USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 935 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 61 THR OG1 : rot -84:sc= -0.173 USER MOD Set 1.2: A 105 THR OG1 : rot 180:sc= 0.0461 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0481 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.845 USER MOD Single : A 21 THR OG1 : rot 132:sc= -0.316 USER MOD Single : A 27 THR OG1 : rot 156:sc= 0.24 USER MOD Single : A 28 SER OG : rot 63:sc= 1.02 USER MOD Single : A 29 THR OG1 : rot -36:sc= 0.854 USER MOD Single : A 40 SER OG : rot 45:sc= -2.18! USER MOD Single : A 42 GLN :FLIP amide:sc= -0.775 F(o=-1.6,f=-0.77) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -2.09! C(o=-2.1!,f=-2.9!) USER MOD Single : A 58 THR OG1 : rot 103:sc= 0.163 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.00767 USER MOD Single : A 60 TYR OH : rot 30:sc= -1.44! USER MOD Single : A 64 TYR OH : rot 180:sc= -0.563 USER MOD Single : A 65 THR OG1 : rot -174:sc= -2.51! USER MOD Single : A 67 THR OG1 : rot 170:sc= -1.93! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -6.2! C(o=-6.2!,f=-18!) USER MOD Single : A 81 ASN :FLIP amide:sc= -0.661 F(o=-1.4,f=-0.66) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.453 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.34 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0.014 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.191 USER MOD Single : A 112 TYR OH : rot 13:sc= -4.67! USER MOD Single : A 124 GLN : amide:sc= -3.69 K(o=-3.7,f=-12!) USER MOD Single : A 128 GLN : amide:sc= -0.483 X(o=-0.48,f=-0.3) USER MOD Single : A 133 SER OG : rot -126:sc= -0.381! USER MOD Single : A 138 THR OG1 : rot -93:sc= -1.46! USER MOD Single : A 148 SER OG : rot 10:sc= 0.543! USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -9.420 5.988 7.982 1.00 0.00 N ATOM 25 CA PRO A 3 -8.534 5.538 6.884 1.00 0.00 C ATOM 26 C PRO A 3 -7.175 5.111 7.447 1.00 0.00 C ATOM 27 O PRO A 3 -7.057 4.748 8.600 1.00 0.00 O ATOM 28 CB PRO A 3 -8.402 6.780 6.004 1.00 0.00 C ATOM 29 CG PRO A 3 -8.660 7.937 6.914 1.00 0.00 C ATOM 30 CD PRO A 3 -9.549 7.447 8.027 1.00 0.00 C ATOM 0 HA PRO A 3 -8.919 4.678 6.337 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.409 6.843 5.559 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.118 6.758 5.183 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -7.724 8.326 7.314 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.139 8.752 6.372 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -9.233 7.844 8.992 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.582 7.759 7.877 1.00 0.00 H new ATOM 38 N ILE A 4 -6.149 5.153 6.644 1.00 0.00 N ATOM 39 CA ILE A 4 -4.799 4.750 7.134 1.00 0.00 C ATOM 40 C ILE A 4 -4.066 5.963 7.713 1.00 0.00 C ATOM 41 O ILE A 4 -3.314 5.852 8.661 1.00 0.00 O ATOM 42 CB ILE A 4 -4.069 4.224 5.899 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.776 5.387 4.948 1.00 0.00 C ATOM 44 CG2 ILE A 4 -4.946 3.193 5.186 1.00 0.00 C ATOM 45 CD1 ILE A 4 -2.933 4.888 3.773 1.00 0.00 C ATOM 0 H ILE A 4 -6.186 5.449 5.669 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.853 4.001 7.925 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.133 3.756 6.203 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.709 5.816 4.583 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.247 6.179 5.478 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.424 2.818 4.305 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.157 2.365 5.862 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.883 3.660 4.882 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.725 5.717 3.096 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.994 4.480 4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.479 4.111 3.238 1.00 0.00 H new ATOM 57 N GLY A 5 -4.280 7.120 7.149 1.00 0.00 N ATOM 58 CA GLY A 5 -3.596 8.340 7.664 1.00 0.00 C ATOM 59 C GLY A 5 -4.159 9.576 6.962 1.00 0.00 C ATOM 60 O GLY A 5 -5.337 9.863 7.039 1.00 0.00 O ATOM 0 H GLY A 5 -4.899 7.273 6.353 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -3.740 8.423 8.741 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -2.522 8.268 7.491 1.00 0.00 H new ATOM 64 N GLU A 6 -3.327 10.311 6.275 1.00 0.00 N ATOM 65 CA GLU A 6 -3.818 11.529 5.568 1.00 0.00 C ATOM 66 C GLU A 6 -2.656 12.240 4.868 1.00 0.00 C ATOM 67 O GLU A 6 -2.648 13.447 4.729 1.00 0.00 O ATOM 68 CB GLU A 6 -4.403 12.417 6.666 1.00 0.00 C ATOM 69 CG GLU A 6 -5.658 13.118 6.142 1.00 0.00 C ATOM 70 CD GLU A 6 -6.649 13.318 7.290 1.00 0.00 C ATOM 71 OE1 GLU A 6 -6.498 12.650 8.299 1.00 0.00 O ATOM 72 OE2 GLU A 6 -7.542 14.135 7.140 1.00 0.00 O ATOM 0 H GLU A 6 -2.330 10.121 6.173 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.554 11.290 4.800 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -4.648 11.816 7.542 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.666 13.156 6.982 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.394 14.081 5.704 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -6.116 12.523 5.352 1.00 0.00 H new ATOM 79 N GLY A 7 -1.675 11.501 4.425 1.00 0.00 N ATOM 80 CA GLY A 7 -0.518 12.137 3.735 1.00 0.00 C ATOM 81 C GLY A 7 0.706 11.227 3.840 1.00 0.00 C ATOM 82 O GLY A 7 0.716 10.124 3.332 1.00 0.00 O ATOM 0 H GLY A 7 -1.625 10.486 4.511 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.761 12.317 2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.302 13.107 4.184 1.00 0.00 H new ATOM 86 N THR A 8 1.740 11.680 4.495 1.00 0.00 N ATOM 87 CA THR A 8 2.963 10.840 4.630 1.00 0.00 C ATOM 88 C THR A 8 3.093 10.331 6.066 1.00 0.00 C ATOM 89 O THR A 8 2.409 10.788 6.961 1.00 0.00 O ATOM 90 CB THR A 8 4.136 11.768 4.290 1.00 0.00 C ATOM 91 OG1 THR A 8 4.470 12.540 5.434 1.00 0.00 O ATOM 92 CG2 THR A 8 3.753 12.702 3.138 1.00 0.00 C ATOM 0 H THR A 8 1.790 12.595 4.942 1.00 0.00 H new ATOM 0 HA THR A 8 2.933 9.968 3.976 1.00 0.00 H new ATOM 0 HB THR A 8 4.992 11.165 3.988 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.220 13.133 5.221 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.593 13.356 2.905 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.500 12.110 2.259 1.00 0.00 H new ATOM 0 HG23 THR A 8 2.893 13.305 3.429 1.00 0.00 H new ATOM 100 N PHE A 9 3.973 9.398 6.297 1.00 0.00 N ATOM 101 CA PHE A 9 4.153 8.872 7.678 1.00 0.00 C ATOM 102 C PHE A 9 4.807 9.950 8.546 1.00 0.00 C ATOM 103 O PHE A 9 4.529 10.073 9.722 1.00 0.00 O ATOM 104 CB PHE A 9 5.077 7.663 7.523 1.00 0.00 C ATOM 105 CG PHE A 9 4.559 6.769 6.419 1.00 0.00 C ATOM 106 CD1 PHE A 9 3.215 6.373 6.409 1.00 0.00 C ATOM 107 CD2 PHE A 9 5.422 6.335 5.406 1.00 0.00 C ATOM 108 CE1 PHE A 9 2.736 5.545 5.386 1.00 0.00 C ATOM 109 CE2 PHE A 9 4.943 5.507 4.384 1.00 0.00 C ATOM 110 CZ PHE A 9 3.600 5.112 4.374 1.00 0.00 C ATOM 0 H PHE A 9 4.575 8.977 5.590 1.00 0.00 H new ATOM 0 HA PHE A 9 3.213 8.596 8.155 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.090 7.993 7.292 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.128 7.109 8.460 1.00 0.00 H new ATOM 0 HD1 PHE A 9 2.548 6.706 7.190 1.00 0.00 H new ATOM 0 HD2 PHE A 9 6.458 6.639 5.413 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.700 5.241 5.378 1.00 0.00 H new ATOM 0 HE2 PHE A 9 5.610 5.173 3.603 1.00 0.00 H new ATOM 0 HZ PHE A 9 3.231 4.473 3.585 1.00 0.00 H new ATOM 120 N ASP A 10 5.667 10.738 7.957 1.00 0.00 N ATOM 121 CA ASP A 10 6.349 11.830 8.715 1.00 0.00 C ATOM 122 C ASP A 10 6.677 11.395 10.149 1.00 0.00 C ATOM 123 O ASP A 10 6.766 12.215 11.042 1.00 0.00 O ATOM 124 CB ASP A 10 5.341 12.980 8.717 1.00 0.00 C ATOM 125 CG ASP A 10 5.864 14.122 9.591 1.00 0.00 C ATOM 126 OD1 ASP A 10 6.970 14.574 9.342 1.00 0.00 O ATOM 127 OD2 ASP A 10 5.150 14.526 10.494 1.00 0.00 O ATOM 0 H ASP A 10 5.929 10.672 6.973 1.00 0.00 H new ATOM 0 HA ASP A 10 7.301 12.107 8.262 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.176 13.334 7.699 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.379 12.632 9.093 1.00 0.00 H new ATOM 132 N ASP A 11 6.870 10.117 10.375 1.00 0.00 N ATOM 133 CA ASP A 11 7.200 9.626 11.753 1.00 0.00 C ATOM 134 C ASP A 11 6.923 8.126 11.859 1.00 0.00 C ATOM 135 O ASP A 11 7.821 7.325 12.022 1.00 0.00 O ATOM 136 CB ASP A 11 6.274 10.388 12.707 1.00 0.00 C ATOM 137 CG ASP A 11 7.093 11.390 13.523 1.00 0.00 C ATOM 138 OD1 ASP A 11 8.246 11.598 13.185 1.00 0.00 O ATOM 139 OD2 ASP A 11 6.552 11.932 14.473 1.00 0.00 O ATOM 0 H ASP A 11 6.813 9.390 9.662 1.00 0.00 H new ATOM 0 HA ASP A 11 8.251 9.789 11.990 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.501 10.909 12.142 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.766 9.690 13.373 1.00 0.00 H new ATOM 144 N GLY A 12 5.681 7.746 11.772 1.00 0.00 N ATOM 145 CA GLY A 12 5.332 6.302 11.871 1.00 0.00 C ATOM 146 C GLY A 12 4.583 5.870 10.611 1.00 0.00 C ATOM 147 O GLY A 12 3.832 6.636 10.040 1.00 0.00 O ATOM 0 H GLY A 12 4.889 8.375 11.636 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.237 5.706 11.991 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.715 6.126 12.752 1.00 0.00 H new ATOM 151 N PRO A 13 4.817 4.649 10.220 1.00 0.00 N ATOM 152 CA PRO A 13 4.163 4.094 9.011 1.00 0.00 C ATOM 153 C PRO A 13 2.700 3.738 9.298 1.00 0.00 C ATOM 154 O PRO A 13 2.013 3.187 8.463 1.00 0.00 O ATOM 155 CB PRO A 13 4.977 2.841 8.711 1.00 0.00 C ATOM 156 CG PRO A 13 5.575 2.435 10.022 1.00 0.00 C ATOM 157 CD PRO A 13 5.709 3.679 10.863 1.00 0.00 C ATOM 0 HA PRO A 13 4.141 4.797 8.178 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.346 2.050 8.305 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.752 3.043 7.971 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.942 1.701 10.521 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.548 1.967 9.871 1.00 0.00 H new ATOM 0 HD2 PRO A 13 5.416 3.494 11.897 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.738 4.037 10.882 1.00 0.00 H new ATOM 165 N GLU A 14 2.219 4.049 10.472 1.00 0.00 N ATOM 166 CA GLU A 14 0.801 3.729 10.813 1.00 0.00 C ATOM 167 C GLU A 14 0.603 2.213 10.902 1.00 0.00 C ATOM 168 O GLU A 14 0.663 1.634 11.968 1.00 0.00 O ATOM 169 CB GLU A 14 -0.035 4.324 9.676 1.00 0.00 C ATOM 170 CG GLU A 14 -0.877 5.482 10.216 1.00 0.00 C ATOM 171 CD GLU A 14 -2.168 4.933 10.827 1.00 0.00 C ATOM 172 OE1 GLU A 14 -2.758 4.053 10.223 1.00 0.00 O ATOM 173 OE2 GLU A 14 -2.544 5.403 11.888 1.00 0.00 O ATOM 0 H GLU A 14 2.748 4.512 11.211 1.00 0.00 H new ATOM 0 HA GLU A 14 0.510 4.139 11.780 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.617 4.676 8.876 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.682 3.559 9.247 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.314 6.036 10.967 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.111 6.181 9.413 1.00 0.00 H new ATOM 180 N GLY A 15 0.364 1.565 9.795 1.00 0.00 N ATOM 181 CA GLY A 15 0.160 0.088 9.831 1.00 0.00 C ATOM 182 C GLY A 15 0.895 -0.570 8.660 1.00 0.00 C ATOM 183 O GLY A 15 0.800 -1.762 8.450 1.00 0.00 O ATOM 0 H GLY A 15 0.301 1.992 8.871 1.00 0.00 H new ATOM 0 HA2 GLY A 15 0.527 -0.315 10.775 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -0.904 -0.142 9.779 1.00 0.00 H new ATOM 187 N TRP A 16 1.627 0.194 7.895 1.00 0.00 N ATOM 188 CA TRP A 16 2.363 -0.398 6.741 1.00 0.00 C ATOM 189 C TRP A 16 3.376 -1.432 7.238 1.00 0.00 C ATOM 190 O TRP A 16 4.523 -1.119 7.487 1.00 0.00 O ATOM 191 CB TRP A 16 3.082 0.780 6.081 1.00 0.00 C ATOM 192 CG TRP A 16 2.169 1.437 5.097 1.00 0.00 C ATOM 193 CD1 TRP A 16 1.452 2.560 5.333 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.865 1.036 3.730 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.724 2.871 4.199 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.946 1.962 3.184 1.00 0.00 C ATOM 197 CE3 TRP A 16 2.292 -0.031 2.920 1.00 0.00 C ATOM 198 CZ2 TRP A 16 0.467 1.834 1.880 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.812 -0.163 1.606 1.00 0.00 C ATOM 200 CH2 TRP A 16 0.901 0.769 1.088 1.00 0.00 C ATOM 0 H TRP A 16 1.747 1.199 8.018 1.00 0.00 H new ATOM 0 HA TRP A 16 1.698 -0.910 6.046 1.00 0.00 H new ATOM 0 HB2 TRP A 16 3.395 1.499 6.838 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.985 0.433 5.579 1.00 0.00 H new ATOM 0 HD1 TRP A 16 1.449 3.121 6.256 1.00 0.00 H new ATOM 0 HE1 TRP A 16 0.099 3.674 4.122 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.993 -0.754 3.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.235 2.554 1.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 2.146 -0.986 0.992 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.535 0.663 0.077 1.00 0.00 H new ATOM 211 N VAL A 17 2.963 -2.660 7.386 1.00 0.00 N ATOM 212 CA VAL A 17 3.907 -3.709 7.871 1.00 0.00 C ATOM 213 C VAL A 17 4.558 -4.418 6.680 1.00 0.00 C ATOM 214 O VAL A 17 4.076 -4.349 5.569 1.00 0.00 O ATOM 215 CB VAL A 17 3.055 -4.693 8.695 1.00 0.00 C ATOM 216 CG1 VAL A 17 1.952 -3.934 9.442 1.00 0.00 C ATOM 217 CG2 VAL A 17 2.413 -5.740 7.773 1.00 0.00 C ATOM 0 H VAL A 17 2.015 -2.983 7.193 1.00 0.00 H new ATOM 0 HA VAL A 17 4.712 -3.287 8.472 1.00 0.00 H new ATOM 0 HB VAL A 17 3.703 -5.194 9.414 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.355 -4.638 10.022 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.404 -3.203 10.112 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.313 -3.421 8.724 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.814 -6.430 8.367 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.775 -5.240 7.044 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.194 -6.294 7.252 1.00 0.00 H new ATOM 227 N ALA A 18 5.638 -5.108 6.909 1.00 0.00 N ATOM 228 CA ALA A 18 6.313 -5.836 5.798 1.00 0.00 C ATOM 229 C ALA A 18 6.854 -7.169 6.322 1.00 0.00 C ATOM 230 O ALA A 18 7.506 -7.225 7.346 1.00 0.00 O ATOM 231 CB ALA A 18 7.446 -4.913 5.347 1.00 0.00 C ATOM 0 H ALA A 18 6.085 -5.200 7.821 1.00 0.00 H new ATOM 0 HA ALA A 18 5.643 -6.067 4.970 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.992 -5.381 4.528 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.030 -3.964 5.010 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.125 -4.736 6.181 1.00 0.00 H new ATOM 237 N TYR A 19 6.563 -8.248 5.647 1.00 0.00 N ATOM 238 CA TYR A 19 7.034 -9.580 6.131 1.00 0.00 C ATOM 239 C TYR A 19 7.972 -10.244 5.115 1.00 0.00 C ATOM 240 O TYR A 19 7.944 -9.947 3.936 1.00 0.00 O ATOM 241 CB TYR A 19 5.754 -10.401 6.291 1.00 0.00 C ATOM 242 CG TYR A 19 4.889 -10.227 5.063 1.00 0.00 C ATOM 243 CD1 TYR A 19 5.227 -10.886 3.876 1.00 0.00 C ATOM 244 CD2 TYR A 19 3.753 -9.407 5.110 1.00 0.00 C ATOM 245 CE1 TYR A 19 4.431 -10.728 2.735 1.00 0.00 C ATOM 246 CE2 TYR A 19 2.958 -9.250 3.969 1.00 0.00 C ATOM 247 CZ TYR A 19 3.297 -9.910 2.782 1.00 0.00 C ATOM 248 OH TYR A 19 2.512 -9.755 1.657 1.00 0.00 O ATOM 0 H TYR A 19 6.021 -8.266 4.783 1.00 0.00 H new ATOM 0 HA TYR A 19 7.602 -9.498 7.057 1.00 0.00 H new ATOM 0 HB2 TYR A 19 5.999 -11.454 6.430 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.211 -10.080 7.180 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.103 -11.517 3.840 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.492 -8.897 6.025 1.00 0.00 H new ATOM 0 HE1 TYR A 19 4.692 -11.237 1.819 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.082 -8.619 4.004 1.00 0.00 H new ATOM 0 HH TYR A 19 1.764 -9.156 1.860 1.00 0.00 H new ATOM 258 N GLY A 20 8.798 -11.151 5.575 1.00 0.00 N ATOM 259 CA GLY A 20 9.742 -11.854 4.657 1.00 0.00 C ATOM 260 C GLY A 20 10.890 -10.915 4.279 1.00 0.00 C ATOM 261 O GLY A 20 11.313 -10.868 3.142 1.00 0.00 O ATOM 0 H GLY A 20 8.858 -11.435 6.553 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.135 -12.749 5.140 1.00 0.00 H new ATOM 0 HA3 GLY A 20 9.216 -12.181 3.760 1.00 0.00 H new ATOM 265 N THR A 21 11.398 -10.166 5.220 1.00 0.00 N ATOM 266 CA THR A 21 12.521 -9.235 4.900 1.00 0.00 C ATOM 267 C THR A 21 13.683 -9.444 5.873 1.00 0.00 C ATOM 268 O THR A 21 13.857 -10.509 6.432 1.00 0.00 O ATOM 269 CB THR A 21 11.948 -7.825 5.064 1.00 0.00 C ATOM 270 OG1 THR A 21 11.814 -7.529 6.447 1.00 0.00 O ATOM 271 CG2 THR A 21 10.580 -7.732 4.387 1.00 0.00 C ATOM 0 H THR A 21 11.087 -10.157 6.191 1.00 0.00 H new ATOM 0 HA THR A 21 12.906 -9.404 3.894 1.00 0.00 H new ATOM 0 HB THR A 21 12.624 -7.108 4.598 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.194 -6.645 6.631 1.00 0.00 H new ATOM 0 HG21 THR A 21 10.181 -6.725 4.509 1.00 0.00 H new ATOM 0 HG22 THR A 21 10.684 -7.955 3.325 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.899 -8.450 4.843 1.00 0.00 H new ATOM 279 N ASP A 22 14.480 -8.430 6.078 1.00 0.00 N ATOM 280 CA ASP A 22 15.633 -8.558 7.014 1.00 0.00 C ATOM 281 C ASP A 22 15.290 -7.921 8.362 1.00 0.00 C ATOM 282 O ASP A 22 16.119 -7.296 8.994 1.00 0.00 O ATOM 283 CB ASP A 22 16.775 -7.798 6.338 1.00 0.00 C ATOM 284 CG ASP A 22 18.104 -8.486 6.654 1.00 0.00 C ATOM 285 OD1 ASP A 22 18.260 -8.944 7.775 1.00 0.00 O ATOM 286 OD2 ASP A 22 18.944 -8.544 5.771 1.00 0.00 O ATOM 0 H ASP A 22 14.381 -7.516 5.636 1.00 0.00 H new ATOM 0 HA ASP A 22 15.894 -9.598 7.211 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.617 -7.767 5.260 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.796 -6.766 6.687 1.00 0.00 H new ATOM 291 N GLY A 23 14.074 -8.074 8.807 1.00 0.00 N ATOM 292 CA GLY A 23 13.677 -7.477 10.113 1.00 0.00 C ATOM 293 C GLY A 23 12.451 -6.583 9.915 1.00 0.00 C ATOM 294 O GLY A 23 11.895 -6.520 8.837 1.00 0.00 O ATOM 0 H GLY A 23 13.337 -8.587 8.323 1.00 0.00 H new ATOM 0 HA2 GLY A 23 13.453 -8.265 10.832 1.00 0.00 H new ATOM 0 HA3 GLY A 23 14.502 -6.895 10.524 1.00 0.00 H new ATOM 298 N PRO A 24 12.071 -5.920 10.973 1.00 0.00 N ATOM 299 CA PRO A 24 10.896 -5.016 10.926 1.00 0.00 C ATOM 300 C PRO A 24 11.231 -3.736 10.155 1.00 0.00 C ATOM 301 O PRO A 24 12.268 -3.133 10.353 1.00 0.00 O ATOM 302 CB PRO A 24 10.623 -4.709 12.395 1.00 0.00 C ATOM 303 CG PRO A 24 11.935 -4.912 13.085 1.00 0.00 C ATOM 304 CD PRO A 24 12.695 -5.950 12.300 1.00 0.00 C ATOM 0 HA PRO A 24 10.038 -5.457 10.419 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.263 -3.688 12.524 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.858 -5.371 12.801 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.495 -3.978 13.130 1.00 0.00 H new ATOM 0 HG3 PRO A 24 11.782 -5.242 14.113 1.00 0.00 H new ATOM 0 HD2 PRO A 24 13.757 -5.711 12.247 1.00 0.00 H new ATOM 0 HD3 PRO A 24 12.612 -6.936 12.758 1.00 0.00 H new ATOM 312 N LEU A 25 10.360 -3.315 9.279 1.00 0.00 N ATOM 313 CA LEU A 25 10.625 -2.073 8.496 1.00 0.00 C ATOM 314 C LEU A 25 11.052 -0.939 9.433 1.00 0.00 C ATOM 315 O LEU A 25 11.138 -1.112 10.633 1.00 0.00 O ATOM 316 CB LEU A 25 9.294 -1.739 7.821 1.00 0.00 C ATOM 317 CG LEU A 25 8.225 -1.490 8.887 1.00 0.00 C ATOM 318 CD1 LEU A 25 7.266 -0.404 8.401 1.00 0.00 C ATOM 319 CD2 LEU A 25 7.443 -2.781 9.138 1.00 0.00 C ATOM 0 H LEU A 25 9.475 -3.778 9.071 1.00 0.00 H new ATOM 0 HA LEU A 25 11.428 -2.205 7.771 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.406 -0.857 7.191 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.989 -2.559 7.170 1.00 0.00 H new ATOM 0 HG LEU A 25 8.703 -1.168 9.812 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.504 -0.226 9.160 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.821 0.517 8.220 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.789 -0.728 7.476 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.682 -2.603 9.897 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.965 -3.102 8.213 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.125 -3.558 9.483 1.00 0.00 H new ATOM 331 N ASP A 26 11.321 0.221 8.897 1.00 0.00 N ATOM 332 CA ASP A 26 11.743 1.361 9.763 1.00 0.00 C ATOM 333 C ASP A 26 11.425 2.692 9.078 1.00 0.00 C ATOM 334 O ASP A 26 11.272 2.762 7.876 1.00 0.00 O ATOM 335 CB ASP A 26 13.253 1.193 9.932 1.00 0.00 C ATOM 336 CG ASP A 26 13.616 1.305 11.414 1.00 0.00 C ATOM 337 OD1 ASP A 26 12.725 1.160 12.234 1.00 0.00 O ATOM 338 OD2 ASP A 26 14.778 1.535 11.703 1.00 0.00 O ATOM 0 H ASP A 26 11.267 0.429 7.900 1.00 0.00 H new ATOM 0 HA ASP A 26 11.224 1.365 10.721 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.568 0.225 9.542 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.781 1.955 9.359 1.00 0.00 H new ATOM 343 N THR A 27 11.325 3.748 9.837 1.00 0.00 N ATOM 344 CA THR A 27 11.017 5.075 9.235 1.00 0.00 C ATOM 345 C THR A 27 12.150 6.061 9.531 1.00 0.00 C ATOM 346 O THR A 27 12.950 6.379 8.674 1.00 0.00 O ATOM 347 CB THR A 27 9.725 5.522 9.918 1.00 0.00 C ATOM 348 OG1 THR A 27 9.704 5.032 11.251 1.00 0.00 O ATOM 349 CG2 THR A 27 8.521 4.973 9.152 1.00 0.00 C ATOM 0 H THR A 27 11.444 3.749 10.850 1.00 0.00 H new ATOM 0 HA THR A 27 10.912 5.028 8.151 1.00 0.00 H new ATOM 0 HB THR A 27 9.678 6.611 9.928 1.00 0.00 H new ATOM 0 HG1 THR A 27 9.120 5.598 11.798 1.00 0.00 H new ATOM 0 HG21 THR A 27 7.601 5.293 9.642 1.00 0.00 H new ATOM 0 HG22 THR A 27 8.538 5.350 8.129 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.564 3.884 9.138 1.00 0.00 H new ATOM 357 N SER A 28 12.222 6.543 10.743 1.00 0.00 N ATOM 358 CA SER A 28 13.302 7.507 11.107 1.00 0.00 C ATOM 359 C SER A 28 13.534 8.511 9.973 1.00 0.00 C ATOM 360 O SER A 28 14.617 9.037 9.812 1.00 0.00 O ATOM 361 CB SER A 28 14.546 6.645 11.320 1.00 0.00 C ATOM 362 OG SER A 28 15.351 6.685 10.149 1.00 0.00 O ATOM 0 H SER A 28 11.578 6.310 11.499 1.00 0.00 H new ATOM 0 HA SER A 28 13.048 8.089 11.993 1.00 0.00 H new ATOM 0 HB2 SER A 28 15.112 7.009 12.177 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.257 5.618 11.542 1.00 0.00 H new ATOM 0 HG SER A 28 15.657 7.603 9.994 1.00 0.00 H new ATOM 368 N THR A 29 12.528 8.781 9.186 1.00 0.00 N ATOM 369 CA THR A 29 12.701 9.752 8.067 1.00 0.00 C ATOM 370 C THR A 29 11.337 10.199 7.534 1.00 0.00 C ATOM 371 O THR A 29 11.212 10.623 6.402 1.00 0.00 O ATOM 372 CB THR A 29 13.471 8.984 6.992 1.00 0.00 C ATOM 373 OG1 THR A 29 13.731 9.845 5.892 1.00 0.00 O ATOM 374 CG2 THR A 29 12.641 7.788 6.523 1.00 0.00 C ATOM 0 H THR A 29 11.597 8.373 9.269 1.00 0.00 H new ATOM 0 HA THR A 29 13.227 10.653 8.382 1.00 0.00 H new ATOM 0 HB THR A 29 14.415 8.627 7.405 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.970 10.449 5.762 1.00 0.00 H new ATOM 0 HG21 THR A 29 13.191 7.242 5.757 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.444 7.128 7.368 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.696 8.141 6.109 1.00 0.00 H new ATOM 382 N GLY A 30 10.315 10.107 8.339 1.00 0.00 N ATOM 383 CA GLY A 30 8.962 10.527 7.876 1.00 0.00 C ATOM 384 C GLY A 30 8.553 9.681 6.670 1.00 0.00 C ATOM 385 O GLY A 30 7.659 10.033 5.926 1.00 0.00 O ATOM 0 H GLY A 30 10.358 9.759 9.297 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.237 10.407 8.681 1.00 0.00 H new ATOM 0 HA3 GLY A 30 8.969 11.583 7.608 1.00 0.00 H new ATOM 389 N ALA A 31 9.201 8.566 6.473 1.00 0.00 N ATOM 390 CA ALA A 31 8.851 7.694 5.316 1.00 0.00 C ATOM 391 C ALA A 31 8.957 6.221 5.717 1.00 0.00 C ATOM 392 O ALA A 31 9.696 5.865 6.614 1.00 0.00 O ATOM 393 CB ALA A 31 9.885 8.032 4.241 1.00 0.00 C ATOM 0 H ALA A 31 9.958 8.221 7.063 1.00 0.00 H new ATOM 0 HA ALA A 31 7.831 7.857 4.967 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.696 7.430 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.812 9.089 3.985 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.885 7.818 4.618 1.00 0.00 H new ATOM 399 N LEU A 32 8.226 5.362 5.062 1.00 0.00 N ATOM 400 CA LEU A 32 8.290 3.914 5.411 1.00 0.00 C ATOM 401 C LEU A 32 9.343 3.211 4.553 1.00 0.00 C ATOM 402 O LEU A 32 9.080 2.802 3.440 1.00 0.00 O ATOM 403 CB LEU A 32 6.898 3.367 5.103 1.00 0.00 C ATOM 404 CG LEU A 32 6.915 1.843 5.224 1.00 0.00 C ATOM 405 CD1 LEU A 32 5.990 1.410 6.361 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.434 1.222 3.911 1.00 0.00 C ATOM 0 H LEU A 32 7.588 5.599 4.302 1.00 0.00 H new ATOM 0 HA LEU A 32 8.568 3.754 6.453 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.168 3.790 5.793 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.594 3.660 4.098 1.00 0.00 H new ATOM 0 HG LEU A 32 7.930 1.507 5.435 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.003 0.323 6.447 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.332 1.852 7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.974 1.746 6.152 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.446 0.135 3.997 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.419 1.558 3.700 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.094 1.529 3.100 1.00 0.00 H new ATOM 418 N CYS A 33 10.535 3.069 5.063 1.00 0.00 N ATOM 419 CA CYS A 33 11.606 2.395 4.277 1.00 0.00 C ATOM 420 C CYS A 33 11.789 0.950 4.752 1.00 0.00 C ATOM 421 O CYS A 33 12.444 0.691 5.742 1.00 0.00 O ATOM 422 CB CYS A 33 12.869 3.211 4.550 1.00 0.00 C ATOM 423 SG CYS A 33 12.933 4.623 3.419 1.00 0.00 S ATOM 0 H CYS A 33 10.814 3.391 5.990 1.00 0.00 H new ATOM 0 HA CYS A 33 11.369 2.350 3.214 1.00 0.00 H new ATOM 0 HB2 CYS A 33 12.874 3.559 5.583 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.753 2.587 4.420 1.00 0.00 H new ATOM 428 N VAL A 34 11.222 0.008 4.050 1.00 0.00 N ATOM 429 CA VAL A 34 11.374 -1.418 4.456 1.00 0.00 C ATOM 430 C VAL A 34 12.613 -2.014 3.785 1.00 0.00 C ATOM 431 O VAL A 34 12.954 -1.664 2.672 1.00 0.00 O ATOM 432 CB VAL A 34 10.106 -2.115 3.963 1.00 0.00 C ATOM 433 CG1 VAL A 34 8.901 -1.601 4.752 1.00 0.00 C ATOM 434 CG2 VAL A 34 9.905 -1.817 2.475 1.00 0.00 C ATOM 0 H VAL A 34 10.660 0.164 3.213 1.00 0.00 H new ATOM 0 HA VAL A 34 11.501 -1.534 5.532 1.00 0.00 H new ATOM 0 HB VAL A 34 10.204 -3.191 4.109 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.997 -2.098 4.400 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.043 -1.813 5.812 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.803 -0.525 4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.001 -2.314 2.123 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.808 -0.741 2.329 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.763 -2.183 1.911 1.00 0.00 H new ATOM 444 N ALA A 35 13.295 -2.902 4.451 1.00 0.00 N ATOM 445 CA ALA A 35 14.516 -3.504 3.844 1.00 0.00 C ATOM 446 C ALA A 35 14.168 -4.782 3.082 1.00 0.00 C ATOM 447 O ALA A 35 14.028 -5.842 3.659 1.00 0.00 O ATOM 448 CB ALA A 35 15.434 -3.820 5.026 1.00 0.00 C ATOM 0 H ALA A 35 13.062 -3.237 5.386 1.00 0.00 H new ATOM 0 HA ALA A 35 14.986 -2.831 3.127 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.358 -4.268 4.660 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.665 -2.900 5.564 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.934 -4.518 5.698 1.00 0.00 H new ATOM 454 N VAL A 36 14.039 -4.694 1.787 1.00 0.00 N ATOM 455 CA VAL A 36 13.716 -5.910 0.993 1.00 0.00 C ATOM 456 C VAL A 36 15.013 -6.669 0.668 1.00 0.00 C ATOM 457 O VAL A 36 15.975 -6.088 0.203 1.00 0.00 O ATOM 458 CB VAL A 36 13.039 -5.389 -0.276 1.00 0.00 C ATOM 459 CG1 VAL A 36 12.664 -6.567 -1.169 1.00 0.00 C ATOM 460 CG2 VAL A 36 11.766 -4.620 0.098 1.00 0.00 C ATOM 0 H VAL A 36 14.143 -3.835 1.247 1.00 0.00 H new ATOM 0 HA VAL A 36 13.068 -6.607 1.525 1.00 0.00 H new ATOM 0 HB VAL A 36 13.725 -4.727 -0.804 1.00 0.00 H new ATOM 0 HG11 VAL A 36 12.181 -6.198 -2.074 1.00 0.00 H new ATOM 0 HG12 VAL A 36 13.564 -7.121 -1.437 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.979 -7.225 -0.635 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.285 -4.250 -0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.082 -5.284 0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.025 -3.779 0.741 1.00 0.00 H new ATOM 470 N PRO A 37 14.997 -7.944 0.955 1.00 0.00 N ATOM 471 CA PRO A 37 16.190 -8.813 0.733 1.00 0.00 C ATOM 472 C PRO A 37 16.544 -8.957 -0.755 1.00 0.00 C ATOM 473 O PRO A 37 15.891 -8.412 -1.622 1.00 0.00 O ATOM 474 CB PRO A 37 15.767 -10.153 1.338 1.00 0.00 C ATOM 475 CG PRO A 37 14.273 -10.132 1.305 1.00 0.00 C ATOM 476 CD PRO A 37 13.869 -8.698 1.505 1.00 0.00 C ATOM 0 HA PRO A 37 17.091 -8.400 1.186 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.164 -10.990 0.763 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.139 -10.262 2.357 1.00 0.00 H new ATOM 0 HG2 PRO A 37 13.899 -10.513 0.354 1.00 0.00 H new ATOM 0 HG3 PRO A 37 13.857 -10.766 2.088 1.00 0.00 H new ATOM 0 HD2 PRO A 37 12.940 -8.467 0.984 1.00 0.00 H new ATOM 0 HD3 PRO A 37 13.709 -8.469 2.559 1.00 0.00 H new ATOM 484 N ALA A 38 17.601 -9.681 -1.040 1.00 0.00 N ATOM 485 CA ALA A 38 18.048 -9.866 -2.456 1.00 0.00 C ATOM 486 C ALA A 38 16.976 -10.560 -3.296 1.00 0.00 C ATOM 487 O ALA A 38 16.613 -11.693 -3.052 1.00 0.00 O ATOM 488 CB ALA A 38 19.298 -10.740 -2.365 1.00 0.00 C ATOM 0 H ALA A 38 18.177 -10.155 -0.345 1.00 0.00 H new ATOM 0 HA ALA A 38 18.241 -8.909 -2.940 1.00 0.00 H new ATOM 0 HB1 ALA A 38 19.688 -10.922 -3.366 1.00 0.00 H new ATOM 0 HB2 ALA A 38 20.055 -10.232 -1.768 1.00 0.00 H new ATOM 0 HB3 ALA A 38 19.044 -11.691 -1.896 1.00 0.00 H new ATOM 494 N GLY A 39 16.481 -9.876 -4.292 1.00 0.00 N ATOM 495 CA GLY A 39 15.433 -10.459 -5.182 1.00 0.00 C ATOM 496 C GLY A 39 14.457 -11.324 -4.379 1.00 0.00 C ATOM 497 O GLY A 39 13.866 -12.242 -4.911 1.00 0.00 O ATOM 0 H GLY A 39 16.762 -8.925 -4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 39 14.889 -9.659 -5.683 1.00 0.00 H new ATOM 0 HA3 GLY A 39 15.904 -11.060 -5.960 1.00 0.00 H new ATOM 501 N SER A 40 14.284 -11.044 -3.107 1.00 0.00 N ATOM 502 CA SER A 40 13.351 -11.861 -2.277 1.00 0.00 C ATOM 503 C SER A 40 13.429 -13.326 -2.699 1.00 0.00 C ATOM 504 O SER A 40 12.544 -13.845 -3.350 1.00 0.00 O ATOM 505 CB SER A 40 11.957 -11.296 -2.546 1.00 0.00 C ATOM 506 OG SER A 40 10.973 -12.202 -2.052 1.00 0.00 O ATOM 0 H SER A 40 14.751 -10.284 -2.612 1.00 0.00 H new ATOM 0 HA SER A 40 13.599 -11.816 -1.217 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.847 -10.325 -2.063 1.00 0.00 H new ATOM 0 HB3 SER A 40 11.817 -11.138 -3.615 1.00 0.00 H new ATOM 0 HG SER A 40 11.232 -12.511 -1.159 1.00 0.00 H new ATOM 512 N ALA A 41 14.487 -13.990 -2.344 1.00 0.00 N ATOM 513 CA ALA A 41 14.628 -15.419 -2.740 1.00 0.00 C ATOM 514 C ALA A 41 13.971 -16.317 -1.695 1.00 0.00 C ATOM 515 O ALA A 41 14.390 -16.369 -0.563 1.00 0.00 O ATOM 516 CB ALA A 41 16.133 -15.673 -2.793 1.00 0.00 C ATOM 0 H ALA A 41 15.260 -13.610 -1.798 1.00 0.00 H new ATOM 0 HA ALA A 41 14.148 -15.633 -3.695 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.317 -16.709 -3.079 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.589 -15.007 -3.526 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.569 -15.485 -1.812 1.00 0.00 H new ATOM 522 N GLN A 42 12.930 -17.002 -2.090 1.00 0.00 N ATOM 523 CA GLN A 42 12.174 -17.914 -1.163 1.00 0.00 C ATOM 524 C GLN A 42 11.470 -17.099 -0.095 1.00 0.00 C ATOM 525 O GLN A 42 10.979 -17.626 0.881 1.00 0.00 O ATOM 526 CB GLN A 42 13.201 -18.872 -0.515 1.00 0.00 C ATOM 527 CG GLN A 42 13.697 -18.345 0.858 1.00 0.00 C ATOM 528 CD GLN A 42 15.205 -18.583 0.987 1.00 0.00 C ATOM 529 OE1 GLN A 42 15.985 -18.356 -0.035 1.00 0.00 O flip ATOM 530 NE2 GLN A 42 15.678 -18.981 2.033 1.00 0.00 N flip ATOM 0 H GLN A 42 12.559 -16.970 -3.039 1.00 0.00 H new ATOM 0 HA GLN A 42 11.418 -18.478 -1.709 1.00 0.00 H new ATOM 0 HB2 GLN A 42 12.749 -19.855 -0.385 1.00 0.00 H new ATOM 0 HB3 GLN A 42 14.052 -18.999 -1.184 1.00 0.00 H new ATOM 0 HG2 GLN A 42 13.477 -17.281 0.951 1.00 0.00 H new ATOM 0 HG3 GLN A 42 13.169 -18.852 1.666 1.00 0.00 H new ATOM 0 HE21 GLN A 42 15.070 -19.159 2.833 1.00 0.00 H new ATOM 0 HE22 GLN A 42 16.683 -19.137 2.112 1.00 0.00 H new ATOM 539 N TYR A 43 11.445 -15.821 -0.261 1.00 0.00 N ATOM 540 CA TYR A 43 10.809 -14.963 0.766 1.00 0.00 C ATOM 541 C TYR A 43 9.863 -13.948 0.144 1.00 0.00 C ATOM 542 O TYR A 43 10.171 -12.776 0.066 1.00 0.00 O ATOM 543 CB TYR A 43 11.977 -14.246 1.436 1.00 0.00 C ATOM 544 CG TYR A 43 11.978 -14.576 2.901 1.00 0.00 C ATOM 545 CD1 TYR A 43 11.702 -15.879 3.319 1.00 0.00 C ATOM 546 CD2 TYR A 43 12.246 -13.581 3.840 1.00 0.00 C ATOM 547 CE1 TYR A 43 11.693 -16.191 4.676 1.00 0.00 C ATOM 548 CE2 TYR A 43 12.239 -13.888 5.201 1.00 0.00 C ATOM 549 CZ TYR A 43 11.962 -15.196 5.623 1.00 0.00 C ATOM 550 OH TYR A 43 11.953 -15.501 6.969 1.00 0.00 O ATOM 0 H TYR A 43 11.837 -15.327 -1.063 1.00 0.00 H new ATOM 0 HA TYR A 43 10.208 -15.549 1.462 1.00 0.00 H new ATOM 0 HB2 TYR A 43 12.918 -14.553 0.980 1.00 0.00 H new ATOM 0 HB3 TYR A 43 11.890 -13.169 1.293 1.00 0.00 H new ATOM 0 HD1 TYR A 43 11.495 -16.647 2.588 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.459 -12.574 3.514 1.00 0.00 H new ATOM 0 HE1 TYR A 43 11.479 -17.200 4.997 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.447 -13.118 5.929 1.00 0.00 H new ATOM 0 HH TYR A 43 12.161 -14.696 7.488 1.00 0.00 H new ATOM 560 N GLY A 44 8.702 -14.368 -0.270 1.00 0.00 N ATOM 561 CA GLY A 44 7.749 -13.387 -0.845 1.00 0.00 C ATOM 562 C GLY A 44 7.674 -12.206 0.119 1.00 0.00 C ATOM 563 O GLY A 44 6.988 -12.252 1.120 1.00 0.00 O ATOM 0 H GLY A 44 8.377 -15.334 -0.236 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.083 -13.059 -1.829 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.766 -13.839 -0.976 1.00 0.00 H new ATOM 567 N VAL A 45 8.391 -11.154 -0.160 1.00 0.00 N ATOM 568 CA VAL A 45 8.374 -9.987 0.759 1.00 0.00 C ATOM 569 C VAL A 45 7.218 -9.086 0.378 1.00 0.00 C ATOM 570 O VAL A 45 7.197 -8.518 -0.689 1.00 0.00 O ATOM 571 CB VAL A 45 9.706 -9.270 0.529 1.00 0.00 C ATOM 572 CG1 VAL A 45 10.010 -8.364 1.720 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.829 -10.300 0.370 1.00 0.00 C ATOM 0 H VAL A 45 8.986 -11.053 -0.982 1.00 0.00 H new ATOM 0 HA VAL A 45 8.253 -10.272 1.804 1.00 0.00 H new ATOM 0 HB VAL A 45 9.638 -8.669 -0.378 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.959 -7.853 1.556 1.00 0.00 H new ATOM 0 HG12 VAL A 45 9.215 -7.626 1.828 1.00 0.00 H new ATOM 0 HG13 VAL A 45 10.073 -8.965 2.627 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.775 -9.784 0.206 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.897 -10.906 1.273 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.614 -10.944 -0.483 1.00 0.00 H new ATOM 583 N GLY A 46 6.246 -8.969 1.230 1.00 0.00 N ATOM 584 CA GLY A 46 5.076 -8.117 0.887 1.00 0.00 C ATOM 585 C GLY A 46 4.719 -7.203 2.057 1.00 0.00 C ATOM 586 O GLY A 46 4.769 -7.593 3.207 1.00 0.00 O ATOM 0 H GLY A 46 6.208 -9.422 2.143 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.301 -7.517 0.005 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.222 -8.746 0.635 1.00 0.00 H new ATOM 590 N VAL A 47 4.348 -5.988 1.765 1.00 0.00 N ATOM 591 CA VAL A 47 3.971 -5.037 2.844 1.00 0.00 C ATOM 592 C VAL A 47 2.449 -4.857 2.858 1.00 0.00 C ATOM 593 O VAL A 47 1.850 -4.500 1.865 1.00 0.00 O ATOM 594 CB VAL A 47 4.676 -3.733 2.470 1.00 0.00 C ATOM 595 CG1 VAL A 47 4.578 -2.744 3.630 1.00 0.00 C ATOM 596 CG2 VAL A 47 6.149 -4.020 2.174 1.00 0.00 C ATOM 0 H VAL A 47 4.290 -5.612 0.819 1.00 0.00 H new ATOM 0 HA VAL A 47 4.259 -5.379 3.838 1.00 0.00 H new ATOM 0 HB VAL A 47 4.200 -3.305 1.588 1.00 0.00 H new ATOM 0 HG11 VAL A 47 5.081 -1.816 3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.529 -2.539 3.846 1.00 0.00 H new ATOM 0 HG13 VAL A 47 5.053 -3.171 4.513 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.654 -3.092 1.907 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.621 -4.449 3.058 1.00 0.00 H new ATOM 0 HG23 VAL A 47 6.223 -4.725 1.346 1.00 0.00 H new ATOM 606 N VAL A 48 1.815 -5.115 3.969 1.00 0.00 N ATOM 607 CA VAL A 48 0.330 -4.970 4.023 1.00 0.00 C ATOM 608 C VAL A 48 -0.075 -3.931 5.072 1.00 0.00 C ATOM 609 O VAL A 48 0.493 -3.860 6.143 1.00 0.00 O ATOM 610 CB VAL A 48 -0.184 -6.353 4.418 1.00 0.00 C ATOM 611 CG1 VAL A 48 0.208 -7.371 3.346 1.00 0.00 C ATOM 612 CG2 VAL A 48 0.435 -6.762 5.757 1.00 0.00 C ATOM 0 H VAL A 48 2.256 -5.418 4.837 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.082 -4.631 3.073 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.270 -6.323 4.510 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.159 -8.357 3.629 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.230 -7.081 2.391 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.294 -7.401 3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.069 -7.749 6.041 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.521 -6.791 5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.157 -6.038 6.523 1.00 0.00 H new ATOM 622 N LEU A 49 -1.060 -3.128 4.771 1.00 0.00 N ATOM 623 CA LEU A 49 -1.509 -2.096 5.750 1.00 0.00 C ATOM 624 C LEU A 49 -3.030 -2.147 5.911 1.00 0.00 C ATOM 625 O LEU A 49 -3.765 -1.601 5.112 1.00 0.00 O ATOM 626 CB LEU A 49 -1.081 -0.757 5.146 1.00 0.00 C ATOM 627 CG LEU A 49 -1.818 0.380 5.857 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.328 0.480 7.302 1.00 0.00 C ATOM 629 CD2 LEU A 49 -1.541 1.699 5.132 1.00 0.00 C ATOM 0 H LEU A 49 -1.573 -3.142 3.890 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.077 -2.253 6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.004 -0.627 5.249 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.304 -0.739 4.079 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.889 0.179 5.850 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.853 1.290 7.809 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.525 -0.459 7.819 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.257 0.681 7.310 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.066 2.509 5.638 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.470 1.900 5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.890 1.628 4.102 1.00 0.00 H new ATOM 641 N ASN A 50 -3.509 -2.792 6.939 1.00 0.00 N ATOM 642 CA ASN A 50 -4.983 -2.872 7.148 1.00 0.00 C ATOM 643 C ASN A 50 -5.510 -1.550 7.713 1.00 0.00 C ATOM 644 O ASN A 50 -4.906 -0.948 8.578 1.00 0.00 O ATOM 645 CB ASN A 50 -5.180 -4.002 8.159 1.00 0.00 C ATOM 646 CG ASN A 50 -4.334 -3.727 9.403 1.00 0.00 C ATOM 647 OD1 ASN A 50 -4.544 -2.747 10.090 1.00 0.00 O ATOM 648 ND2 ASN A 50 -3.378 -4.556 9.724 1.00 0.00 N ATOM 0 H ASN A 50 -2.944 -3.267 7.643 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.521 -3.058 6.219 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.232 -4.081 8.432 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -4.894 -4.955 7.715 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -2.808 -4.381 10.551 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -3.201 -5.379 9.148 1.00 0.00 H new ATOM 655 N GLY A 51 -6.634 -1.093 7.230 1.00 0.00 N ATOM 656 CA GLY A 51 -7.197 0.189 7.741 1.00 0.00 C ATOM 657 C GLY A 51 -7.647 1.058 6.564 1.00 0.00 C ATOM 658 O GLY A 51 -6.992 2.013 6.199 1.00 0.00 O ATOM 0 H GLY A 51 -7.186 -1.552 6.505 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.040 -0.010 8.402 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.448 0.717 8.331 1.00 0.00 H new ATOM 662 N VAL A 52 -8.763 0.736 5.968 1.00 0.00 N ATOM 663 CA VAL A 52 -9.254 1.546 4.816 1.00 0.00 C ATOM 664 C VAL A 52 -10.755 1.812 4.960 1.00 0.00 C ATOM 665 O VAL A 52 -11.410 1.268 5.827 1.00 0.00 O ATOM 666 CB VAL A 52 -8.975 0.688 3.583 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.723 1.264 2.381 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.472 0.687 3.293 1.00 0.00 C ATOM 0 H VAL A 52 -9.356 -0.052 6.229 1.00 0.00 H new ATOM 0 HA VAL A 52 -8.765 2.518 4.754 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.312 -0.332 3.767 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.524 0.652 1.501 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.794 1.267 2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -9.386 2.284 2.197 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.272 0.075 2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.136 1.708 3.109 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.936 0.278 4.150 1.00 0.00 H new ATOM 678 N ALA A 53 -11.307 2.649 4.122 1.00 0.00 N ATOM 679 CA ALA A 53 -12.765 2.947 4.221 1.00 0.00 C ATOM 680 C ALA A 53 -13.395 3.034 2.827 1.00 0.00 C ATOM 681 O ALA A 53 -13.588 4.107 2.290 1.00 0.00 O ATOM 682 CB ALA A 53 -12.843 4.300 4.929 1.00 0.00 C ATOM 0 H ALA A 53 -10.813 3.138 3.375 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.306 2.169 4.759 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.887 4.592 5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.380 4.223 5.913 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.318 5.051 4.338 1.00 0.00 H new ATOM 688 N ILE A 54 -13.724 1.915 2.243 1.00 0.00 N ATOM 689 CA ILE A 54 -14.351 1.934 0.889 1.00 0.00 C ATOM 690 C ILE A 54 -15.740 1.291 0.952 1.00 0.00 C ATOM 691 O ILE A 54 -16.049 0.552 1.865 1.00 0.00 O ATOM 692 CB ILE A 54 -13.413 1.113 0.002 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.038 1.780 -0.040 1.00 0.00 C ATOM 694 CG2 ILE A 54 -13.981 1.042 -1.416 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.198 3.255 -0.405 1.00 0.00 C ATOM 0 H ILE A 54 -13.586 0.987 2.644 1.00 0.00 H new ATOM 0 HA ILE A 54 -14.483 2.945 0.504 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.320 0.106 0.409 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.546 1.685 0.928 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.402 1.280 -0.771 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.312 0.457 -2.047 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -14.963 0.569 -1.391 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -14.074 2.049 -1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.218 3.731 -0.435 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.672 3.338 -1.383 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.819 3.749 0.342 1.00 0.00 H new ATOM 707 N GLU A 55 -16.585 1.568 -0.005 1.00 0.00 N ATOM 708 CA GLU A 55 -17.951 0.969 0.018 1.00 0.00 C ATOM 709 C GLU A 55 -18.511 0.841 -1.400 1.00 0.00 C ATOM 710 O GLU A 55 -18.478 1.772 -2.179 1.00 0.00 O ATOM 711 CB GLU A 55 -18.795 1.945 0.839 1.00 0.00 C ATOM 712 CG GLU A 55 -20.035 1.225 1.373 1.00 0.00 C ATOM 713 CD GLU A 55 -20.441 1.834 2.715 1.00 0.00 C ATOM 714 OE1 GLU A 55 -20.587 3.044 2.774 1.00 0.00 O ATOM 715 OE2 GLU A 55 -20.601 1.081 3.662 1.00 0.00 O ATOM 0 H GLU A 55 -16.390 2.180 -0.798 1.00 0.00 H new ATOM 0 HA GLU A 55 -17.949 -0.034 0.444 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.208 2.343 1.667 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.092 2.793 0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -20.854 1.312 0.659 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -19.828 0.162 1.492 1.00 0.00 H new ATOM 722 N GLU A 56 -19.033 -0.311 -1.730 1.00 0.00 N ATOM 723 CA GLU A 56 -19.612 -0.524 -3.088 1.00 0.00 C ATOM 724 C GLU A 56 -18.780 0.189 -4.158 1.00 0.00 C ATOM 725 O GLU A 56 -17.599 0.420 -3.989 1.00 0.00 O ATOM 726 CB GLU A 56 -21.018 0.068 -3.011 1.00 0.00 C ATOM 727 CG GLU A 56 -20.926 1.591 -2.948 1.00 0.00 C ATOM 728 CD GLU A 56 -22.312 2.197 -3.178 1.00 0.00 C ATOM 729 OE1 GLU A 56 -23.284 1.474 -3.035 1.00 0.00 O ATOM 730 OE2 GLU A 56 -22.377 3.374 -3.494 1.00 0.00 O ATOM 0 H GLU A 56 -19.083 -1.120 -1.111 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.624 -1.578 -3.365 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.600 -0.236 -3.881 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.537 -0.312 -2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.538 1.902 -1.978 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -20.229 1.955 -3.702 1.00 0.00 H new ATOM 737 N GLY A 57 -19.388 0.533 -5.261 1.00 0.00 N ATOM 738 CA GLY A 57 -18.637 1.226 -6.346 1.00 0.00 C ATOM 739 C GLY A 57 -18.596 2.729 -6.069 1.00 0.00 C ATOM 740 O GLY A 57 -19.391 3.488 -6.586 1.00 0.00 O ATOM 0 H GLY A 57 -20.374 0.363 -5.458 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -17.623 0.831 -6.409 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -19.113 1.037 -7.308 1.00 0.00 H new ATOM 744 N THR A 58 -17.671 3.167 -5.259 1.00 0.00 N ATOM 745 CA THR A 58 -17.575 4.623 -4.952 1.00 0.00 C ATOM 746 C THR A 58 -16.289 5.197 -5.557 1.00 0.00 C ATOM 747 O THR A 58 -15.438 4.472 -6.034 1.00 0.00 O ATOM 748 CB THR A 58 -17.553 4.701 -3.419 1.00 0.00 C ATOM 749 OG1 THR A 58 -18.888 4.705 -2.932 1.00 0.00 O ATOM 750 CG2 THR A 58 -16.843 5.980 -2.964 1.00 0.00 C ATOM 0 H THR A 58 -16.977 2.580 -4.796 1.00 0.00 H new ATOM 0 HA THR A 58 -18.401 5.200 -5.369 1.00 0.00 H new ATOM 0 HB THR A 58 -17.015 3.838 -3.026 1.00 0.00 H new ATOM 0 HG1 THR A 58 -19.110 3.818 -2.580 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.834 6.023 -1.875 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.818 5.979 -3.336 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.371 6.849 -3.357 1.00 0.00 H new ATOM 758 N THR A 59 -16.143 6.493 -5.543 1.00 0.00 N ATOM 759 CA THR A 59 -14.914 7.111 -6.119 1.00 0.00 C ATOM 760 C THR A 59 -13.832 7.242 -5.045 1.00 0.00 C ATOM 761 O THR A 59 -14.119 7.327 -3.867 1.00 0.00 O ATOM 762 CB THR A 59 -15.355 8.492 -6.606 1.00 0.00 C ATOM 763 OG1 THR A 59 -16.712 8.434 -7.021 1.00 0.00 O ATOM 764 CG2 THR A 59 -14.477 8.926 -7.781 1.00 0.00 C ATOM 0 H THR A 59 -16.821 7.151 -5.158 1.00 0.00 H new ATOM 0 HA THR A 59 -14.490 6.510 -6.924 1.00 0.00 H new ATOM 0 HB THR A 59 -15.253 9.213 -5.795 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.997 9.319 -7.332 1.00 0.00 H new ATOM 0 HG21 THR A 59 -14.793 9.910 -8.127 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.436 8.970 -7.460 1.00 0.00 H new ATOM 0 HG23 THR A 59 -14.576 8.207 -8.594 1.00 0.00 H new ATOM 772 N TYR A 60 -12.590 7.262 -5.442 1.00 0.00 N ATOM 773 CA TYR A 60 -11.489 7.390 -4.445 1.00 0.00 C ATOM 774 C TYR A 60 -10.220 7.906 -5.126 1.00 0.00 C ATOM 775 O TYR A 60 -10.198 8.156 -6.314 1.00 0.00 O ATOM 776 CB TYR A 60 -11.269 5.975 -3.910 1.00 0.00 C ATOM 777 CG TYR A 60 -12.409 5.598 -2.997 1.00 0.00 C ATOM 778 CD1 TYR A 60 -12.490 6.148 -1.713 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.385 4.696 -3.434 1.00 0.00 C ATOM 780 CE1 TYR A 60 -13.547 5.796 -0.866 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.441 4.343 -2.588 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.523 4.893 -1.303 1.00 0.00 C ATOM 783 OH TYR A 60 -15.565 4.545 -0.468 1.00 0.00 O ATOM 0 H TYR A 60 -12.289 7.195 -6.414 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.734 8.093 -3.649 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -11.203 5.268 -4.737 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -10.324 5.922 -3.370 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -11.737 6.844 -1.375 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -13.323 4.272 -4.425 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.610 6.221 0.125 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -15.194 3.646 -2.926 1.00 0.00 H new ATOM 0 HH TYR A 60 -15.766 5.293 0.133 1.00 0.00 H new ATOM 793 N THR A 61 -9.161 8.064 -4.381 1.00 0.00 N ATOM 794 CA THR A 61 -7.892 8.561 -4.983 1.00 0.00 C ATOM 795 C THR A 61 -6.693 7.994 -4.222 1.00 0.00 C ATOM 796 O THR A 61 -6.451 8.338 -3.082 1.00 0.00 O ATOM 797 CB THR A 61 -7.952 10.082 -4.835 1.00 0.00 C ATOM 798 OG1 THR A 61 -9.089 10.579 -5.526 1.00 0.00 O ATOM 799 CG2 THR A 61 -6.683 10.703 -5.422 1.00 0.00 C ATOM 0 H THR A 61 -9.120 7.870 -3.380 1.00 0.00 H new ATOM 0 HA THR A 61 -7.781 8.258 -6.024 1.00 0.00 H new ATOM 0 HB THR A 61 -8.026 10.343 -3.779 1.00 0.00 H new ATOM 0 HG1 THR A 61 -8.871 10.693 -6.475 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.726 11.787 -5.316 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.811 10.321 -4.890 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.606 10.444 -6.478 1.00 0.00 H new ATOM 807 N LEU A 62 -5.940 7.126 -4.840 1.00 0.00 N ATOM 808 CA LEU A 62 -4.760 6.540 -4.145 1.00 0.00 C ATOM 809 C LEU A 62 -3.521 7.403 -4.389 1.00 0.00 C ATOM 810 O LEU A 62 -3.114 7.620 -5.514 1.00 0.00 O ATOM 811 CB LEU A 62 -4.575 5.154 -4.765 1.00 0.00 C ATOM 812 CG LEU A 62 -3.240 4.566 -4.305 1.00 0.00 C ATOM 813 CD1 LEU A 62 -3.351 4.122 -2.846 1.00 0.00 C ATOM 814 CD2 LEU A 62 -2.886 3.360 -5.177 1.00 0.00 C ATOM 0 H LEU A 62 -6.091 6.798 -5.794 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.905 6.486 -3.066 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.395 4.499 -4.470 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.599 5.224 -5.853 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.461 5.323 -4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.399 3.703 -2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.603 4.980 -2.223 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.131 3.366 -2.754 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.935 2.941 -4.849 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.666 2.604 -5.086 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.805 3.675 -6.217 1.00 0.00 H new ATOM 826 N ARG A 63 -2.918 7.896 -3.343 1.00 0.00 N ATOM 827 CA ARG A 63 -1.704 8.743 -3.512 1.00 0.00 C ATOM 828 C ARG A 63 -0.568 8.205 -2.639 1.00 0.00 C ATOM 829 O ARG A 63 -0.774 7.821 -1.508 1.00 0.00 O ATOM 830 CB ARG A 63 -2.125 10.138 -3.047 1.00 0.00 C ATOM 831 CG ARG A 63 -0.881 10.995 -2.809 1.00 0.00 C ATOM 832 CD ARG A 63 -1.303 12.440 -2.530 1.00 0.00 C ATOM 833 NE ARG A 63 -1.576 12.484 -1.067 1.00 0.00 N ATOM 834 CZ ARG A 63 -2.357 13.407 -0.575 1.00 0.00 C ATOM 835 NH1 ARG A 63 -2.721 14.418 -1.316 1.00 0.00 N ATOM 836 NH2 ARG A 63 -2.773 13.320 0.658 1.00 0.00 N ATOM 0 H ARG A 63 -3.214 7.749 -2.378 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.342 8.751 -4.540 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.763 10.605 -3.797 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.710 10.066 -2.130 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -0.311 10.602 -1.967 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.228 10.957 -3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.516 13.142 -2.806 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.188 12.711 -3.105 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.152 11.792 -0.449 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.395 14.487 -2.280 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.331 15.139 -0.931 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.488 12.531 1.238 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.383 14.041 1.042 1.00 0.00 H new ATOM 850 N TYR A 64 0.628 8.172 -3.158 1.00 0.00 N ATOM 851 CA TYR A 64 1.777 7.657 -2.357 1.00 0.00 C ATOM 852 C TYR A 64 3.081 7.841 -3.141 1.00 0.00 C ATOM 853 O TYR A 64 3.087 7.842 -4.353 1.00 0.00 O ATOM 854 CB TYR A 64 1.467 6.171 -2.127 1.00 0.00 C ATOM 855 CG TYR A 64 1.833 5.369 -3.357 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.169 5.018 -3.596 1.00 0.00 C ATOM 857 CD2 TYR A 64 0.836 4.980 -4.259 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.504 4.279 -4.737 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.172 4.241 -5.399 1.00 0.00 C ATOM 860 CZ TYR A 64 2.505 3.891 -5.639 1.00 0.00 C ATOM 861 OH TYR A 64 2.836 3.163 -6.764 1.00 0.00 O ATOM 0 H TYR A 64 0.861 8.479 -4.102 1.00 0.00 H new ATOM 0 HA TYR A 64 1.904 8.186 -1.412 1.00 0.00 H new ATOM 0 HB2 TYR A 64 2.024 5.804 -1.265 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.408 6.043 -1.901 1.00 0.00 H new ATOM 0 HD1 TYR A 64 3.939 5.317 -2.901 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -0.193 5.250 -4.075 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.533 4.008 -4.922 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.402 3.941 -6.094 1.00 0.00 H new ATOM 0 HH TYR A 64 2.026 2.975 -7.282 1.00 0.00 H new ATOM 871 N THR A 65 4.182 8.000 -2.461 1.00 0.00 N ATOM 872 CA THR A 65 5.477 8.187 -3.179 1.00 0.00 C ATOM 873 C THR A 65 6.447 7.063 -2.814 1.00 0.00 C ATOM 874 O THR A 65 7.189 7.158 -1.858 1.00 0.00 O ATOM 875 CB THR A 65 6.009 9.535 -2.691 1.00 0.00 C ATOM 876 OG1 THR A 65 5.108 10.565 -3.075 1.00 0.00 O ATOM 877 CG2 THR A 65 7.383 9.799 -3.310 1.00 0.00 C ATOM 0 H THR A 65 4.243 8.009 -1.443 1.00 0.00 H new ATOM 0 HA THR A 65 5.357 8.165 -4.262 1.00 0.00 H new ATOM 0 HB THR A 65 6.101 9.518 -1.605 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.492 11.437 -2.847 1.00 0.00 H new ATOM 0 HG21 THR A 65 7.761 10.760 -2.961 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.073 9.009 -3.014 1.00 0.00 H new ATOM 0 HG23 THR A 65 7.295 9.816 -4.396 1.00 0.00 H new ATOM 885 N ALA A 66 6.443 5.998 -3.568 1.00 0.00 N ATOM 886 CA ALA A 66 7.363 4.864 -3.259 1.00 0.00 C ATOM 887 C ALA A 66 8.699 5.049 -3.980 1.00 0.00 C ATOM 888 O ALA A 66 8.753 5.517 -5.099 1.00 0.00 O ATOM 889 CB ALA A 66 6.645 3.617 -3.776 1.00 0.00 C ATOM 0 H ALA A 66 5.845 5.863 -4.383 1.00 0.00 H new ATOM 0 HA ALA A 66 7.585 4.796 -2.194 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.260 2.738 -3.585 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.689 3.509 -3.264 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.474 3.714 -4.848 1.00 0.00 H new ATOM 895 N THR A 67 9.778 4.679 -3.348 1.00 0.00 N ATOM 896 CA THR A 67 11.111 4.828 -3.999 1.00 0.00 C ATOM 897 C THR A 67 12.019 3.657 -3.618 1.00 0.00 C ATOM 898 O THR A 67 12.368 3.477 -2.468 1.00 0.00 O ATOM 899 CB THR A 67 11.677 6.142 -3.458 1.00 0.00 C ATOM 900 OG1 THR A 67 10.821 7.213 -3.829 1.00 0.00 O ATOM 901 CG2 THR A 67 13.073 6.374 -4.043 1.00 0.00 C ATOM 0 H THR A 67 9.795 4.280 -2.409 1.00 0.00 H new ATOM 0 HA THR A 67 11.038 4.835 -5.087 1.00 0.00 H new ATOM 0 HB THR A 67 11.744 6.091 -2.371 1.00 0.00 H new ATOM 0 HG1 THR A 67 11.089 8.026 -3.353 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.478 7.310 -3.658 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.728 5.551 -3.758 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.008 6.426 -5.130 1.00 0.00 H new ATOM 909 N ALA A 68 12.408 2.863 -4.576 1.00 0.00 N ATOM 910 CA ALA A 68 13.297 1.707 -4.270 1.00 0.00 C ATOM 911 C ALA A 68 14.698 1.967 -4.826 1.00 0.00 C ATOM 912 O ALA A 68 14.866 2.257 -5.994 1.00 0.00 O ATOM 913 CB ALA A 68 12.656 0.506 -4.974 1.00 0.00 C ATOM 0 H ALA A 68 12.149 2.964 -5.557 1.00 0.00 H new ATOM 0 HA ALA A 68 13.400 1.538 -3.198 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.257 -0.385 -4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 68 11.650 0.350 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 68 12.604 0.697 -6.046 1.00 0.00 H new ATOM 919 N SER A 69 15.706 1.861 -4.003 1.00 0.00 N ATOM 920 CA SER A 69 17.092 2.098 -4.497 1.00 0.00 C ATOM 921 C SER A 69 17.282 1.400 -5.845 1.00 0.00 C ATOM 922 O SER A 69 18.091 1.799 -6.658 1.00 0.00 O ATOM 923 CB SER A 69 18.004 1.481 -3.438 1.00 0.00 C ATOM 924 OG SER A 69 18.551 2.515 -2.629 1.00 0.00 O ATOM 0 H SER A 69 15.630 1.622 -3.014 1.00 0.00 H new ATOM 0 HA SER A 69 17.309 3.156 -4.646 1.00 0.00 H new ATOM 0 HB2 SER A 69 17.442 0.780 -2.821 1.00 0.00 H new ATOM 0 HB3 SER A 69 18.804 0.915 -3.915 1.00 0.00 H new ATOM 0 HG SER A 69 19.135 2.122 -1.947 1.00 0.00 H new ATOM 930 N THR A 70 16.533 0.358 -6.082 1.00 0.00 N ATOM 931 CA THR A 70 16.654 -0.376 -7.372 1.00 0.00 C ATOM 932 C THR A 70 15.397 -0.154 -8.222 1.00 0.00 C ATOM 933 O THR A 70 14.402 0.361 -7.752 1.00 0.00 O ATOM 934 CB THR A 70 16.778 -1.850 -6.965 1.00 0.00 C ATOM 935 OG1 THR A 70 17.380 -2.582 -8.023 1.00 0.00 O ATOM 936 CG2 THR A 70 15.388 -2.427 -6.668 1.00 0.00 C ATOM 0 H THR A 70 15.840 -0.017 -5.435 1.00 0.00 H new ATOM 0 HA THR A 70 17.502 -0.042 -7.969 1.00 0.00 H new ATOM 0 HB THR A 70 17.395 -1.926 -6.070 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.462 -3.524 -7.764 1.00 0.00 H new ATOM 0 HG21 THR A 70 15.483 -3.474 -6.380 1.00 0.00 H new ATOM 0 HG22 THR A 70 14.928 -1.867 -5.854 1.00 0.00 H new ATOM 0 HG23 THR A 70 14.765 -2.351 -7.559 1.00 0.00 H new ATOM 944 N ASP A 71 15.426 -0.560 -9.461 1.00 0.00 N ATOM 945 CA ASP A 71 14.223 -0.394 -10.324 1.00 0.00 C ATOM 946 C ASP A 71 13.309 -1.608 -10.143 1.00 0.00 C ATOM 947 O ASP A 71 12.917 -2.254 -11.094 1.00 0.00 O ATOM 948 CB ASP A 71 14.761 -0.329 -11.754 1.00 0.00 C ATOM 949 CG ASP A 71 13.688 0.250 -12.678 1.00 0.00 C ATOM 950 OD1 ASP A 71 13.443 1.442 -12.595 1.00 0.00 O ATOM 951 OD2 ASP A 71 13.130 -0.509 -13.454 1.00 0.00 O ATOM 0 H ASP A 71 16.229 -0.999 -9.912 1.00 0.00 H new ATOM 0 HA ASP A 71 13.643 0.496 -10.079 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.658 0.290 -11.789 1.00 0.00 H new ATOM 0 HB3 ASP A 71 15.048 -1.325 -12.092 1.00 0.00 H new ATOM 956 N VAL A 72 12.989 -1.932 -8.919 1.00 0.00 N ATOM 957 CA VAL A 72 12.123 -3.116 -8.656 1.00 0.00 C ATOM 958 C VAL A 72 10.705 -2.899 -9.190 1.00 0.00 C ATOM 959 O VAL A 72 10.103 -1.864 -8.992 1.00 0.00 O ATOM 960 CB VAL A 72 12.102 -3.262 -7.131 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.137 -2.242 -6.521 1.00 0.00 C ATOM 962 CG2 VAL A 72 11.638 -4.671 -6.764 1.00 0.00 C ATOM 0 H VAL A 72 13.292 -1.425 -8.087 1.00 0.00 H new ATOM 0 HA VAL A 72 12.504 -4.008 -9.154 1.00 0.00 H new ATOM 0 HB VAL A 72 13.105 -3.087 -6.742 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.128 -2.353 -5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.461 -1.234 -6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.134 -2.412 -6.911 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.622 -4.778 -5.679 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.636 -4.839 -7.160 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.324 -5.403 -7.191 1.00 0.00 H new ATOM 972 N THR A 73 10.164 -3.887 -9.844 1.00 0.00 N ATOM 973 CA THR A 73 8.776 -3.770 -10.371 1.00 0.00 C ATOM 974 C THR A 73 7.920 -4.865 -9.738 1.00 0.00 C ATOM 975 O THR A 73 7.676 -5.898 -10.329 1.00 0.00 O ATOM 976 CB THR A 73 8.894 -3.979 -11.881 1.00 0.00 C ATOM 977 OG1 THR A 73 9.753 -2.988 -12.429 1.00 0.00 O ATOM 978 CG2 THR A 73 7.509 -3.869 -12.522 1.00 0.00 C ATOM 0 H THR A 73 10.626 -4.776 -10.038 1.00 0.00 H new ATOM 0 HA THR A 73 8.314 -2.809 -10.145 1.00 0.00 H new ATOM 0 HB THR A 73 9.307 -4.968 -12.081 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.831 -3.122 -13.397 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.593 -4.018 -13.598 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.852 -4.630 -12.101 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.094 -2.881 -12.324 1.00 0.00 H new ATOM 986 N VAL A 74 7.480 -4.656 -8.528 1.00 0.00 N ATOM 987 CA VAL A 74 6.662 -5.695 -7.847 1.00 0.00 C ATOM 988 C VAL A 74 5.177 -5.485 -8.144 1.00 0.00 C ATOM 989 O VAL A 74 4.801 -5.129 -9.243 1.00 0.00 O ATOM 990 CB VAL A 74 6.962 -5.507 -6.360 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.477 -5.479 -6.147 1.00 0.00 C ATOM 992 CG2 VAL A 74 6.366 -4.184 -5.883 1.00 0.00 C ATOM 0 H VAL A 74 7.652 -3.811 -7.983 1.00 0.00 H new ATOM 0 HA VAL A 74 6.899 -6.704 -8.184 1.00 0.00 H new ATOM 0 HB VAL A 74 6.525 -6.331 -5.796 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.693 -5.345 -5.087 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.910 -6.419 -6.490 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.909 -4.653 -6.712 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.580 -4.050 -4.823 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.805 -3.362 -6.449 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.287 -4.195 -6.037 1.00 0.00 H new ATOM 1002 N ARG A 75 4.327 -5.714 -7.181 1.00 0.00 N ATOM 1003 CA ARG A 75 2.867 -5.535 -7.426 1.00 0.00 C ATOM 1004 C ARG A 75 2.234 -4.676 -6.326 1.00 0.00 C ATOM 1005 O ARG A 75 2.622 -4.735 -5.177 1.00 0.00 O ATOM 1006 CB ARG A 75 2.292 -6.952 -7.400 1.00 0.00 C ATOM 1007 CG ARG A 75 2.319 -7.541 -8.812 1.00 0.00 C ATOM 1008 CD ARG A 75 0.911 -7.996 -9.203 1.00 0.00 C ATOM 1009 NE ARG A 75 0.128 -6.738 -9.353 1.00 0.00 N ATOM 1010 CZ ARG A 75 -1.099 -6.782 -9.795 1.00 0.00 C ATOM 1011 NH1 ARG A 75 -1.973 -7.561 -9.219 1.00 0.00 N ATOM 1012 NH2 ARG A 75 -1.452 -6.046 -10.813 1.00 0.00 N ATOM 0 H ARG A 75 4.578 -6.016 -6.240 1.00 0.00 H new ATOM 0 HA ARG A 75 2.668 -5.025 -8.369 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.872 -7.579 -6.722 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.270 -6.934 -7.022 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.682 -6.797 -9.521 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.009 -8.384 -8.853 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.924 -8.566 -10.132 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.478 -8.642 -8.439 1.00 0.00 H new ATOM 0 HE ARG A 75 0.551 -5.842 -9.110 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -1.697 -8.136 -8.423 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -2.932 -7.595 -9.565 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -0.769 -5.437 -11.263 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.411 -6.080 -11.159 1.00 0.00 H new ATOM 1026 N ALA A 76 1.256 -3.885 -6.672 1.00 0.00 N ATOM 1027 CA ALA A 76 0.584 -3.028 -5.651 1.00 0.00 C ATOM 1028 C ALA A 76 -0.899 -2.881 -6.000 1.00 0.00 C ATOM 1029 O ALA A 76 -1.281 -2.932 -7.156 1.00 0.00 O ATOM 1030 CB ALA A 76 1.294 -1.675 -5.719 1.00 0.00 C ATOM 0 H ALA A 76 0.891 -3.794 -7.620 1.00 0.00 H new ATOM 0 HA ALA A 76 0.641 -3.454 -4.649 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.850 -0.994 -4.993 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.352 -1.807 -5.492 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.187 -1.258 -6.720 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.740 -2.708 -5.015 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.195 -2.570 -5.300 1.00 0.00 C ATOM 1038 C LEU A 77 -3.993 -2.487 -3.992 1.00 0.00 C ATOM 1039 O LEU A 77 -3.464 -2.157 -2.949 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.562 -3.839 -6.076 1.00 0.00 C ATOM 1041 CG LEU A 77 -2.929 -5.056 -5.399 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -3.566 -5.266 -4.024 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -3.162 -6.298 -6.263 1.00 0.00 C ATOM 0 H LEU A 77 -1.482 -2.657 -4.029 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.422 -1.664 -5.862 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.645 -3.954 -6.114 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.214 -3.761 -7.106 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.858 -4.889 -5.281 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.114 -6.133 -3.542 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.401 -4.382 -3.408 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.637 -5.432 -4.141 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.711 -7.166 -5.782 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.233 -6.464 -6.381 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.708 -6.150 -7.243 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.262 -2.787 -4.046 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.107 -2.733 -2.818 1.00 0.00 C ATOM 1057 C VAL A 78 -7.164 -3.839 -2.882 1.00 0.00 C ATOM 1058 O VAL A 78 -7.367 -4.446 -3.915 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.766 -1.353 -2.854 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.371 -1.034 -1.486 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.715 -0.297 -3.202 1.00 0.00 C ATOM 0 H VAL A 78 -5.754 -3.069 -4.894 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.535 -2.881 -1.902 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.554 -1.349 -3.607 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.839 -0.050 -1.516 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.120 -1.785 -1.235 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.585 -1.039 -0.731 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.183 0.687 -3.228 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.928 -0.305 -2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.284 -0.520 -4.178 1.00 0.00 H new ATOM 1071 N GLY A 79 -7.839 -4.114 -1.800 1.00 0.00 N ATOM 1072 CA GLY A 79 -8.871 -5.189 -1.841 1.00 0.00 C ATOM 1073 C GLY A 79 -9.570 -5.310 -0.487 1.00 0.00 C ATOM 1074 O GLY A 79 -9.385 -4.497 0.398 1.00 0.00 O ATOM 0 H GLY A 79 -7.724 -3.648 -0.900 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.604 -4.969 -2.617 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.405 -6.139 -2.103 1.00 0.00 H new ATOM 1078 N GLN A 80 -10.376 -6.324 -0.324 1.00 0.00 N ATOM 1079 CA GLN A 80 -11.099 -6.513 0.966 1.00 0.00 C ATOM 1080 C GLN A 80 -10.613 -7.786 1.663 1.00 0.00 C ATOM 1081 O GLN A 80 -10.992 -8.884 1.305 1.00 0.00 O ATOM 1082 CB GLN A 80 -12.570 -6.647 0.573 1.00 0.00 C ATOM 1083 CG GLN A 80 -13.365 -7.217 1.749 1.00 0.00 C ATOM 1084 CD GLN A 80 -13.181 -6.319 2.973 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -12.584 -5.265 2.884 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -13.673 -6.695 4.122 1.00 0.00 N ATOM 0 H GLN A 80 -10.566 -7.033 -1.032 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.933 -5.689 1.660 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -12.971 -5.674 0.287 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.667 -7.299 -0.295 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.421 -7.283 1.489 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.028 -8.229 1.973 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.174 -7.580 4.197 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -13.556 -6.104 4.945 1.00 0.00 H new ATOM 1095 N ASN A 81 -9.778 -7.651 2.656 1.00 0.00 N ATOM 1096 CA ASN A 81 -9.271 -8.856 3.373 1.00 0.00 C ATOM 1097 C ASN A 81 -10.428 -9.593 4.054 1.00 0.00 C ATOM 1098 O ASN A 81 -10.827 -9.260 5.153 1.00 0.00 O ATOM 1099 CB ASN A 81 -8.291 -8.315 4.415 1.00 0.00 C ATOM 1100 CG ASN A 81 -6.891 -8.234 3.805 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -6.761 -8.160 2.508 1.00 0.00 O flip ATOM 1102 ND2 ASN A 81 -5.905 -8.239 4.515 1.00 0.00 N flip ATOM 0 H ASN A 81 -9.425 -6.759 3.002 1.00 0.00 H new ATOM 0 HA ASN A 81 -8.795 -9.568 2.698 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -8.610 -7.329 4.752 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -8.281 -8.963 5.291 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -6.006 -8.297 5.528 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.976 -8.185 4.098 1.00 0.00 H new ATOM 1109 N GLY A 82 -10.969 -10.592 3.411 1.00 0.00 N ATOM 1110 CA GLY A 82 -12.098 -11.348 4.022 1.00 0.00 C ATOM 1111 C GLY A 82 -13.330 -11.248 3.120 1.00 0.00 C ATOM 1112 O GLY A 82 -13.717 -10.177 2.699 1.00 0.00 O ATOM 0 H GLY A 82 -10.678 -10.917 2.489 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.818 -12.393 4.158 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -12.325 -10.948 5.010 1.00 0.00 H new ATOM 1116 N ALA A 83 -13.949 -12.358 2.821 1.00 0.00 N ATOM 1117 CA ALA A 83 -15.156 -12.325 1.945 1.00 0.00 C ATOM 1118 C ALA A 83 -16.070 -11.162 2.347 1.00 0.00 C ATOM 1119 O ALA A 83 -16.059 -10.735 3.485 1.00 0.00 O ATOM 1120 CB ALA A 83 -15.855 -13.664 2.185 1.00 0.00 C ATOM 0 H ALA A 83 -13.672 -13.285 3.145 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.901 -12.180 0.895 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.756 -13.719 1.574 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.183 -14.479 1.914 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -16.124 -13.750 3.238 1.00 0.00 H new ATOM 1126 N PRO A 84 -16.837 -10.681 1.397 1.00 0.00 N ATOM 1127 CA PRO A 84 -16.814 -11.238 0.019 1.00 0.00 C ATOM 1128 C PRO A 84 -15.594 -10.730 -0.761 1.00 0.00 C ATOM 1129 O PRO A 84 -15.509 -10.890 -1.962 1.00 0.00 O ATOM 1130 CB PRO A 84 -18.102 -10.707 -0.600 1.00 0.00 C ATOM 1131 CG PRO A 84 -18.423 -9.458 0.162 1.00 0.00 C ATOM 1132 CD PRO A 84 -17.796 -9.580 1.529 1.00 0.00 C ATOM 0 HA PRO A 84 -16.747 -12.326 0.006 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -17.970 -10.497 -1.661 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -18.908 -11.436 -0.517 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.036 -8.582 -0.359 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -19.502 -9.328 0.246 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.300 -8.655 1.822 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -18.545 -9.795 2.291 1.00 0.00 H new ATOM 1140 N TYR A 85 -14.654 -10.115 -0.094 1.00 0.00 N ATOM 1141 CA TYR A 85 -13.448 -9.596 -0.805 1.00 0.00 C ATOM 1142 C TYR A 85 -13.857 -8.550 -1.845 1.00 0.00 C ATOM 1143 O TYR A 85 -14.918 -7.962 -1.766 1.00 0.00 O ATOM 1144 CB TYR A 85 -12.825 -10.814 -1.492 1.00 0.00 C ATOM 1145 CG TYR A 85 -12.677 -11.943 -0.498 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -11.813 -11.805 0.595 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -13.400 -13.129 -0.674 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -11.673 -12.854 1.513 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -13.260 -14.177 0.244 1.00 0.00 C ATOM 1150 CZ TYR A 85 -12.397 -14.039 1.337 1.00 0.00 C ATOM 1151 OH TYR A 85 -12.259 -15.072 2.242 1.00 0.00 O ATOM 0 H TYR A 85 -14.669 -9.949 0.912 1.00 0.00 H new ATOM 0 HA TYR A 85 -12.748 -9.114 -0.122 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -13.450 -11.132 -2.326 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.851 -10.551 -1.905 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -11.255 -10.890 0.730 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.066 -13.236 -1.518 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -11.007 -12.748 2.356 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.818 -15.092 0.109 1.00 0.00 H new ATOM 0 HH TYR A 85 -12.832 -15.821 1.974 1.00 0.00 H new ATOM 1161 N GLY A 86 -13.021 -8.312 -2.818 1.00 0.00 N ATOM 1162 CA GLY A 86 -13.357 -7.303 -3.862 1.00 0.00 C ATOM 1163 C GLY A 86 -12.131 -6.431 -4.139 1.00 0.00 C ATOM 1164 O GLY A 86 -11.816 -5.530 -3.387 1.00 0.00 O ATOM 0 H GLY A 86 -12.119 -8.773 -2.935 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.676 -7.802 -4.777 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.190 -6.683 -3.530 1.00 0.00 H new ATOM 1168 N THR A 87 -11.436 -6.692 -5.212 1.00 0.00 N ATOM 1169 CA THR A 87 -10.229 -5.877 -5.533 1.00 0.00 C ATOM 1170 C THR A 87 -10.617 -4.673 -6.394 1.00 0.00 C ATOM 1171 O THR A 87 -11.435 -4.773 -7.287 1.00 0.00 O ATOM 1172 CB THR A 87 -9.310 -6.819 -6.312 1.00 0.00 C ATOM 1173 OG1 THR A 87 -10.090 -7.617 -7.192 1.00 0.00 O ATOM 1174 CG2 THR A 87 -8.553 -7.720 -5.336 1.00 0.00 C ATOM 0 H THR A 87 -11.651 -7.433 -5.880 1.00 0.00 H new ATOM 0 HA THR A 87 -9.746 -5.485 -4.638 1.00 0.00 H new ATOM 0 HB THR A 87 -8.594 -6.234 -6.890 1.00 0.00 H new ATOM 0 HG1 THR A 87 -9.503 -8.220 -7.694 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.899 -8.391 -5.893 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.955 -7.106 -4.663 1.00 0.00 H new ATOM 0 HG23 THR A 87 -9.265 -8.307 -4.756 1.00 0.00 H new ATOM 1182 N VAL A 88 -10.036 -3.535 -6.133 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.369 -2.324 -6.936 1.00 0.00 C ATOM 1184 C VAL A 88 -9.113 -1.789 -7.629 1.00 0.00 C ATOM 1185 O VAL A 88 -9.189 -1.012 -8.560 1.00 0.00 O ATOM 1186 CB VAL A 88 -10.896 -1.310 -5.920 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.091 -1.908 -5.175 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -9.790 -0.973 -4.918 1.00 0.00 C ATOM 0 H VAL A 88 -9.344 -3.391 -5.398 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.098 -2.533 -7.719 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.207 -0.404 -6.439 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.467 -1.185 -4.451 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.879 -2.151 -5.887 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -11.779 -2.814 -4.655 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.164 -0.250 -4.193 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.480 -1.880 -4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -8.937 -0.548 -5.447 1.00 0.00 H new ATOM 1198 N LEU A 89 -7.958 -2.203 -7.184 1.00 0.00 N ATOM 1199 CA LEU A 89 -6.697 -1.721 -7.818 1.00 0.00 C ATOM 1200 C LEU A 89 -5.902 -2.886 -8.411 1.00 0.00 C ATOM 1201 O LEU A 89 -5.802 -3.946 -7.827 1.00 0.00 O ATOM 1202 CB LEU A 89 -5.911 -1.064 -6.698 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.248 0.419 -6.666 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.548 0.632 -5.894 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.111 1.168 -5.983 1.00 0.00 C ATOM 0 H LEU A 89 -7.833 -2.854 -6.409 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.900 -1.032 -8.638 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.157 -1.527 -5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.842 -1.205 -6.855 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.375 0.793 -7.682 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -7.788 1.695 -5.872 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.355 0.088 -6.384 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.430 0.266 -4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.342 2.233 -5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.989 0.796 -4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.187 1.012 -6.539 1.00 0.00 H new ATOM 1217 N ASP A 90 -5.331 -2.690 -9.565 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.531 -3.778 -10.200 1.00 0.00 C ATOM 1219 C ASP A 90 -3.433 -3.174 -11.081 1.00 0.00 C ATOM 1220 O ASP A 90 -3.609 -3.008 -12.272 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.531 -4.562 -11.050 1.00 0.00 C ATOM 1222 CG ASP A 90 -4.865 -5.832 -11.582 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -4.571 -6.703 -10.780 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -4.659 -5.911 -12.782 1.00 0.00 O ATOM 0 H ASP A 90 -5.383 -1.822 -10.099 1.00 0.00 H new ATOM 0 HA ASP A 90 -4.038 -4.414 -9.465 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.407 -4.820 -10.454 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.880 -3.947 -11.880 1.00 0.00 H new ATOM 1229 N THR A 91 -2.304 -2.838 -10.514 1.00 0.00 N ATOM 1230 CA THR A 91 -1.216 -2.241 -11.344 1.00 0.00 C ATOM 1231 C THR A 91 0.157 -2.735 -10.880 1.00 0.00 C ATOM 1232 O THR A 91 0.267 -3.569 -10.002 1.00 0.00 O ATOM 1233 CB THR A 91 -1.343 -0.732 -11.129 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.652 -0.473 -9.767 1.00 0.00 O ATOM 1235 CG2 THR A 91 -2.455 -0.179 -12.022 1.00 0.00 C ATOM 0 H THR A 91 -2.089 -2.949 -9.523 1.00 0.00 H new ATOM 0 HA THR A 91 -1.305 -2.519 -12.394 1.00 0.00 H new ATOM 0 HB THR A 91 -0.401 -0.248 -11.385 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.732 0.494 -9.628 1.00 0.00 H new ATOM 0 HG21 THR A 91 -2.545 0.896 -11.868 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.215 -0.377 -13.067 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.399 -0.662 -11.769 1.00 0.00 H new ATOM 1243 N SER A 92 1.205 -2.220 -11.466 1.00 0.00 N ATOM 1244 CA SER A 92 2.576 -2.651 -11.066 1.00 0.00 C ATOM 1245 C SER A 92 3.369 -1.449 -10.544 1.00 0.00 C ATOM 1246 O SER A 92 3.690 -0.545 -11.288 1.00 0.00 O ATOM 1247 CB SER A 92 3.210 -3.195 -12.346 1.00 0.00 C ATOM 1248 OG SER A 92 2.185 -3.590 -13.248 1.00 0.00 O ATOM 0 H SER A 92 1.171 -1.518 -12.206 1.00 0.00 H new ATOM 0 HA SER A 92 2.562 -3.397 -10.271 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.840 -2.433 -12.805 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.853 -4.044 -12.114 1.00 0.00 H new ATOM 0 HG SER A 92 2.589 -3.938 -14.070 1.00 0.00 H new ATOM 1254 N PRO A 93 3.652 -1.482 -9.271 1.00 0.00 N ATOM 1255 CA PRO A 93 4.410 -0.382 -8.624 1.00 0.00 C ATOM 1256 C PRO A 93 5.875 -0.385 -9.070 1.00 0.00 C ATOM 1257 O PRO A 93 6.712 -1.041 -8.481 1.00 0.00 O ATOM 1258 CB PRO A 93 4.299 -0.699 -7.135 1.00 0.00 C ATOM 1259 CG PRO A 93 4.055 -2.171 -7.073 1.00 0.00 C ATOM 1260 CD PRO A 93 3.297 -2.539 -8.319 1.00 0.00 C ATOM 0 HA PRO A 93 4.023 0.604 -8.882 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.211 -0.427 -6.604 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.483 -0.143 -6.672 1.00 0.00 H new ATOM 0 HG2 PRO A 93 4.997 -2.717 -7.018 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.484 -2.431 -6.182 1.00 0.00 H new ATOM 0 HD2 PRO A 93 3.587 -3.523 -8.688 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.222 -2.570 -8.139 1.00 0.00 H new ATOM 1268 N ALA A 94 6.195 0.357 -10.095 1.00 0.00 N ATOM 1269 CA ALA A 94 7.610 0.410 -10.563 1.00 0.00 C ATOM 1270 C ALA A 94 8.377 1.451 -9.744 1.00 0.00 C ATOM 1271 O ALA A 94 7.939 2.572 -9.590 1.00 0.00 O ATOM 1272 CB ALA A 94 7.530 0.829 -12.031 1.00 0.00 C ATOM 0 H ALA A 94 5.539 0.928 -10.628 1.00 0.00 H new ATOM 0 HA ALA A 94 8.128 -0.542 -10.448 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.536 0.890 -12.447 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.951 0.093 -12.588 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.047 1.803 -12.106 1.00 0.00 H new ATOM 1278 N LEU A 95 9.509 1.092 -9.207 1.00 0.00 N ATOM 1279 CA LEU A 95 10.282 2.070 -8.388 1.00 0.00 C ATOM 1280 C LEU A 95 11.667 2.318 -8.989 1.00 0.00 C ATOM 1281 O LEU A 95 12.018 1.779 -10.020 1.00 0.00 O ATOM 1282 CB LEU A 95 10.407 1.421 -7.014 1.00 0.00 C ATOM 1283 CG LEU A 95 9.231 1.857 -6.144 1.00 0.00 C ATOM 1284 CD1 LEU A 95 7.956 1.167 -6.628 1.00 0.00 C ATOM 1285 CD2 LEU A 95 9.505 1.471 -4.690 1.00 0.00 C ATOM 0 H LEU A 95 9.932 0.168 -9.298 1.00 0.00 H new ATOM 0 HA LEU A 95 9.787 3.040 -8.345 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.420 0.335 -7.111 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.348 1.710 -6.546 1.00 0.00 H new ATOM 0 HG LEU A 95 9.105 2.937 -6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 95 7.116 1.478 -6.007 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.763 1.444 -7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.078 0.086 -6.558 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.666 1.782 -4.067 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.630 0.391 -4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 95 10.414 1.965 -4.347 1.00 0.00 H new ATOM 1297 N THR A 96 12.453 3.136 -8.344 1.00 0.00 N ATOM 1298 CA THR A 96 13.820 3.434 -8.859 1.00 0.00 C ATOM 1299 C THR A 96 14.526 4.415 -7.921 1.00 0.00 C ATOM 1300 O THR A 96 13.985 4.820 -6.911 1.00 0.00 O ATOM 1301 CB THR A 96 13.607 4.067 -10.237 1.00 0.00 C ATOM 1302 OG1 THR A 96 14.783 4.765 -10.622 1.00 0.00 O ATOM 1303 CG2 THR A 96 12.429 5.043 -10.185 1.00 0.00 C ATOM 0 H THR A 96 12.206 3.614 -7.477 1.00 0.00 H new ATOM 0 HA THR A 96 14.441 2.541 -8.920 1.00 0.00 H new ATOM 0 HB THR A 96 13.391 3.283 -10.963 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.649 5.169 -11.505 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.283 5.490 -11.168 1.00 0.00 H new ATOM 0 HG22 THR A 96 11.526 4.508 -9.892 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.638 5.827 -9.458 1.00 0.00 H new ATOM 1311 N SER A 97 15.727 4.802 -8.245 1.00 0.00 N ATOM 1312 CA SER A 97 16.462 5.758 -7.367 1.00 0.00 C ATOM 1313 C SER A 97 15.705 7.087 -7.284 1.00 0.00 C ATOM 1314 O SER A 97 15.997 7.928 -6.457 1.00 0.00 O ATOM 1315 CB SER A 97 17.821 5.949 -8.039 1.00 0.00 C ATOM 1316 OG SER A 97 18.116 7.338 -8.124 1.00 0.00 O ATOM 0 H SER A 97 16.232 4.499 -9.078 1.00 0.00 H new ATOM 0 HA SER A 97 16.564 5.389 -6.346 1.00 0.00 H new ATOM 0 HB2 SER A 97 18.596 5.436 -7.469 1.00 0.00 H new ATOM 0 HB3 SER A 97 17.812 5.506 -9.035 1.00 0.00 H new ATOM 0 HG SER A 97 18.988 7.461 -8.553 1.00 0.00 H new ATOM 1322 N GLU A 98 14.734 7.281 -8.133 1.00 0.00 N ATOM 1323 CA GLU A 98 13.959 8.555 -8.100 1.00 0.00 C ATOM 1324 C GLU A 98 12.632 8.345 -7.366 1.00 0.00 C ATOM 1325 O GLU A 98 12.157 7.233 -7.246 1.00 0.00 O ATOM 1326 CB GLU A 98 13.710 8.904 -9.568 1.00 0.00 C ATOM 1327 CG GLU A 98 14.853 9.779 -10.086 1.00 0.00 C ATOM 1328 CD GLU A 98 14.445 11.251 -10.010 1.00 0.00 C ATOM 1329 OE1 GLU A 98 13.285 11.537 -10.258 1.00 0.00 O ATOM 1330 OE2 GLU A 98 15.298 12.067 -9.706 1.00 0.00 O ATOM 0 H GLU A 98 14.443 6.614 -8.848 1.00 0.00 H new ATOM 0 HA GLU A 98 14.490 9.350 -7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.637 7.993 -10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.760 9.429 -9.672 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.752 9.609 -9.494 1.00 0.00 H new ATOM 0 HG3 GLU A 98 15.093 9.510 -11.115 1.00 0.00 H new ATOM 1337 N PRO A 99 12.077 9.429 -6.898 1.00 0.00 N ATOM 1338 CA PRO A 99 10.788 9.370 -6.165 1.00 0.00 C ATOM 1339 C PRO A 99 9.637 9.086 -7.134 1.00 0.00 C ATOM 1340 O PRO A 99 9.596 9.603 -8.232 1.00 0.00 O ATOM 1341 CB PRO A 99 10.656 10.764 -5.560 1.00 0.00 C ATOM 1342 CG PRO A 99 11.482 11.649 -6.439 1.00 0.00 C ATOM 1343 CD PRO A 99 12.591 10.799 -7.005 1.00 0.00 C ATOM 0 HA PRO A 99 10.757 8.580 -5.414 1.00 0.00 H new ATOM 0 HB2 PRO A 99 9.616 11.088 -5.540 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.016 10.783 -4.531 1.00 0.00 H new ATOM 0 HG2 PRO A 99 10.875 12.073 -7.239 1.00 0.00 H new ATOM 0 HG3 PRO A 99 11.889 12.485 -5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 99 12.809 11.064 -8.040 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.516 10.923 -6.442 1.00 0.00 H new ATOM 1351 N ARG A 100 8.701 8.269 -6.736 1.00 0.00 N ATOM 1352 CA ARG A 100 7.556 7.958 -7.639 1.00 0.00 C ATOM 1353 C ARG A 100 6.236 8.374 -6.988 1.00 0.00 C ATOM 1354 O ARG A 100 5.639 7.625 -6.236 1.00 0.00 O ATOM 1355 CB ARG A 100 7.597 6.443 -7.838 1.00 0.00 C ATOM 1356 CG ARG A 100 6.264 5.973 -8.427 1.00 0.00 C ATOM 1357 CD ARG A 100 6.446 4.599 -9.072 1.00 0.00 C ATOM 1358 NE ARG A 100 7.347 4.837 -10.233 1.00 0.00 N ATOM 1359 CZ ARG A 100 6.878 5.379 -11.323 1.00 0.00 C ATOM 1360 NH1 ARG A 100 6.888 6.677 -11.463 1.00 0.00 N ATOM 1361 NH2 ARG A 100 6.398 4.624 -12.274 1.00 0.00 N ATOM 0 H ARG A 100 8.679 7.805 -5.828 1.00 0.00 H new ATOM 0 HA ARG A 100 7.628 8.494 -8.585 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.417 6.174 -8.504 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.783 5.945 -6.887 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.507 5.921 -7.645 1.00 0.00 H new ATOM 0 HG3 ARG A 100 5.909 6.690 -9.168 1.00 0.00 H new ATOM 0 HD2 ARG A 100 6.884 3.888 -8.371 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.491 4.183 -9.392 1.00 0.00 H new ATOM 0 HE ARG A 100 8.331 4.576 -10.176 1.00 0.00 H new ATOM 0 HH11 ARG A 100 7.263 7.267 -10.720 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.521 7.101 -12.315 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.390 3.610 -12.165 1.00 0.00 H new ATOM 0 HH22 ARG A 100 6.031 5.048 -13.126 1.00 0.00 H new ATOM 1375 N GLN A 101 5.771 9.557 -7.279 1.00 0.00 N ATOM 1376 CA GLN A 101 4.483 10.017 -6.689 1.00 0.00 C ATOM 1377 C GLN A 101 3.316 9.512 -7.542 1.00 0.00 C ATOM 1378 O GLN A 101 2.922 10.139 -8.506 1.00 0.00 O ATOM 1379 CB GLN A 101 4.553 11.544 -6.720 1.00 0.00 C ATOM 1380 CG GLN A 101 5.118 12.057 -5.394 1.00 0.00 C ATOM 1381 CD GLN A 101 5.352 13.565 -5.487 1.00 0.00 C ATOM 1382 OE1 GLN A 101 6.458 14.033 -5.304 1.00 0.00 O ATOM 1383 NE2 GLN A 101 4.349 14.353 -5.766 1.00 0.00 N ATOM 0 H GLN A 101 6.227 10.225 -7.900 1.00 0.00 H new ATOM 0 HA GLN A 101 4.329 9.643 -5.677 1.00 0.00 H new ATOM 0 HB2 GLN A 101 5.182 11.873 -7.547 1.00 0.00 H new ATOM 0 HB3 GLN A 101 3.560 11.961 -6.890 1.00 0.00 H new ATOM 0 HG2 GLN A 101 4.426 11.835 -4.582 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.053 11.547 -5.164 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.420 13.961 -5.920 1.00 0.00 H new ATOM 0 HE22 GLN A 101 4.495 15.361 -5.830 1.00 0.00 H new ATOM 1392 N VAL A 102 2.768 8.379 -7.201 1.00 0.00 N ATOM 1393 CA VAL A 102 1.636 7.827 -7.996 1.00 0.00 C ATOM 1394 C VAL A 102 0.301 8.348 -7.458 1.00 0.00 C ATOM 1395 O VAL A 102 0.055 8.349 -6.268 1.00 0.00 O ATOM 1396 CB VAL A 102 1.730 6.313 -7.813 1.00 0.00 C ATOM 1397 CG1 VAL A 102 0.434 5.659 -8.290 1.00 0.00 C ATOM 1398 CG2 VAL A 102 2.905 5.773 -8.631 1.00 0.00 C ATOM 0 H VAL A 102 3.056 7.811 -6.405 1.00 0.00 H new ATOM 0 HA VAL A 102 1.689 8.119 -9.045 1.00 0.00 H new ATOM 0 HB VAL A 102 1.885 6.084 -6.759 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.502 4.579 -8.159 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.403 6.043 -7.707 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.278 5.888 -9.344 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.973 4.693 -8.501 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.750 6.003 -9.685 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.830 6.238 -8.290 1.00 0.00 H new ATOM 1408 N THR A 103 -0.562 8.790 -8.331 1.00 0.00 N ATOM 1409 CA THR A 103 -1.884 9.312 -7.880 1.00 0.00 C ATOM 1410 C THR A 103 -2.938 9.079 -8.966 1.00 0.00 C ATOM 1411 O THR A 103 -2.734 9.402 -10.119 1.00 0.00 O ATOM 1412 CB THR A 103 -1.664 10.810 -7.659 1.00 0.00 C ATOM 1413 OG1 THR A 103 -0.280 11.057 -7.451 1.00 0.00 O ATOM 1414 CG2 THR A 103 -2.456 11.270 -6.435 1.00 0.00 C ATOM 0 H THR A 103 -0.409 8.812 -9.339 1.00 0.00 H new ATOM 0 HA THR A 103 -2.240 8.816 -6.977 1.00 0.00 H new ATOM 0 HB THR A 103 -2.005 11.361 -8.536 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.136 12.016 -7.311 1.00 0.00 H new ATOM 0 HG21 THR A 103 -2.298 12.337 -6.279 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.517 11.080 -6.596 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.118 10.721 -5.556 1.00 0.00 H new ATOM 1422 N GLU A 104 -4.062 8.521 -8.610 1.00 0.00 N ATOM 1423 CA GLU A 104 -5.121 8.271 -9.629 1.00 0.00 C ATOM 1424 C GLU A 104 -6.485 8.109 -8.953 1.00 0.00 C ATOM 1425 O GLU A 104 -6.607 7.486 -7.918 1.00 0.00 O ATOM 1426 CB GLU A 104 -4.707 6.970 -10.318 1.00 0.00 C ATOM 1427 CG GLU A 104 -3.792 7.289 -11.502 1.00 0.00 C ATOM 1428 CD GLU A 104 -4.082 6.319 -12.648 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -4.001 5.123 -12.420 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -4.380 6.788 -13.735 1.00 0.00 O ATOM 0 H GLU A 104 -4.293 8.228 -7.661 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.215 9.096 -10.335 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -4.192 6.320 -9.611 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.590 6.431 -10.662 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.951 8.316 -11.832 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -2.748 7.209 -11.200 1.00 0.00 H new ATOM 1437 N THR A 105 -7.513 8.666 -9.535 1.00 0.00 N ATOM 1438 CA THR A 105 -8.870 8.544 -8.929 1.00 0.00 C ATOM 1439 C THR A 105 -9.621 7.364 -9.552 1.00 0.00 C ATOM 1440 O THR A 105 -10.060 7.423 -10.683 1.00 0.00 O ATOM 1441 CB THR A 105 -9.572 9.863 -9.260 1.00 0.00 C ATOM 1442 OG1 THR A 105 -8.808 10.945 -8.748 1.00 0.00 O ATOM 1443 CG2 THR A 105 -10.965 9.875 -8.629 1.00 0.00 C ATOM 0 H THR A 105 -7.472 9.200 -10.403 1.00 0.00 H new ATOM 0 HA THR A 105 -8.829 8.363 -7.855 1.00 0.00 H new ATOM 0 HB THR A 105 -9.666 9.964 -10.341 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.255 11.791 -8.960 1.00 0.00 H new ATOM 0 HG21 THR A 105 -11.464 10.815 -8.866 1.00 0.00 H new ATOM 0 HG22 THR A 105 -11.550 9.044 -9.024 1.00 0.00 H new ATOM 0 HG23 THR A 105 -10.875 9.774 -7.547 1.00 0.00 H new ATOM 1451 N PHE A 106 -9.769 6.292 -8.823 1.00 0.00 N ATOM 1452 CA PHE A 106 -10.489 5.109 -9.375 1.00 0.00 C ATOM 1453 C PHE A 106 -11.801 4.884 -8.618 1.00 0.00 C ATOM 1454 O PHE A 106 -11.959 5.308 -7.491 1.00 0.00 O ATOM 1455 CB PHE A 106 -9.538 3.932 -9.155 1.00 0.00 C ATOM 1456 CG PHE A 106 -9.480 3.604 -7.683 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -10.388 2.692 -7.132 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -8.518 4.213 -6.868 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -10.335 2.389 -5.766 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -8.465 3.910 -5.502 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.374 2.998 -4.951 1.00 0.00 C ATOM 0 H PHE A 106 -9.423 6.184 -7.870 1.00 0.00 H new ATOM 0 HA PHE A 106 -10.748 5.237 -10.426 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.879 3.064 -9.719 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.543 4.180 -9.523 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -11.130 2.222 -7.761 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.817 4.916 -7.293 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -11.036 1.685 -5.341 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -7.723 4.380 -4.873 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.333 2.765 -3.897 1.00 0.00 H new ATOM 1471 N THR A 107 -12.741 4.217 -9.229 1.00 0.00 N ATOM 1472 CA THR A 107 -14.040 3.961 -8.543 1.00 0.00 C ATOM 1473 C THR A 107 -13.972 2.643 -7.767 1.00 0.00 C ATOM 1474 O THR A 107 -14.279 1.589 -8.287 1.00 0.00 O ATOM 1475 CB THR A 107 -15.073 3.871 -9.668 1.00 0.00 C ATOM 1476 OG1 THR A 107 -15.232 5.150 -10.266 1.00 0.00 O ATOM 1477 CG2 THR A 107 -16.412 3.402 -9.098 1.00 0.00 C ATOM 0 H THR A 107 -12.666 3.838 -10.173 1.00 0.00 H new ATOM 0 HA THR A 107 -14.291 4.741 -7.825 1.00 0.00 H new ATOM 0 HB THR A 107 -14.732 3.158 -10.419 1.00 0.00 H new ATOM 0 HG1 THR A 107 -15.892 5.094 -10.988 1.00 0.00 H new ATOM 0 HG21 THR A 107 -17.147 3.338 -9.901 1.00 0.00 H new ATOM 0 HG22 THR A 107 -16.289 2.421 -8.640 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.756 4.112 -8.346 1.00 0.00 H new ATOM 1485 N ALA A 108 -13.568 2.694 -6.528 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.476 1.444 -5.720 1.00 0.00 C ATOM 1487 C ALA A 108 -14.738 0.598 -5.903 1.00 0.00 C ATOM 1488 O ALA A 108 -15.787 0.908 -5.376 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.355 1.919 -4.272 1.00 0.00 C ATOM 0 H ALA A 108 -13.297 3.547 -6.039 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.633 0.821 -6.019 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.282 1.056 -3.611 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.462 2.535 -4.164 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.234 2.506 -4.007 1.00 0.00 H new ATOM 1495 N SER A 109 -14.644 -0.471 -6.647 1.00 0.00 N ATOM 1496 CA SER A 109 -15.838 -1.337 -6.862 1.00 0.00 C ATOM 1497 C SER A 109 -15.884 -2.447 -5.808 1.00 0.00 C ATOM 1498 O SER A 109 -16.010 -3.613 -6.126 1.00 0.00 O ATOM 1499 CB SER A 109 -15.650 -1.931 -8.258 1.00 0.00 C ATOM 1500 OG SER A 109 -14.439 -2.675 -8.291 1.00 0.00 O ATOM 0 H SER A 109 -13.792 -0.782 -7.115 1.00 0.00 H new ATOM 0 HA SER A 109 -16.772 -0.781 -6.778 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.493 -2.575 -8.509 1.00 0.00 H new ATOM 0 HB3 SER A 109 -15.623 -1.136 -9.004 1.00 0.00 H new ATOM 0 HG SER A 109 -14.315 -3.059 -9.184 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.780 -2.094 -4.556 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.817 -3.129 -3.483 1.00 0.00 C ATOM 1508 C ALA A 110 -16.188 -2.489 -2.142 1.00 0.00 C ATOM 1509 O ALA A 110 -16.821 -1.454 -2.092 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.399 -3.698 -3.432 1.00 0.00 C ATOM 0 H ALA A 110 -15.671 -1.134 -4.229 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.559 -3.902 -3.681 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.344 -4.469 -2.664 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -14.146 -4.131 -4.400 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.695 -2.900 -3.196 1.00 0.00 H new ATOM 1516 N THR A 111 -15.799 -3.098 -1.056 1.00 0.00 N ATOM 1517 CA THR A 111 -16.129 -2.524 0.280 1.00 0.00 C ATOM 1518 C THR A 111 -14.986 -2.785 1.265 1.00 0.00 C ATOM 1519 O THR A 111 -14.713 -3.911 1.631 1.00 0.00 O ATOM 1520 CB THR A 111 -17.397 -3.256 0.722 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.349 -3.231 -0.333 1.00 0.00 O ATOM 1522 CG2 THR A 111 -17.982 -2.568 1.956 1.00 0.00 C ATOM 0 H THR A 111 -15.267 -3.968 -1.035 1.00 0.00 H new ATOM 0 HA THR A 111 -16.274 -1.444 0.242 1.00 0.00 H new ATOM 0 HB THR A 111 -17.153 -4.290 0.967 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.162 -3.701 -0.052 1.00 0.00 H new ATOM 0 HG21 THR A 111 -18.886 -3.091 2.270 1.00 0.00 H new ATOM 0 HG22 THR A 111 -17.251 -2.589 2.765 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.227 -1.534 1.714 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.319 -1.751 1.699 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.195 -1.937 2.662 1.00 0.00 C ATOM 1532 C TYR A 112 -13.575 -1.366 4.031 1.00 0.00 C ATOM 1533 O TYR A 112 -13.277 -0.228 4.333 1.00 0.00 O ATOM 1534 CB TYR A 112 -12.022 -1.153 2.066 1.00 0.00 C ATOM 1535 CG TYR A 112 -11.653 -1.714 0.708 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.120 -2.974 0.308 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -10.839 -0.967 -0.153 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -11.776 -3.481 -0.952 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.494 -1.475 -1.410 1.00 0.00 C ATOM 1540 CZ TYR A 112 -10.962 -2.731 -1.810 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.628 -3.225 -3.054 1.00 0.00 O ATOM 0 H TYR A 112 -14.503 -0.785 1.429 1.00 0.00 H new ATOM 0 HA TYR A 112 -12.949 -2.989 2.809 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -12.289 -0.100 1.972 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -11.163 -1.206 2.735 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -12.745 -3.554 0.971 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.477 0.003 0.154 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.139 -4.450 -1.262 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.866 -0.897 -2.072 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.197 -3.995 -3.264 1.00 0.00 H new ATOM 1551 N PRO A 113 -14.224 -2.182 4.816 1.00 0.00 N ATOM 1552 CA PRO A 113 -14.653 -1.754 6.170 1.00 0.00 C ATOM 1553 C PRO A 113 -13.444 -1.653 7.104 1.00 0.00 C ATOM 1554 O PRO A 113 -12.548 -2.474 7.067 1.00 0.00 O ATOM 1555 CB PRO A 113 -15.596 -2.869 6.615 1.00 0.00 C ATOM 1556 CG PRO A 113 -15.176 -4.068 5.826 1.00 0.00 C ATOM 1557 CD PRO A 113 -14.616 -3.564 4.521 1.00 0.00 C ATOM 0 HA PRO A 113 -15.128 -0.773 6.182 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -15.513 -3.052 7.686 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -16.636 -2.610 6.416 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -14.427 -4.644 6.370 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -16.024 -4.731 5.651 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -13.764 -4.160 4.195 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.359 -3.607 3.724 1.00 0.00 H new ATOM 1565 N ALA A 114 -13.410 -0.652 7.941 1.00 0.00 N ATOM 1566 CA ALA A 114 -12.257 -0.500 8.874 1.00 0.00 C ATOM 1567 C ALA A 114 -12.487 -1.329 10.141 1.00 0.00 C ATOM 1568 O ALA A 114 -12.459 -0.818 11.242 1.00 0.00 O ATOM 1569 CB ALA A 114 -12.213 0.991 9.209 1.00 0.00 C ATOM 0 H ALA A 114 -14.130 0.066 8.019 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.322 -0.847 8.434 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -11.388 1.186 9.894 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -12.068 1.565 8.294 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -13.151 1.286 9.678 1.00 0.00 H new ATOM 1661 N GLU A 122 -12.002 -6.413 6.544 1.00 0.00 N ATOM 1662 CA GLU A 122 -11.650 -4.986 6.293 1.00 0.00 C ATOM 1663 C GLU A 122 -10.783 -4.869 5.036 1.00 0.00 C ATOM 1664 O GLU A 122 -10.032 -5.763 4.704 1.00 0.00 O ATOM 1665 CB GLU A 122 -10.863 -4.549 7.529 1.00 0.00 C ATOM 1666 CG GLU A 122 -9.479 -5.200 7.511 1.00 0.00 C ATOM 1667 CD GLU A 122 -9.621 -6.709 7.714 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -10.494 -7.106 8.470 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -8.856 -7.444 7.111 1.00 0.00 O ATOM 0 HA GLU A 122 -12.531 -4.365 6.130 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -10.765 -3.464 7.546 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -11.399 -4.835 8.434 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -8.982 -4.995 6.563 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -8.855 -4.774 8.297 1.00 0.00 H new ATOM 1676 N GLY A 123 -10.881 -3.772 4.335 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.061 -3.601 3.102 1.00 0.00 C ATOM 1678 C GLY A 123 -8.722 -2.960 3.464 1.00 0.00 C ATOM 1679 O GLY A 123 -8.618 -2.211 4.415 1.00 0.00 O ATOM 0 H GLY A 123 -11.493 -2.988 4.562 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.896 -4.567 2.625 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.592 -2.977 2.383 1.00 0.00 H new ATOM 1683 N GLN A 124 -7.694 -3.252 2.715 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.360 -2.662 3.022 1.00 0.00 C ATOM 1685 C GLN A 124 -5.539 -2.502 1.739 1.00 0.00 C ATOM 1686 O GLN A 124 -6.074 -2.453 0.648 1.00 0.00 O ATOM 1687 CB GLN A 124 -5.695 -3.672 3.957 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.388 -4.957 3.185 1.00 0.00 C ATOM 1689 CD GLN A 124 -3.874 -5.175 3.138 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -3.136 -4.556 3.877 1.00 0.00 O ATOM 1691 NE2 GLN A 124 -3.378 -6.037 2.293 1.00 0.00 N ATOM 0 H GLN A 124 -7.720 -3.872 1.906 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.439 -1.672 3.471 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -4.776 -3.253 4.367 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.351 -3.890 4.800 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -5.874 -5.807 3.665 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.788 -4.890 2.173 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.998 -6.557 1.672 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -2.370 -6.191 2.254 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.241 -2.431 1.867 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.374 -2.283 0.663 1.00 0.00 C ATOM 1702 C ILE A 125 -2.444 -3.492 0.558 1.00 0.00 C ATOM 1703 O ILE A 125 -1.957 -4.000 1.549 1.00 0.00 O ATOM 1704 CB ILE A 125 -2.571 -0.999 0.903 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.426 0.210 0.517 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.294 -1.013 0.052 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -2.819 1.479 1.117 1.00 0.00 C ATOM 0 H ILE A 125 -3.743 -2.469 2.756 1.00 0.00 H new ATOM 0 HA ILE A 125 -3.944 -2.229 -0.264 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.297 -0.937 1.956 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.480 0.298 -0.568 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.446 0.077 0.877 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -0.729 -0.098 0.228 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -0.684 -1.874 0.325 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.560 -1.077 -1.003 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.429 2.339 0.841 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.788 1.389 2.203 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.807 1.614 0.735 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.205 -3.965 -0.632 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.320 -5.150 -0.789 1.00 0.00 C ATOM 1721 C ALA A 126 -0.073 -4.802 -1.605 1.00 0.00 C ATOM 1722 O ALA A 126 -0.155 -4.368 -2.737 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.171 -6.181 -1.530 1.00 0.00 C ATOM 0 H ALA A 126 -2.583 -3.584 -1.499 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.965 -5.519 0.173 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.589 -7.089 -1.686 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.056 -6.415 -0.939 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.476 -5.775 -2.495 1.00 0.00 H new ATOM 1729 N PHE A 127 1.081 -5.019 -1.039 1.00 0.00 N ATOM 1730 CA PHE A 127 2.350 -4.739 -1.768 1.00 0.00 C ATOM 1731 C PHE A 127 3.119 -6.055 -1.900 1.00 0.00 C ATOM 1732 O PHE A 127 3.717 -6.534 -0.959 1.00 0.00 O ATOM 1733 CB PHE A 127 3.115 -3.737 -0.894 1.00 0.00 C ATOM 1734 CG PHE A 127 2.756 -2.324 -1.302 1.00 0.00 C ATOM 1735 CD1 PHE A 127 1.414 -1.933 -1.388 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.770 -1.406 -1.609 1.00 0.00 C ATOM 1737 CE1 PHE A 127 1.086 -0.630 -1.782 1.00 0.00 C ATOM 1738 CE2 PHE A 127 3.441 -0.102 -1.999 1.00 0.00 C ATOM 1739 CZ PHE A 127 2.099 0.285 -2.087 1.00 0.00 C ATOM 0 H PHE A 127 1.201 -5.382 -0.093 1.00 0.00 H new ATOM 0 HA PHE A 127 2.196 -4.333 -2.768 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.871 -3.895 0.156 1.00 0.00 H new ATOM 0 HB3 PHE A 127 4.189 -3.894 -0.999 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.631 -2.638 -1.150 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.806 -1.705 -1.545 1.00 0.00 H new ATOM 0 HE1 PHE A 127 0.050 -0.331 -1.850 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.223 0.605 -2.232 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.846 1.290 -2.390 1.00 0.00 H new ATOM 1749 N GLN A 128 3.070 -6.668 -3.049 1.00 0.00 N ATOM 1750 CA GLN A 128 3.758 -7.978 -3.219 1.00 0.00 C ATOM 1751 C GLN A 128 5.209 -7.811 -3.674 1.00 0.00 C ATOM 1752 O GLN A 128 5.515 -7.889 -4.845 1.00 0.00 O ATOM 1753 CB GLN A 128 2.947 -8.707 -4.290 1.00 0.00 C ATOM 1754 CG GLN A 128 1.841 -9.528 -3.624 1.00 0.00 C ATOM 1755 CD GLN A 128 0.475 -8.992 -4.056 1.00 0.00 C ATOM 1756 OE1 GLN A 128 0.235 -8.781 -5.228 1.00 0.00 O ATOM 1757 NE2 GLN A 128 -0.437 -8.761 -3.151 1.00 0.00 N ATOM 0 H GLN A 128 2.585 -6.320 -3.876 1.00 0.00 H new ATOM 0 HA GLN A 128 3.805 -8.524 -2.277 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.512 -7.988 -4.984 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.598 -9.359 -4.873 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.936 -10.578 -3.902 1.00 0.00 H new ATOM 0 HG3 GLN A 128 1.938 -9.475 -2.540 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -0.235 -8.938 -2.167 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -1.351 -8.403 -3.428 1.00 0.00 H new ATOM 1766 N LEU A 129 6.109 -7.617 -2.749 1.00 0.00 N ATOM 1767 CA LEU A 129 7.551 -7.490 -3.126 1.00 0.00 C ATOM 1768 C LEU A 129 8.214 -8.871 -3.027 1.00 0.00 C ATOM 1769 O LEU A 129 9.259 -9.031 -2.425 1.00 0.00 O ATOM 1770 CB LEU A 129 8.199 -6.531 -2.113 1.00 0.00 C ATOM 1771 CG LEU A 129 7.180 -5.521 -1.582 1.00 0.00 C ATOM 1772 CD1 LEU A 129 7.911 -4.465 -0.749 1.00 0.00 C ATOM 1773 CD2 LEU A 129 6.470 -4.845 -2.757 1.00 0.00 C ATOM 0 H LEU A 129 5.912 -7.541 -1.751 1.00 0.00 H new ATOM 0 HA LEU A 129 7.666 -7.114 -4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.617 -7.101 -1.283 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.027 -6.003 -2.586 1.00 0.00 H new ATOM 0 HG LEU A 129 6.443 -6.032 -0.963 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.191 -3.741 -0.367 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.419 -4.948 0.086 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.644 -3.953 -1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 129 5.744 -4.126 -2.378 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.203 -4.329 -3.377 1.00 0.00 H new ATOM 0 HD23 LEU A 129 5.956 -5.599 -3.354 1.00 0.00 H new ATOM 1785 N GLY A 130 7.602 -9.877 -3.590 1.00 0.00 N ATOM 1786 CA GLY A 130 8.190 -11.247 -3.505 1.00 0.00 C ATOM 1787 C GLY A 130 8.749 -11.683 -4.863 1.00 0.00 C ATOM 1788 O GLY A 130 8.123 -11.514 -5.890 1.00 0.00 O ATOM 0 H GLY A 130 6.723 -9.812 -4.104 1.00 0.00 H new ATOM 0 HA2 GLY A 130 8.984 -11.261 -2.758 1.00 0.00 H new ATOM 0 HA3 GLY A 130 7.429 -11.955 -3.175 1.00 0.00 H new ATOM 1792 N GLY A 131 9.925 -12.257 -4.860 1.00 0.00 N ATOM 1793 CA GLY A 131 10.550 -12.730 -6.129 1.00 0.00 C ATOM 1794 C GLY A 131 10.278 -11.728 -7.257 1.00 0.00 C ATOM 1795 O GLY A 131 9.755 -12.079 -8.295 1.00 0.00 O ATOM 0 H GLY A 131 10.484 -12.419 -4.022 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.624 -12.851 -5.991 1.00 0.00 H new ATOM 0 HA3 GLY A 131 10.151 -13.708 -6.397 1.00 0.00 H new ATOM 1799 N PHE A 132 10.631 -10.484 -7.066 1.00 0.00 N ATOM 1800 CA PHE A 132 10.392 -9.470 -8.136 1.00 0.00 C ATOM 1801 C PHE A 132 11.716 -8.866 -8.616 1.00 0.00 C ATOM 1802 O PHE A 132 12.046 -8.932 -9.783 1.00 0.00 O ATOM 1803 CB PHE A 132 9.507 -8.401 -7.492 1.00 0.00 C ATOM 1804 CG PHE A 132 8.056 -8.752 -7.724 1.00 0.00 C ATOM 1805 CD1 PHE A 132 7.540 -8.757 -9.026 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.228 -9.075 -6.643 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.197 -9.084 -9.247 1.00 0.00 C ATOM 1808 CE2 PHE A 132 5.885 -9.403 -6.864 1.00 0.00 C ATOM 1809 CZ PHE A 132 5.369 -9.407 -8.166 1.00 0.00 C ATOM 0 H PHE A 132 11.073 -10.127 -6.219 1.00 0.00 H new ATOM 0 HA PHE A 132 9.918 -9.910 -9.013 1.00 0.00 H new ATOM 0 HB2 PHE A 132 9.712 -8.338 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 132 9.730 -7.423 -7.918 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.179 -8.508 -9.860 1.00 0.00 H new ATOM 0 HD2 PHE A 132 7.625 -9.071 -5.639 1.00 0.00 H new ATOM 0 HE1 PHE A 132 5.800 -9.087 -10.251 1.00 0.00 H new ATOM 0 HE2 PHE A 132 5.246 -9.653 -6.030 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.333 -9.659 -8.336 1.00 0.00 H new ATOM 1819 N SER A 133 12.479 -8.276 -7.735 1.00 0.00 N ATOM 1820 CA SER A 133 13.775 -7.675 -8.169 1.00 0.00 C ATOM 1821 C SER A 133 14.895 -8.717 -8.094 1.00 0.00 C ATOM 1822 O SER A 133 14.674 -9.855 -7.732 1.00 0.00 O ATOM 1823 CB SER A 133 14.038 -6.537 -7.185 1.00 0.00 C ATOM 1824 OG SER A 133 15.440 -6.365 -7.031 1.00 0.00 O ATOM 0 H SER A 133 12.264 -8.184 -6.742 1.00 0.00 H new ATOM 0 HA SER A 133 13.738 -7.321 -9.199 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.584 -5.615 -7.548 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.579 -6.760 -6.222 1.00 0.00 H new ATOM 0 HG SER A 133 15.673 -6.413 -6.080 1.00 0.00 H new ATOM 1830 N ALA A 134 16.096 -8.337 -8.439 1.00 0.00 N ATOM 1831 CA ALA A 134 17.228 -9.307 -8.392 1.00 0.00 C ATOM 1832 C ALA A 134 18.061 -9.088 -7.127 1.00 0.00 C ATOM 1833 O ALA A 134 17.997 -9.858 -6.189 1.00 0.00 O ATOM 1834 CB ALA A 134 18.059 -9.007 -9.640 1.00 0.00 C ATOM 0 H ALA A 134 16.342 -7.398 -8.751 1.00 0.00 H new ATOM 0 HA ALA A 134 16.884 -10.341 -8.370 1.00 0.00 H new ATOM 0 HB1 ALA A 134 18.914 -9.682 -9.678 1.00 0.00 H new ATOM 0 HB2 ALA A 134 17.445 -9.149 -10.529 1.00 0.00 H new ATOM 0 HB3 ALA A 134 18.411 -7.976 -9.603 1.00 0.00 H new ATOM 1840 N ASP A 135 18.842 -8.043 -7.092 1.00 0.00 N ATOM 1841 CA ASP A 135 19.676 -7.777 -5.885 1.00 0.00 C ATOM 1842 C ASP A 135 18.793 -7.292 -4.733 1.00 0.00 C ATOM 1843 O ASP A 135 17.610 -7.074 -4.896 1.00 0.00 O ATOM 1844 CB ASP A 135 20.654 -6.682 -6.311 1.00 0.00 C ATOM 1845 CG ASP A 135 21.759 -7.292 -7.176 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.372 -8.248 -6.731 1.00 0.00 O ATOM 1847 OD2 ASP A 135 21.973 -6.794 -8.268 1.00 0.00 O ATOM 0 H ASP A 135 18.939 -7.363 -7.846 1.00 0.00 H new ATOM 0 HA ASP A 135 20.194 -8.670 -5.535 1.00 0.00 H new ATOM 0 HB2 ASP A 135 20.128 -5.907 -6.868 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.087 -6.205 -5.432 1.00 0.00 H new ATOM 1852 N ALA A 136 19.359 -7.122 -3.570 1.00 0.00 N ATOM 1853 CA ALA A 136 18.548 -6.654 -2.410 1.00 0.00 C ATOM 1854 C ALA A 136 18.146 -5.191 -2.600 1.00 0.00 C ATOM 1855 O ALA A 136 18.974 -4.337 -2.845 1.00 0.00 O ATOM 1856 CB ALA A 136 19.468 -6.804 -1.198 1.00 0.00 C ATOM 0 H ALA A 136 20.346 -7.286 -3.373 1.00 0.00 H new ATOM 0 HA ALA A 136 17.626 -7.223 -2.295 1.00 0.00 H new ATOM 0 HB1 ALA A 136 18.943 -6.479 -0.300 1.00 0.00 H new ATOM 0 HB2 ALA A 136 19.760 -7.849 -1.090 1.00 0.00 H new ATOM 0 HB3 ALA A 136 20.359 -6.192 -1.339 1.00 0.00 H new ATOM 1862 N TRP A 137 16.881 -4.893 -2.478 1.00 0.00 N ATOM 1863 CA TRP A 137 16.437 -3.482 -2.642 1.00 0.00 C ATOM 1864 C TRP A 137 15.510 -3.088 -1.500 1.00 0.00 C ATOM 1865 O TRP A 137 15.506 -3.707 -0.454 1.00 0.00 O ATOM 1866 CB TRP A 137 15.738 -3.418 -4.004 1.00 0.00 C ATOM 1867 CG TRP A 137 14.385 -4.064 -3.964 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.210 -3.394 -4.019 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.040 -5.482 -3.895 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.171 -4.308 -3.990 1.00 0.00 N ATOM 1871 CE2 TRP A 137 12.629 -5.602 -3.911 1.00 0.00 C ATOM 1872 CE3 TRP A 137 14.800 -6.662 -3.819 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 11.995 -6.842 -3.857 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.161 -7.914 -3.761 1.00 0.00 C ATOM 1875 CH2 TRP A 137 12.764 -8.003 -3.780 1.00 0.00 C ATOM 0 H TRP A 137 16.140 -5.563 -2.273 1.00 0.00 H new ATOM 0 HA TRP A 137 17.269 -2.779 -2.611 1.00 0.00 H new ATOM 0 HB2 TRP A 137 15.635 -2.377 -4.312 1.00 0.00 H new ATOM 0 HB3 TRP A 137 16.356 -3.913 -4.754 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.101 -2.321 -4.076 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.184 -4.052 -4.023 1.00 0.00 H new ATOM 0 HE3 TRP A 137 15.879 -6.607 -3.805 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 10.917 -6.903 -3.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.754 -8.815 -3.701 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.283 -8.969 -3.735 1.00 0.00 H new ATOM 1886 N THR A 138 14.758 -2.042 -1.664 1.00 0.00 N ATOM 1887 CA THR A 138 13.880 -1.602 -0.552 1.00 0.00 C ATOM 1888 C THR A 138 12.754 -0.701 -1.078 1.00 0.00 C ATOM 1889 O THR A 138 12.798 -0.215 -2.190 1.00 0.00 O ATOM 1890 CB THR A 138 14.851 -0.838 0.363 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.191 -1.661 1.467 1.00 0.00 O ATOM 1892 CG2 THR A 138 14.226 0.465 0.877 1.00 0.00 C ATOM 0 H THR A 138 14.713 -1.477 -2.512 1.00 0.00 H new ATOM 0 HA THR A 138 13.372 -2.418 -0.037 1.00 0.00 H new ATOM 0 HB THR A 138 15.740 -0.585 -0.214 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.579 -1.480 2.211 1.00 0.00 H new ATOM 0 HG21 THR A 138 14.938 0.981 1.521 1.00 0.00 H new ATOM 0 HG22 THR A 138 13.971 1.105 0.032 1.00 0.00 H new ATOM 0 HG23 THR A 138 13.324 0.237 1.444 1.00 0.00 H new ATOM 1900 N LEU A 139 11.756 -0.467 -0.272 1.00 0.00 N ATOM 1901 CA LEU A 139 10.632 0.413 -0.701 1.00 0.00 C ATOM 1902 C LEU A 139 10.467 1.549 0.308 1.00 0.00 C ATOM 1903 O LEU A 139 10.364 1.323 1.496 1.00 0.00 O ATOM 1904 CB LEU A 139 9.394 -0.482 -0.709 1.00 0.00 C ATOM 1905 CG LEU A 139 9.228 -1.112 -2.092 1.00 0.00 C ATOM 1906 CD1 LEU A 139 9.968 -2.450 -2.139 1.00 0.00 C ATOM 1907 CD2 LEU A 139 7.741 -1.337 -2.371 1.00 0.00 C ATOM 0 H LEU A 139 11.670 -0.849 0.670 1.00 0.00 H new ATOM 0 HA LEU A 139 10.802 0.862 -1.679 1.00 0.00 H new ATOM 0 HB2 LEU A 139 9.490 -1.261 0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 139 8.509 0.101 -0.455 1.00 0.00 H new ATOM 0 HG LEU A 139 9.643 -0.446 -2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 139 9.848 -2.897 -3.126 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.027 -2.287 -1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 139 9.556 -3.120 -1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 139 7.620 -1.786 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.326 -2.003 -1.615 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.216 -0.382 -2.340 1.00 0.00 H new ATOM 1919 N CYS A 140 10.452 2.769 -0.148 1.00 0.00 N ATOM 1920 CA CYS A 140 10.307 3.906 0.803 1.00 0.00 C ATOM 1921 C CYS A 140 9.129 4.798 0.411 1.00 0.00 C ATOM 1922 O CYS A 140 9.257 5.687 -0.407 1.00 0.00 O ATOM 1923 CB CYS A 140 11.621 4.680 0.695 1.00 0.00 C ATOM 1924 SG CYS A 140 12.922 3.787 1.580 1.00 0.00 S ATOM 0 H CYS A 140 10.533 3.028 -1.131 1.00 0.00 H new ATOM 0 HA CYS A 140 10.111 3.563 1.819 1.00 0.00 H new ATOM 0 HB2 CYS A 140 11.898 4.803 -0.352 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.502 5.679 1.113 1.00 0.00 H new ATOM 1929 N LEU A 141 7.985 4.582 1.002 1.00 0.00 N ATOM 1930 CA LEU A 141 6.811 5.436 0.673 1.00 0.00 C ATOM 1931 C LEU A 141 6.787 6.643 1.613 1.00 0.00 C ATOM 1932 O LEU A 141 7.664 6.812 2.435 1.00 0.00 O ATOM 1933 CB LEU A 141 5.581 4.552 0.893 1.00 0.00 C ATOM 1934 CG LEU A 141 5.749 3.237 0.128 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.562 2.066 1.089 1.00 0.00 C ATOM 1936 CD2 LEU A 141 4.701 3.147 -0.986 1.00 0.00 C ATOM 0 H LEU A 141 7.814 3.854 1.696 1.00 0.00 H new ATOM 0 HA LEU A 141 6.843 5.814 -0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.451 4.351 1.956 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.684 5.069 0.554 1.00 0.00 H new ATOM 0 HG LEU A 141 6.746 3.201 -0.310 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.681 1.128 0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.307 2.124 1.882 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.564 2.109 1.525 1.00 0.00 H new ATOM 0 HD21 LEU A 141 4.825 2.209 -1.527 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.703 3.185 -0.550 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.829 3.983 -1.674 1.00 0.00 H new ATOM 1948 N ASP A 142 5.796 7.481 1.500 1.00 0.00 N ATOM 1949 CA ASP A 142 5.723 8.679 2.393 1.00 0.00 C ATOM 1950 C ASP A 142 4.636 9.638 1.904 1.00 0.00 C ATOM 1951 O ASP A 142 4.851 10.826 1.781 1.00 0.00 O ATOM 1952 CB ASP A 142 7.099 9.348 2.299 1.00 0.00 C ATOM 1953 CG ASP A 142 7.595 9.315 0.851 1.00 0.00 C ATOM 1954 OD1 ASP A 142 7.209 10.190 0.093 1.00 0.00 O ATOM 1955 OD2 ASP A 142 8.351 8.415 0.525 1.00 0.00 O ATOM 0 H ASP A 142 5.032 7.392 0.830 1.00 0.00 H new ATOM 0 HA ASP A 142 5.476 8.404 3.418 1.00 0.00 H new ATOM 0 HB2 ASP A 142 7.037 10.379 2.648 1.00 0.00 H new ATOM 0 HB3 ASP A 142 7.808 8.834 2.948 1.00 0.00 H new ATOM 1960 N ASP A 143 3.471 9.126 1.626 1.00 0.00 N ATOM 1961 CA ASP A 143 2.358 9.993 1.144 1.00 0.00 C ATOM 1962 C ASP A 143 1.145 9.122 0.830 1.00 0.00 C ATOM 1963 O ASP A 143 0.523 9.251 -0.205 1.00 0.00 O ATOM 1964 CB ASP A 143 2.887 10.658 -0.129 1.00 0.00 C ATOM 1965 CG ASP A 143 1.756 11.432 -0.809 1.00 0.00 C ATOM 1966 OD1 ASP A 143 0.977 12.049 -0.102 1.00 0.00 O ATOM 1967 OD2 ASP A 143 1.689 11.394 -2.027 1.00 0.00 O ATOM 0 H ASP A 143 3.239 8.136 1.712 1.00 0.00 H new ATOM 0 HA ASP A 143 2.051 10.734 1.882 1.00 0.00 H new ATOM 0 HB2 ASP A 143 3.708 11.332 0.115 1.00 0.00 H new ATOM 0 HB3 ASP A 143 3.285 9.904 -0.808 1.00 0.00 H new ATOM 1972 N VAL A 144 0.816 8.223 1.714 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.343 7.320 1.467 1.00 0.00 C ATOM 1974 C VAL A 144 -1.631 7.952 1.998 1.00 0.00 C ATOM 1975 O VAL A 144 -1.728 8.314 3.154 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.029 6.022 2.225 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -0.671 4.846 1.491 1.00 0.00 C ATOM 1978 CG2 VAL A 144 1.487 5.794 2.296 1.00 0.00 C ATOM 0 H VAL A 144 1.300 8.074 2.599 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.492 7.136 0.403 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.425 6.102 3.237 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.452 3.921 2.024 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.750 4.991 1.445 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.270 4.786 0.479 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.691 4.870 2.837 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.892 5.721 1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.957 6.629 2.815 1.00 0.00 H new ATOM 1988 N ALA A 145 -2.621 8.087 1.158 1.00 0.00 N ATOM 1989 CA ALA A 145 -3.906 8.696 1.605 1.00 0.00 C ATOM 1990 C ALA A 145 -5.041 8.276 0.667 1.00 0.00 C ATOM 1991 O ALA A 145 -4.824 7.988 -0.494 1.00 0.00 O ATOM 1992 CB ALA A 145 -3.675 10.206 1.526 1.00 0.00 C ATOM 0 H ALA A 145 -2.595 7.801 0.179 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.189 8.379 2.609 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -4.578 10.729 1.840 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.849 10.482 2.181 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -3.433 10.484 0.500 1.00 0.00 H new ATOM 1998 N LEU A 146 -6.248 8.237 1.160 1.00 0.00 N ATOM 1999 CA LEU A 146 -7.395 7.834 0.295 1.00 0.00 C ATOM 2000 C LEU A 146 -8.678 8.530 0.759 1.00 0.00 C ATOM 2001 O LEU A 146 -8.821 8.882 1.913 1.00 0.00 O ATOM 2002 CB LEU A 146 -7.512 6.319 0.473 1.00 0.00 C ATOM 2003 CG LEU A 146 -8.447 5.748 -0.593 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -7.868 6.022 -1.982 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -8.588 4.238 -0.391 1.00 0.00 C ATOM 0 H LEU A 146 -6.491 8.466 2.124 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.243 8.111 -0.748 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.528 5.856 0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.894 6.088 1.467 1.00 0.00 H new ATOM 0 HG LEU A 146 -9.425 6.221 -0.507 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.535 5.614 -2.741 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -7.766 7.097 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.889 5.550 -2.068 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -9.255 3.830 -1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.609 3.767 -0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.001 4.040 0.598 1.00 0.00 H new ATOM 2017 N ASP A 147 -9.612 8.731 -0.131 1.00 0.00 N ATOM 2018 CA ASP A 147 -10.884 9.404 0.262 1.00 0.00 C ATOM 2019 C ASP A 147 -11.851 9.447 -0.926 1.00 0.00 C ATOM 2020 O ASP A 147 -11.443 9.452 -2.071 1.00 0.00 O ATOM 2021 CB ASP A 147 -10.473 10.820 0.670 1.00 0.00 C ATOM 2022 CG ASP A 147 -11.657 11.524 1.336 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -12.102 11.046 2.366 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -12.098 12.529 0.804 1.00 0.00 O ATOM 0 H ASP A 147 -9.550 8.459 -1.112 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.396 8.879 1.068 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -9.627 10.781 1.356 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -10.148 11.382 -0.205 1.00 0.00 H new ATOM 2029 N SER A 148 -13.129 9.477 -0.662 1.00 0.00 N ATOM 2030 CA SER A 148 -14.122 9.520 -1.775 1.00 0.00 C ATOM 2031 C SER A 148 -14.467 10.971 -2.120 1.00 0.00 C ATOM 2032 O SER A 148 -14.769 11.770 -1.256 1.00 0.00 O ATOM 2033 CB SER A 148 -15.351 8.791 -1.236 1.00 0.00 C ATOM 2034 OG SER A 148 -15.965 9.585 -0.230 1.00 0.00 O ATOM 0 H SER A 148 -13.529 9.474 0.276 1.00 0.00 H new ATOM 0 HA SER A 148 -13.741 9.059 -2.686 1.00 0.00 H new ATOM 0 HB2 SER A 148 -16.057 8.598 -2.044 1.00 0.00 H new ATOM 0 HB3 SER A 148 -15.063 7.823 -0.826 1.00 0.00 H new ATOM 0 HG SER A 148 -15.556 10.476 -0.221 1.00 0.00 H new