE B 123 21.698 -18.310 -23.947 1.00 0.00 C ATOM 0 H ILE B 123 23.130 -18.899 -21.338 1.00 0.00 H new ATOM 0 HA ILE B 123 23.134 -21.279 -22.684 1.00 0.00 H new ATOM 0 HB ILE B 123 24.123 -18.515 -23.228 1.00 0.00 H new ATOM 0 HG12 ILE B 123 22.755 -19.421 -25.430 1.00 0.00 H new ATOM 0 HG13 ILE B 123 22.044 -20.404 -24.165 1.00 0.00 H new ATOM 0 HG21 ILE B 123 25.064 -19.157 -25.412 1.00 0.00 H new ATOM 0 HG22 ILE B 123 25.995 -19.853 -24.064 1.00 0.00 H new ATOM 0 HG23 ILE B 123 24.868 -20.874 -24.987 1.00 0.00 H new ATOM 0 HD11 ILE B 123 20.761 -18.348 -24.503 1.00 0.00 H new ATOM 0 HD12 ILE B 123 21.489 -18.370 -22.879 1.00 0.00 H new ATOM 0 HD13 ILE B 123 22.211 -17.373 -24.164 1.00 0.00 H new ATOM 975 N VAL B 124 26.137 -20.457 -21.598 1.00 0.00 N ATOM 976 CA VAL B 124 27.485 -20.961 -21.366 1.00 0.00 C ATOM 977 C VAL B 124 27.475 -22.122 -20.378 1.00 0.00 C ATOM 978 O VAL B 124 28.011 -23.195 -20.659 1.00 0.00 O ATOM 979 CB VAL B 124 28.414 -19.854 -20.831 1.00 0.00 C ATOM 980 CG1 VAL B 124 29.645 -20.461 -20.177 1.00 0.00 C ATOM 981 CG2 VAL B 124 28.808 -18.903 -21.951 1.00 0.00 C ATOM 0 H VAL B 124 25.952 -19.543 -21.184 1.00 0.00 H new ATOM 0 HA VAL B 124 27.863 -21.309 -22.327 1.00 0.00 H new ATOM 0 HB VAL B 124 27.875 -19.284 -20.075 1.00 0.00 H new ATOM 0 HG11 VAL B 124 30.290 -19.665 -19.805 1.00 0.00 H new ATOM 0 HG12 VAL B 124 29.339 -21.098 -19.347 1.00 0.00 H new ATOM 0 HG13 VAL B 124 30.190 -21.056 -20.910 1.00 0.00 H new ATOM 0 HG21 VAL B 124 29.464 -18.127 -21.556 1.00 0.00 H new ATOM 0 HG22 VAL B 124 29.330 -19.457 -22.732 1.00 0.00 H new ATOM 0 HG23 VAL B 124 27.913 -18.443 -22.369 1.00 0.00 H new ATOM 991 N LEU B 125 26.861 -21.902 -19.221 1.00 0.00 N ATOM 992 CA LEU B 125 26.780 -22.931 -18.190 1.00 0.00 C ATOM 993 C LEU B 125 26.115 -24.192 -18.731 1.00 0.00 C ATOM 994 O LEU B 125 26.461 -25.307 -18.336 1.00 0.00 O ATOM 995 CB LEU B 125 26.002 -22.409 -16.981 1.00 0.00 C ATOM 996 CG LEU B 125 26.761 -21.462 -16.051 1.00 0.00 C ATOM 997 CD1 LEU B 125 25.906 -21.093 -14.849 1.00 0.00 C ATOM 998 CD2 LEU B 125 28.072 -22.092 -15.603 1.00 0.00 C ATOM 0 H LEU B 125 26.412 -21.020 -18.973 1.00 0.00 H new ATOM 0 HA LEU B 125 27.795 -23.182 -17.881 1.00 0.00 H new ATOM 0 HB2 LEU B 125 25.111 -21.895 -17.342 1.00 0.00 H new ATOM 0 HB3 LEU B 125 25.662 -23.264 -16.397 1.00 0.00 H new ATOM 0 HG LEU B 125 26.989 -20.549 -16.601 1.00 0.00 H new ATOM 0 HD11 LEU B 125 26.464 -20.419 -14.199 1.00 0.00 H new ATOM 0 HD12 LEU B 125 24.995 -20.600 -15.188 1.00 0.00 H new ATOM 0 HD13 LEU B 125 25.645 -21.996 -14.297 1.00 0.00 H new ATOM 0 HD21 LEU B 125 28.599 -21.404 -14.942 1.00 0.00 H new ATOM 0 HD22 LEU B 125 27.866 -23.021 -15.071 1.00 0.00 H new ATOM 0 HD23 LEU B 125 28.691 -22.303 -16.475 1.00 0.00 H new ATOM 1010 N LEU B 126 25.162 -24.010 -19.637 1.00 0.00 N ATOM 1011 CA LEU B 126 24.449 -25.134 -20.235 1.00 0.00 C ATOM 1012 C LEU B 126 25.422 -26.105 -20.898 1.00 0.00 C ATOM 1013 O LEU B 126 25.319 -27.319 -20.721 1.00 0.00 O ATOM 1014 CB LEU B 126 23.434 -24.631 -21.262 1.00 0.00 C ATOM 1015 CG LEU B 126 22.999 -25.640 -22.326 1.00 0.00 C ATOM 1016 CD1 LEU B 126 22.249 -26.799 -21.688 1.00 0.00 C ATOM 1017 CD2 LEU B 126 22.139 -24.964 -23.384 1.00 0.00 C ATOM 0 H LEU B 126 24.864 -23.095 -19.974 1.00 0.00 H new ATOM 0 HA LEU B 126 23.922 -25.662 -19.441 1.00 0.00 H new ATOM 0 HB2 LEU B 126 22.546 -24.290 -20.729 1.00 0.00 H new ATOM 0 HB3 LEU B 126 23.857 -23.762 -21.766 1.00 0.00 H new ATOM 0 HG LEU B 126 23.892 -26.034 -22.811 1.00 0.00 H new ATOM 0 HD11 LEU B 126 21.947 -27.507 -22.460 1.00 0.00 H new ATOM 0 HD12 LEU B 126 22.897 -27.301 -20.970 1.00 0.00 H new ATOM 0 HD13 LEU B 126 21.364 -26.422 -21.176 1.00 0.00 H new ATOM 0 HD21 LEU B 126 21.839 -25.698 -24.132 1.00 0.00 H new ATOM 0 HD22 LEU B 126 21.251 -24.540 -22.915 1.00 0.00 H new ATOM 0 HD23 LEU B 126 22.710 -24.169 -23.864 1.00 0.00 H new ATOM 1029 N ILE B 127 26.366 -25.561 -21.658 1.00 0.00 N ATOM 1030 CA ILE B 127 27.359 -26.379 -22.344 1.00 0.00 C ATOM 1031 C ILE B 127 28.327 -27.014 -21.352 1.00 0.00 C ATOM 1032 O ILE B 127 28.543 -28.227 -21.368 1.00 0.00 O ATOM 1033 CB ILE B 127 28.159 -25.553 -23.368 1.00 0.00 C ATOM 1034 CG1 ILE B 127 27.473 -25.592 -24.735 1.00 0.00 C ATOM 1035 CG2 ILE B 127 29.585 -26.072 -23.470 1.00 0.00 C ATOM 1036 CD1 ILE B 127 26.567 -24.407 -24.991 1.00 0.00 C ATOM 0 H ILE B 127 26.464 -24.558 -21.814 1.00 0.00 H new ATOM 0 HA ILE B 127 26.814 -27.163 -22.869 1.00 0.00 H new ATOM 0 HB ILE B 127 28.194 -24.518 -23.029 1.00 0.00 H new ATOM 0 HG12 ILE B 127 28.235 -25.632 -25.514 1.00 0.00 H new ATOM 0 HG13 ILE B 127 26.889 -26.509 -24.813 1.00 0.00 H new ATOM 0 HG21 ILE B 127 30.137 -25.478 -24.198 1.00 0.00 H new ATOM 0 HG22 ILE B 127 30.070 -25.997 -22.497 1.00 0.00 H new ATOM 0 HG23 ILE B 127 29.571 -27.114 -23.789 1.00 0.00 H new ATOM 0 HD11 ILE B 127 26.115 -24.501 -25.978 1.00 0.00 H new ATOM 0 HD12 ILE B 127 25.783 -24.378 -24.234 1.00 0.00 H new ATOM 0 HD13 ILE B 127 27.150 -23.487 -24.945 1.00 0.00 H new ATOM 1048 N HIS B 128 28.909 -26.188 -20.488 1.00 0.00 N ATOM 1049 CA HIS B 128 29.853 -26.669 -19.486 1.00 0.00 C ATOM 1050 C HIS B 128 29.284 -27.870 -18.736 1.00 0.00 C ATOM 1051 O HIS B 128 30.024 -28.761 -18.319 1.00 0.00 O ATOM 1052 CB HIS B 128 30.196 -25.552 -18.500 1.00 0.00 C ATOM 1053 CG HIS B 128 31.053 -26.005 -17.358 1.00 0.00 C ATOM 1054 ND1 HIS B 128 30.557 -26.698 -16.273 1.00 0.00 N ATOM 1055 CD2 HIS B 128 32.380 -25.860 -17.135 1.00 0.00 C ATOM 1056 CE1 HIS B 128 31.542 -26.959 -15.433 1.00 0.00 C ATOM 1057 NE2 HIS B 128 32.659 -26.462 -15.933 1.00 0.00 N ATOM 0 H HIS B 128 28.743 -25.182 -20.462 1.00 0.00 H new ATOM 0 HA HIS B 128 30.762 -26.981 -19.999 1.00 0.00 H new ATOM 0 HB2 HIS B 128 30.709 -24.752 -19.034 1.00 0.00 H new ATOM 0 HB3 HIS B 128 29.272 -25.130 -18.105 1.00 0.00 H new ATOM 0 HD1 HIS B 128 29.582 -26.967 -16.140 1.00 0.00 H new ATOM 0 HD2 HIS B 128 33.088 -25.363 -17.782 1.00 0.00 H new ATOM 0 HE1 HIS B 128 31.450 -27.489 -14.496 1.00 0.00 H new ATOM 1065 N PHE B 129 27.966 -27.886 -18.568 1.00 0.00 N ATOM 1066 CA PHE B 129 27.299 -28.976 -17.866 1.00 0.00 C ATOM 1067 C PHE B 129 26.790 -30.025 -18.850 1.00 0.00 C ATOM 1068 O PHE B 129 26.622 -31.192 -18.497 1.00 0.00 O ATOM 1069 CB PHE B 129 26.135 -28.437 -17.031 1.00 0.00 C ATOM 1070 CG PHE B 129 26.554 -27.913 -15.687 1.00 0.00 C ATOM 1071 CD1 PHE B 129 27.119 -28.757 -14.745 1.00 0.00 C ATOM 1072 CD2 PHE B 129 26.382 -26.576 -15.366 1.00 0.00 C ATOM 1073 CE1 PHE B 129 27.505 -28.278 -13.508 1.00 0.00 C ATOM 1074 CE2 PHE B 129 26.767 -26.091 -14.131 1.00 0.00 C ATOM 1075 CZ PHE B 129 27.328 -26.943 -13.200 1.00 0.00 C ATOM 0 H PHE B 129 27.339 -27.157 -18.908 1.00 0.00 H new ATOM 0 HA PHE B 129 28.025 -29.446 -17.203 1.00 0.00 H new ATOM 0 HB2 PHE B 129 25.640 -27.639 -17.585 1.00 0.00 H new ATOM 0 HB3 PHE B 129 25.401 -29.231 -16.890 1.00 0.00 H new ATOM 0 HD1 PHE B 129 27.259 -29.802 -14.980 1.00 0.00 H new ATOM 0 HD2 PHE B 129 25.942 -25.906 -16.089 1.00 0.00 H new ATOM 0 HE1 PHE B 129 27.945 -28.946 -12.783 1.00 0.00 H new ATOM 0 HE2 PHE B 129 26.629 -25.046 -13.894 1.00 0.00 H new ATOM 0 HZ PHE B 129 27.628 -26.566 -12.233 1.00 0.00 H new ATOM 1085 N GLU B 130 26.546 -29.600 -20.086 1.00 0.00 N ATOM 1086 CA GLU B 130 26.055 -30.503 -21.121 1.00 0.00 C ATOM 1087 C GLU B 130 27.163 -31.437 -21.599 1.00 0.00 C ATOM 1088 O GLU B 130 26.953 -32.265 -22.484 1.00 0.00 O ATOM 1089 CB GLU B 130 25.500 -29.705 -22.303 1.00 0.00 C ATOM 1090 CG GLU B 130 24.005 -29.446 -22.213 1.00 0.00 C ATOM 1091 CD GLU B 130 23.180 -30.689 -22.480 1.00 0.00 C ATOM 1092 OE1 GLU B 130 23.777 -31.772 -22.655 1.00 0.00 O ATOM 1093 OE2 GLU B 130 21.936 -30.580 -22.514 1.00 0.00 O ATOM 0 H GLU B 130 26.680 -28.637 -20.395 1.00 0.00 H new ATOM 0 HA GLU B 130 25.255 -31.107 -20.691 1.00 0.00 H new ATOM 0 HB2 GLU B 130 26.023 -28.750 -22.364 1.00 0.00 H new ATOM 0 HB3 GLU B 130 25.712 -30.244 -23.226 1.00 0.00 H new ATOM 0 HG2 GLU B 130 23.766 -29.062 -21.221 1.00 0.00 H new ATOM 0 HG3 GLU B 130 23.731 -28.672 -22.929 1.00 0.00 H new ATOM 1100 N GLY B 131 28.345 -31.296 -21.005 1.00 0.00 N ATOM 1101 CA GLY B 131 29.469 -32.132 -21.384 1.00 0.00 C ATOM 1102 C GLY B 131 30.692 -31.322 -21.764 1.00 0.00 C ATOM 1103 O GLY B 131 31.301 -31.557 -22.807 1.00 0.00 O ATOM 0 H GLY B 131 28.544 -30.618 -20.269 1.00 0.00 H new ATOM 0 HA2 GLY B 131 29.719 -32.796 -20.556 1.00 0.00 H new ATOM 0 HA3 GLY B 131 29.181 -32.764 -22.224 1.00 0.00 H new ATOM 1107 N TRP B 132 31.052 -30.364 -20.917 1.00 0.00 N ATOM 1108 CA TRP B 132 32.210 -29.515 -21.171 1.00 0.00 C ATOM 1109 C TRP B 132 32.888 -29.114 -19.865 1.00 0.00 C ATOM 1110 O TRP B 132 32.628 -28.038 -19.325 1.00 0.00 O ATOM 1111 CB TRP B 132 31.791 -28.265 -21.947 1.00 0.00 C ATOM 1112 CG TRP B 132 32.301 -28.243 -23.356 1.00 0.00 C ATOM 1113 CD1 TRP B 132 31.904 -29.049 -24.384 1.00 0.00 C ATOM 1114 CD2 TRP B 132 33.304 -27.372 -23.891 1.00 0.00 C ATOM 1115 NE1 TRP B 132 32.600 -28.732 -25.526 1.00 0.00 N ATOM 1116 CE2 TRP B 132 33.464 -27.705 -25.250 1.00 0.00 C ATOM 1117 CE3 TRP B 132 34.080 -26.341 -23.355 1.00 0.00 C ATOM 1118 CZ2 TRP B 132 34.369 -27.045 -26.077 1.00 0.00 C ATOM 1119 CZ3 TRP B 132 34.978 -25.687 -24.177 1.00 0.00 C ATOM 1120 CH2 TRP B 132 35.116 -26.040 -25.526 1.00 0.00 C ATOM 0 H TRP B 132 30.559 -30.156 -20.049 1.00 0.00 H new ATOM 0 HA TRP B 132 32.922 -30.084 -21.769 1.00 0.00 H new ATOM 0 HB2 TRP B 132 30.703 -28.202 -21.961 1.00 0.00 H new ATOM 0 HB3 TRP B 132 32.155 -27.381 -21.423 1.00 0.00 H new ATOM 0 HD1 TRP B 132 31.153 -29.822 -24.311 1.00 0.00 H new ATOM 0 HE1 TRP B 132 32.491 -29.187 -26.432 1.00 0.00 H new ATOM 0 HE3 TRP B 132 33.980 -26.060 -22.317 1.00 0.00 H new ATOM 0 HZ2 TRP B 132 34.477 -27.317 -27.117 1.00 0.00 H new ATOM 0 HZ3 TRP B 132 35.584 -24.890 -23.773 1.00 0.00 H new ATOM 0 HH2 TRP B 132 35.826 -25.508 -26.143 1.00 0.00 H new ATOM 1131 N ARG B 133 33.757 -29.985 -19.363 1.00 0.00 N ATOM 1132 CA ARG B 133 34.472 -29.721 -18.120 1.00 0.00 C ATOM 1133 C ARG B 133 35.839 -30.398 -18.124 1.00 0.00 C ATOM 1134 O ARG B 133 36.033 -31.432 -17.485 1.00 0.00 O ATOM 1135 CB ARG B 133 33.653 -30.209 -16.923 1.00 0.00 C ATOM 1136 CG ARG B 133 33.993 -29.499 -15.623 1.00 0.00 C ATOM 1137 CD ARG B 133 35.228 -30.097 -14.968 1.00 0.00 C ATOM 1138 NE ARG B 133 35.030 -31.496 -14.600 1.00 0.00 N ATOM 1139 CZ ARG B 133 34.346 -31.885 -13.529 1.00 0.00 C ATOM 1140 NH1 ARG B 133 33.798 -30.983 -12.726 1.00 0.00 N ATOM 1141 NH2 ARG B 133 34.209 -33.177 -13.260 1.00 0.00 N ATOM 0 H ARG B 133 33.983 -30.880 -19.798 1.00 0.00 H new ATOM 0 HA ARG B 133 34.620 -28.644 -18.037 1.00 0.00 H new ATOM 0 HB2 ARG B 133 32.593 -30.069 -17.137 1.00 0.00 H new ATOM 0 HB3 ARG B 133 33.814 -31.279 -16.795 1.00 0.00 H new ATOM 0 HG2 ARG B 133 34.160 -28.440 -15.819 1.00 0.00 H new ATOM 0 HG3 ARG B 133 33.148 -29.567 -14.938 1.00 0.00 H new ATOM 0 HD2 ARG B 133 36.074 -30.018 -15.650 1.00 0.00 H new ATOM 0 HD3 ARG B 133 35.481 -29.521 -14.078 1.00 0.00 H new ATOM 0 HE ARG B 133 35.439 -32.214 -15.198 1.00 0.00 H new ATOM 0 HH11 ARG B 133 33.901 -29.989 -12.930 1.00 0.00 H new ATOM 0 HH12 ARG B 133 33.273 -31.283 -11.904 1.00 0.00 H new ATOM 0 HH21 ARG B 133 34.629 -33.873 -13.876 1.00 0.00 H new ATOM 0 HH22 ARG B 133 33.684 -33.474 -12.438 1.00 0.00 H new ATOM 1155 N ILE B 134 36.783 -29.807 -18.850 1.00 0.00 N ATOM 1156 CA ILE B 134 38.132 -30.353 -18.937 1.00 0.00 C ATOM 1157 C ILE B 134 38.718 -30.594 -17.550 1.00 0.00 C ATOM 1158 O ILE B 134 38.702 -29.708 -16.695 1.00 0.00 O ATOM 1159 CB ILE B 134 39.068 -29.416 -19.722 1.00 0.00 C ATOM 1160 CG1 ILE B 134 38.533 -29.194 -21.139 1.00 0.00 C ATOM 1161 CG2 ILE B 134 40.477 -29.990 -19.766 1.00 0.00 C ATOM 1162 CD1 ILE B 134 39.201 -28.047 -21.864 1.00 0.00 C ATOM 0 H ILE B 134 36.638 -28.951 -19.386 1.00 0.00 H new ATOM 0 HA ILE B 134 38.055 -31.303 -19.466 1.00 0.00 H new ATOM 0 HB ILE B 134 39.104 -28.453 -19.213 1.00 0.00 H new ATOM 0 HG12 ILE B 134 38.670 -30.108 -21.718 1.00 0.00 H new ATOM 0 HG13 ILE B 134 37.461 -29.006 -21.088 1.00 0.00 H new ATOM 0 HG21 ILE B 134 41.127 -29.316 -20.324 1.00 0.00 H new ATOM 0 HG22 ILE B 134 40.856 -30.101 -18.750 1.00 0.00 H new ATOM 0 HG23 ILE B 134 40.458 -30.964 -20.255 1.00 0.00 H new ATOM 0 HD11 ILE B 134 38.772 -27.948 -22.861 1.00 0.00 H new ATOM 0 HD12 ILE B 134 39.043 -27.123 -21.308 1.00 0.00 H new ATOM 0 HD13 ILE B 134 40.270 -28.242 -21.946 1.00 0.00 H new TER 1174 ILE B 134