USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 956 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 5 MET CE :methyl -117:sc= -1.55 (180deg=-6.08!) USER MOD Set 1.2: A 30 LYS NZ :NH3+ 149:sc= -0.0457 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= -0.0504 (180deg=-0.357) USER MOD Single : A 8 GLN : amide:sc= -0.0637 X(o=-0.064,f=-0.39) USER MOD Single : A 16 LYS NZ :NH3+ 139:sc= -0.743 (180deg=-3.83!) USER MOD Single : A 19 LYS NZ :NH3+ -177:sc= -2.04 (180deg=-2.18) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot -130:sc= -1.14 USER MOD Single : A 33 GLN : amide:sc= -0.0894 X(o=-0.089,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -158:sc= -2.08 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.0141 X(o=-0.014,f=0) USER MOD Single : A 59 SER OG : rot 25:sc= 0.401 USER MOD Single : A 63 MET CE :methyl 156:sc= -1.87 (180deg=-4.49!) USER MOD Single : A 66 LYS NZ :NH3+ 162:sc=0.000651 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -2.65! K(o=-2.6!,f=-0.37) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0769 USER MOD Single : A 84 GLN : amide:sc= -0.72 X(o=-0.72,f=-0.71) USER MOD Single : A 86 TYR OH : rot -15:sc= -2.11! USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -145:sc= -0.0209 (180deg=-0.196) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.439 2.456 10.312 1.00 0.00 N ATOM 2 CA MET A 1 -16.037 2.177 10.575 1.00 0.00 C ATOM 3 C MET A 1 -15.469 1.206 9.539 1.00 0.00 C ATOM 4 O MET A 1 -14.523 0.473 9.823 1.00 0.00 O ATOM 5 CB MET A 1 -15.889 1.577 11.974 1.00 0.00 C ATOM 6 CG MET A 1 -14.725 2.223 12.727 1.00 0.00 C ATOM 7 SD MET A 1 -15.079 3.944 13.039 1.00 0.00 S ATOM 8 CE MET A 1 -15.850 3.816 14.644 1.00 0.00 C ATOM 0 H1 MET A 1 -17.871 2.886 11.155 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.518 3.113 9.509 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.932 1.570 10.083 1.00 0.00 H new ATOM 0 HA MET A 1 -15.481 3.112 10.512 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.813 1.719 12.534 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.725 0.502 11.897 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.557 1.701 13.669 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.809 2.132 12.144 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.136 4.809 14.991 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.738 3.187 14.572 1.00 0.00 H new ATOM 0 HE3 MET A 1 -15.148 3.373 15.351 1.00 0.00 H new ATOM 17 N GLU A 2 -16.070 1.231 8.358 1.00 0.00 N ATOM 18 CA GLU A 2 -15.635 0.361 7.278 1.00 0.00 C ATOM 19 C GLU A 2 -15.139 1.193 6.094 1.00 0.00 C ATOM 20 O GLU A 2 -15.499 2.361 5.957 1.00 0.00 O ATOM 21 CB GLU A 2 -16.758 -0.586 6.851 1.00 0.00 C ATOM 22 CG GLU A 2 -16.216 -1.990 6.575 1.00 0.00 C ATOM 23 CD GLU A 2 -17.341 -2.941 6.164 1.00 0.00 C ATOM 24 OE1 GLU A 2 -18.164 -2.517 5.324 1.00 0.00 O ATOM 25 OE2 GLU A 2 -17.353 -4.071 6.699 1.00 0.00 O ATOM 0 H GLU A 2 -16.854 1.840 8.125 1.00 0.00 H new ATOM 0 HA GLU A 2 -14.808 -0.250 7.640 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.516 -0.632 7.633 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.245 -0.198 5.956 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.466 -1.945 5.785 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -15.718 -2.373 7.466 1.00 0.00 H new ATOM 32 N TRP A 3 -14.320 0.558 5.268 1.00 0.00 N ATOM 33 CA TRP A 3 -13.772 1.225 4.099 1.00 0.00 C ATOM 34 C TRP A 3 -13.751 0.219 2.947 1.00 0.00 C ATOM 35 O TRP A 3 -13.434 -0.953 3.147 1.00 0.00 O ATOM 36 CB TRP A 3 -12.393 1.815 4.402 1.00 0.00 C ATOM 37 CG TRP A 3 -12.285 2.468 5.781 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.750 1.955 6.897 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.747 3.786 6.148 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.833 2.841 7.952 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.459 3.989 7.482 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.388 4.772 5.377 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.775 5.171 8.162 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.697 5.947 6.072 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.414 6.168 7.415 1.00 0.00 C ATOM 0 H TRP A 3 -14.023 -0.411 5.385 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.395 2.072 3.810 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.646 1.025 4.326 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -12.151 2.556 3.640 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.309 0.971 6.963 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.497 2.682 8.902 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.623 4.634 4.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.539 5.307 9.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.190 6.738 5.526 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.686 7.104 7.880 1.00 0.00 H new ATOM 56 N GLU A 4 -14.093 0.713 1.766 1.00 0.00 N ATOM 57 CA GLU A 4 -14.117 -0.129 0.581 1.00 0.00 C ATOM 58 C GLU A 4 -13.293 0.508 -0.539 1.00 0.00 C ATOM 59 O GLU A 4 -13.355 1.718 -0.750 1.00 0.00 O ATOM 60 CB GLU A 4 -15.554 -0.390 0.124 1.00 0.00 C ATOM 61 CG GLU A 4 -16.266 0.919 -0.222 1.00 0.00 C ATOM 62 CD GLU A 4 -17.181 1.364 0.921 1.00 0.00 C ATOM 63 OE1 GLU A 4 -17.950 0.502 1.400 1.00 0.00 O ATOM 64 OE2 GLU A 4 -17.092 2.555 1.290 1.00 0.00 O ATOM 0 H GLU A 4 -14.356 1.685 1.604 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.670 -1.091 0.833 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.549 -1.046 -0.746 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.101 -0.909 0.911 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.529 1.695 -0.426 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.852 0.789 -1.132 1.00 0.00 H new ATOM 71 N MET A 5 -12.539 -0.336 -1.229 1.00 0.00 N ATOM 72 CA MET A 5 -11.704 0.129 -2.323 1.00 0.00 C ATOM 73 C MET A 5 -11.530 -0.961 -3.382 1.00 0.00 C ATOM 74 O MET A 5 -10.886 -1.979 -3.131 1.00 0.00 O ATOM 75 CB MET A 5 -10.332 0.537 -1.780 1.00 0.00 C ATOM 76 CG MET A 5 -10.475 1.442 -0.554 1.00 0.00 C ATOM 77 SD MET A 5 -8.904 2.194 -0.165 1.00 0.00 S ATOM 78 CE MET A 5 -9.161 2.575 1.560 1.00 0.00 C ATOM 0 H MET A 5 -12.489 -1.339 -1.051 1.00 0.00 H new ATOM 0 HA MET A 5 -12.191 0.986 -2.788 1.00 0.00 H new ATOM 0 HB2 MET A 5 -9.762 -0.354 -1.515 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.769 1.056 -2.556 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.220 2.214 -0.747 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.831 0.862 0.297 1.00 0.00 H new ATOM 0 HE1 MET A 5 -9.120 3.655 1.704 1.00 0.00 H new ATOM 0 HE2 MET A 5 -10.137 2.204 1.873 1.00 0.00 H new ATOM 0 HE3 MET A 5 -8.383 2.099 2.157 1.00 0.00 H new ATOM 88 N GLY A 6 -12.115 -0.711 -4.544 1.00 0.00 N ATOM 89 CA GLY A 6 -12.033 -1.659 -5.643 1.00 0.00 C ATOM 90 C GLY A 6 -10.690 -1.544 -6.366 1.00 0.00 C ATOM 91 O GLY A 6 -10.037 -0.503 -6.310 1.00 0.00 O ATOM 0 H GLY A 6 -12.648 0.134 -4.749 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.160 -2.673 -5.264 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.846 -1.477 -6.346 1.00 0.00 H new ATOM 95 N LEU A 7 -10.317 -2.629 -7.030 1.00 0.00 N ATOM 96 CA LEU A 7 -9.063 -2.663 -7.764 1.00 0.00 C ATOM 97 C LEU A 7 -9.010 -3.934 -8.614 1.00 0.00 C ATOM 98 O LEU A 7 -9.951 -4.726 -8.613 1.00 0.00 O ATOM 99 CB LEU A 7 -7.878 -2.513 -6.808 1.00 0.00 C ATOM 100 CG LEU A 7 -7.899 -3.410 -5.568 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.496 -3.556 -4.974 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.908 -2.899 -4.538 1.00 0.00 C ATOM 0 H LEU A 7 -10.861 -3.491 -7.075 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.999 -1.817 -8.449 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.962 -2.715 -7.362 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.830 -1.475 -6.480 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.226 -4.405 -5.871 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.538 -4.198 -4.094 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.831 -4.000 -5.715 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.118 -2.574 -4.689 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.903 -3.555 -3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.637 -1.888 -4.233 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.905 -2.890 -4.979 1.00 0.00 H new ATOM 114 N GLN A 8 -7.900 -4.089 -9.320 1.00 0.00 N ATOM 115 CA GLN A 8 -7.711 -5.250 -10.173 1.00 0.00 C ATOM 116 C GLN A 8 -7.444 -6.495 -9.324 1.00 0.00 C ATOM 117 O GLN A 8 -7.013 -6.387 -8.177 1.00 0.00 O ATOM 118 CB GLN A 8 -6.579 -5.016 -11.175 1.00 0.00 C ATOM 119 CG GLN A 8 -7.095 -5.096 -12.613 1.00 0.00 C ATOM 120 CD GLN A 8 -6.844 -6.483 -13.210 1.00 0.00 C ATOM 121 OE1 GLN A 8 -5.767 -7.047 -13.105 1.00 0.00 O ATOM 122 NE2 GLN A 8 -7.896 -6.999 -13.839 1.00 0.00 N ATOM 0 H GLN A 8 -7.122 -3.430 -9.319 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.627 -5.412 -10.741 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.130 -4.038 -11.000 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.796 -5.759 -11.024 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -8.162 -4.875 -12.633 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.602 -4.339 -13.223 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.768 -6.473 -13.890 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.831 -7.921 -14.271 1.00 0.00 H new ATOM 131 N GLU A 9 -7.710 -7.647 -9.921 1.00 0.00 N ATOM 132 CA GLU A 9 -7.503 -8.911 -9.234 1.00 0.00 C ATOM 133 C GLU A 9 -6.024 -9.091 -8.887 1.00 0.00 C ATOM 134 O GLU A 9 -5.691 -9.585 -7.811 1.00 0.00 O ATOM 135 CB GLU A 9 -8.016 -10.082 -10.075 1.00 0.00 C ATOM 136 CG GLU A 9 -8.158 -11.346 -9.225 1.00 0.00 C ATOM 137 CD GLU A 9 -7.278 -12.474 -9.767 1.00 0.00 C ATOM 138 OE1 GLU A 9 -6.041 -12.294 -9.736 1.00 0.00 O ATOM 139 OE2 GLU A 9 -7.862 -13.491 -10.201 1.00 0.00 O ATOM 0 H GLU A 9 -8.067 -7.732 -10.873 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.074 -8.896 -8.306 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.980 -9.824 -10.514 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.330 -10.270 -10.901 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.881 -11.128 -8.194 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.200 -11.666 -9.214 1.00 0.00 H new ATOM 146 N GLU A 10 -5.176 -8.680 -9.819 1.00 0.00 N ATOM 147 CA GLU A 10 -3.741 -8.789 -9.625 1.00 0.00 C ATOM 148 C GLU A 10 -3.312 -8.007 -8.382 1.00 0.00 C ATOM 149 O GLU A 10 -2.542 -8.508 -7.564 1.00 0.00 O ATOM 150 CB GLU A 10 -2.982 -8.310 -10.864 1.00 0.00 C ATOM 151 CG GLU A 10 -1.844 -9.270 -11.216 1.00 0.00 C ATOM 152 CD GLU A 10 -0.915 -8.658 -12.266 1.00 0.00 C ATOM 153 OE1 GLU A 10 -0.665 -7.438 -12.160 1.00 0.00 O ATOM 154 OE2 GLU A 10 -0.476 -9.424 -13.151 1.00 0.00 O ATOM 0 H GLU A 10 -5.456 -8.271 -10.710 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.494 -9.840 -9.472 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.669 -8.230 -11.707 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.579 -7.313 -10.685 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.275 -9.510 -10.318 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -2.257 -10.206 -11.592 1.00 0.00 H new ATOM 161 N PHE A 11 -3.828 -6.791 -8.280 1.00 0.00 N ATOM 162 CA PHE A 11 -3.508 -5.935 -7.151 1.00 0.00 C ATOM 163 C PHE A 11 -4.006 -6.547 -5.840 1.00 0.00 C ATOM 164 O PHE A 11 -3.424 -6.314 -4.781 1.00 0.00 O ATOM 165 CB PHE A 11 -4.225 -4.603 -7.382 1.00 0.00 C ATOM 166 CG PHE A 11 -3.284 -3.404 -7.513 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.533 -3.248 -8.636 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.198 -2.494 -6.505 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.659 -2.135 -8.757 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.324 -1.381 -6.626 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.573 -1.225 -7.749 1.00 0.00 C ATOM 0 H PHE A 11 -4.466 -6.378 -8.961 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.428 -5.808 -7.075 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.828 -4.679 -8.287 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.912 -4.424 -6.555 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.601 -3.970 -9.436 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.794 -2.618 -5.613 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.063 -2.011 -9.649 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -2.256 -0.659 -5.826 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.908 -0.379 -7.841 1.00 0.00 H new ATOM 181 N LEU A 12 -5.077 -7.318 -5.953 1.00 0.00 N ATOM 182 CA LEU A 12 -5.660 -7.965 -4.790 1.00 0.00 C ATOM 183 C LEU A 12 -4.689 -9.024 -4.261 1.00 0.00 C ATOM 184 O LEU A 12 -4.374 -9.043 -3.072 1.00 0.00 O ATOM 185 CB LEU A 12 -7.048 -8.516 -5.122 1.00 0.00 C ATOM 186 CG LEU A 12 -8.157 -7.476 -5.297 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.442 -8.127 -5.813 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.389 -6.698 -4.001 1.00 0.00 C ATOM 0 H LEU A 12 -5.557 -7.509 -6.833 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.813 -7.242 -3.989 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.976 -9.099 -6.040 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.343 -9.204 -4.330 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.835 -6.757 -6.050 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.214 -7.366 -5.929 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.249 -8.598 -6.777 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.779 -8.881 -5.102 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.182 -5.966 -4.153 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.680 -7.388 -3.209 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.471 -6.185 -3.716 1.00 0.00 H new ATOM 200 N GLU A 13 -4.242 -9.877 -5.170 1.00 0.00 N ATOM 201 CA GLU A 13 -3.314 -10.936 -4.811 1.00 0.00 C ATOM 202 C GLU A 13 -2.026 -10.340 -4.238 1.00 0.00 C ATOM 203 O GLU A 13 -1.393 -10.940 -3.370 1.00 0.00 O ATOM 204 CB GLU A 13 -3.015 -11.835 -6.012 1.00 0.00 C ATOM 205 CG GLU A 13 -2.577 -13.229 -5.558 1.00 0.00 C ATOM 206 CD GLU A 13 -3.788 -14.126 -5.294 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.591 -14.288 -6.238 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.884 -14.628 -4.153 1.00 0.00 O ATOM 0 H GLU A 13 -4.505 -9.857 -6.155 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.779 -11.555 -4.044 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.902 -11.915 -6.640 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.232 -11.385 -6.622 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.944 -13.682 -6.321 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.976 -13.148 -4.652 1.00 0.00 H new ATOM 215 N LEU A 14 -1.677 -9.168 -4.747 1.00 0.00 N ATOM 216 CA LEU A 14 -0.476 -8.485 -4.297 1.00 0.00 C ATOM 217 C LEU A 14 -0.594 -8.187 -2.801 1.00 0.00 C ATOM 218 O LEU A 14 0.347 -8.414 -2.042 1.00 0.00 O ATOM 219 CB LEU A 14 -0.213 -7.244 -5.152 1.00 0.00 C ATOM 220 CG LEU A 14 0.312 -7.503 -6.566 1.00 0.00 C ATOM 221 CD1 LEU A 14 1.053 -6.279 -7.108 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.180 -8.762 -6.606 1.00 0.00 C ATOM 0 H LEU A 14 -2.205 -8.674 -5.467 1.00 0.00 H new ATOM 0 HA LEU A 14 0.397 -9.124 -4.427 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.140 -6.676 -5.228 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.505 -6.612 -4.629 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.542 -7.679 -7.221 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.416 -6.489 -8.114 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.374 -5.427 -7.138 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.897 -6.048 -6.459 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.540 -8.923 -7.622 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.030 -8.639 -5.935 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.589 -9.622 -6.290 1.00 0.00 H new ATOM 234 N ILE A 15 -1.759 -7.681 -2.421 1.00 0.00 N ATOM 235 CA ILE A 15 -2.012 -7.350 -1.029 1.00 0.00 C ATOM 236 C ILE A 15 -1.786 -8.591 -0.164 1.00 0.00 C ATOM 237 O ILE A 15 -1.250 -8.494 0.939 1.00 0.00 O ATOM 238 CB ILE A 15 -3.404 -6.735 -0.870 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.325 -5.208 -0.804 1.00 0.00 C ATOM 240 CG2 ILE A 15 -4.129 -7.324 0.342 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.255 -4.602 -2.207 1.00 0.00 C ATOM 0 H ILE A 15 -2.537 -7.493 -3.053 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.311 -6.590 -0.685 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.992 -6.989 -1.752 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.196 -4.818 -0.278 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.447 -4.910 -0.231 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.116 -6.870 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.236 -8.401 0.214 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.553 -7.121 1.245 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.200 -3.516 -2.132 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.370 -4.976 -2.721 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.146 -4.882 -2.769 1.00 0.00 H new ATOM 253 N LYS A 16 -2.205 -9.729 -0.697 1.00 0.00 N ATOM 254 CA LYS A 16 -2.055 -10.988 0.013 1.00 0.00 C ATOM 255 C LYS A 16 -0.567 -11.269 0.235 1.00 0.00 C ATOM 256 O LYS A 16 -0.195 -11.934 1.201 1.00 0.00 O ATOM 257 CB LYS A 16 -2.788 -12.110 -0.725 1.00 0.00 C ATOM 258 CG LYS A 16 -3.686 -12.899 0.230 1.00 0.00 C ATOM 259 CD LYS A 16 -5.104 -12.324 0.249 1.00 0.00 C ATOM 260 CE LYS A 16 -6.045 -13.157 -0.624 1.00 0.00 C ATOM 261 NZ LYS A 16 -5.897 -14.597 -0.318 1.00 0.00 N ATOM 0 H LYS A 16 -2.648 -9.806 -1.612 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.520 -10.928 0.997 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.389 -11.688 -1.530 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.063 -12.781 -1.186 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.718 -13.945 -0.075 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.266 -12.873 1.235 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.477 -12.301 1.273 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.088 -11.294 -0.108 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.076 -12.847 -0.455 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.827 -12.979 -1.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.834 -15.047 -0.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.306 -15.048 -1.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.447 -14.710 0.613 1.00 0.00 H new ATOM 275 N LEU A 17 0.243 -10.748 -0.674 1.00 0.00 N ATOM 276 CA LEU A 17 1.682 -10.934 -0.589 1.00 0.00 C ATOM 277 C LEU A 17 2.279 -9.852 0.313 1.00 0.00 C ATOM 278 O LEU A 17 3.367 -10.027 0.861 1.00 0.00 O ATOM 279 CB LEU A 17 2.300 -10.977 -1.988 1.00 0.00 C ATOM 280 CG LEU A 17 2.169 -12.305 -2.738 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.672 -12.080 -4.167 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.484 -13.085 -2.705 1.00 0.00 C ATOM 0 H LEU A 17 -0.069 -10.197 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 17 1.915 -11.896 -0.132 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.840 -10.195 -2.591 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.359 -10.733 -1.904 1.00 0.00 H new ATOM 0 HG LEU A 17 1.421 -12.913 -2.229 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.588 -13.039 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.696 -11.596 -4.141 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.378 -11.445 -4.702 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.364 -14.024 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.270 -12.494 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.757 -13.294 -1.671 1.00 0.00 H new ATOM 294 N ARG A 18 1.541 -8.759 0.441 1.00 0.00 N ATOM 295 CA ARG A 18 1.985 -7.650 1.268 1.00 0.00 C ATOM 296 C ARG A 18 1.754 -7.965 2.747 1.00 0.00 C ATOM 297 O ARG A 18 2.041 -7.140 3.613 1.00 0.00 O ATOM 298 CB ARG A 18 1.241 -6.362 0.906 1.00 0.00 C ATOM 299 CG ARG A 18 1.825 -5.729 -0.359 1.00 0.00 C ATOM 300 CD ARG A 18 0.716 -5.343 -1.340 1.00 0.00 C ATOM 301 NE ARG A 18 1.247 -4.417 -2.365 1.00 0.00 N ATOM 302 CZ ARG A 18 1.458 -3.110 -2.159 1.00 0.00 C ATOM 303 NH1 ARG A 18 1.185 -2.567 -0.965 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.943 -2.346 -3.147 1.00 0.00 N ATOM 0 H ARG A 18 0.639 -8.618 -0.014 1.00 0.00 H new ATOM 0 HA ARG A 18 3.050 -7.506 1.086 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.184 -6.579 0.754 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.305 -5.656 1.734 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.405 -4.845 -0.093 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.511 -6.428 -0.837 1.00 0.00 H new ATOM 0 HD2 ARG A 18 0.315 -6.237 -1.818 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.107 -4.871 -0.804 1.00 0.00 H new ATOM 0 HE ARG A 18 1.466 -4.797 -3.286 1.00 0.00 H new ATOM 0 HH11 ARG A 18 0.816 -3.149 -0.212 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.346 -1.572 -0.808 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.152 -2.759 -4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 18 2.104 -1.351 -2.990 1.00 0.00 H new ATOM 318 N LYS A 19 1.239 -9.161 2.991 1.00 0.00 N ATOM 319 CA LYS A 19 0.967 -9.595 4.351 1.00 0.00 C ATOM 320 C LYS A 19 2.289 -9.892 5.061 1.00 0.00 C ATOM 321 O LYS A 19 2.318 -10.068 6.278 1.00 0.00 O ATOM 322 CB LYS A 19 -0.010 -10.773 4.351 1.00 0.00 C ATOM 323 CG LYS A 19 -0.435 -11.132 5.777 1.00 0.00 C ATOM 324 CD LYS A 19 0.210 -12.445 6.227 1.00 0.00 C ATOM 325 CE LYS A 19 -0.402 -13.637 5.490 1.00 0.00 C ATOM 326 NZ LYS A 19 -1.793 -13.867 5.940 1.00 0.00 N ATOM 0 H LYS A 19 1.003 -9.843 2.270 1.00 0.00 H new ATOM 0 HA LYS A 19 0.475 -8.802 4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.889 -10.521 3.758 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.456 -11.637 3.878 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -0.150 -10.330 6.458 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.520 -11.220 5.826 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.283 -12.410 6.041 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.077 -12.570 7.302 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.387 -13.454 4.416 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.197 -14.530 5.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.176 -14.710 5.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -1.805 -14.012 6.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.377 -13.040 5.700 1.00 0.00 H new ATOM 340 N LYS A 20 3.351 -9.939 4.270 1.00 0.00 N ATOM 341 CA LYS A 20 4.673 -10.212 4.808 1.00 0.00 C ATOM 342 C LYS A 20 5.641 -9.119 4.350 1.00 0.00 C ATOM 343 O LYS A 20 6.836 -9.184 4.634 1.00 0.00 O ATOM 344 CB LYS A 20 5.122 -11.626 4.434 1.00 0.00 C ATOM 345 CG LYS A 20 4.943 -12.587 5.611 1.00 0.00 C ATOM 346 CD LYS A 20 5.208 -14.032 5.185 1.00 0.00 C ATOM 347 CE LYS A 20 4.939 -15.002 6.337 1.00 0.00 C ATOM 348 NZ LYS A 20 6.040 -15.984 6.456 1.00 0.00 N ATOM 0 H LYS A 20 3.323 -9.793 3.261 1.00 0.00 H new ATOM 0 HA LYS A 20 4.654 -10.186 5.898 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.546 -11.980 3.580 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.168 -11.610 4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.623 -12.311 6.417 1.00 0.00 H new ATOM 0 HG3 LYS A 20 3.930 -12.500 6.005 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.574 -14.286 4.335 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.241 -14.133 4.853 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.836 -14.448 7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 20 3.996 -15.523 6.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.841 -16.635 7.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.120 -16.525 5.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.933 -15.484 6.638 1.00 0.00 H new ATOM 362 N LYS A 21 5.088 -8.139 3.650 1.00 0.00 N ATOM 363 CA LYS A 21 5.887 -7.033 3.150 1.00 0.00 C ATOM 364 C LYS A 21 5.413 -5.732 3.801 1.00 0.00 C ATOM 365 O LYS A 21 5.561 -5.548 5.008 1.00 0.00 O ATOM 366 CB LYS A 21 5.860 -7.001 1.621 1.00 0.00 C ATOM 367 CG LYS A 21 6.378 -8.317 1.036 1.00 0.00 C ATOM 368 CD LYS A 21 7.722 -8.701 1.656 1.00 0.00 C ATOM 369 CE LYS A 21 8.581 -9.485 0.661 1.00 0.00 C ATOM 370 NZ LYS A 21 9.710 -10.142 1.356 1.00 0.00 N ATOM 0 H LYS A 21 4.096 -8.088 3.417 1.00 0.00 H new ATOM 0 HA LYS A 21 6.934 -7.164 3.424 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.842 -6.821 1.275 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.470 -6.173 1.260 1.00 0.00 H new ATOM 0 HG2 LYS A 21 5.651 -9.110 1.215 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.486 -8.221 -0.044 1.00 0.00 H new ATOM 0 HD2 LYS A 21 8.252 -7.802 1.970 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.556 -9.301 2.550 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.971 -10.234 0.157 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.961 -8.813 -0.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 10.283 -10.669 0.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.301 -9.421 1.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 9.341 -10.798 2.074 1.00 0.00 H new ATOM 384 N ILE A 22 4.852 -4.863 2.972 1.00 0.00 N ATOM 385 CA ILE A 22 4.356 -3.585 3.452 1.00 0.00 C ATOM 386 C ILE A 22 3.490 -2.940 2.368 1.00 0.00 C ATOM 387 O ILE A 22 3.410 -3.446 1.250 1.00 0.00 O ATOM 388 CB ILE A 22 5.514 -2.702 3.921 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.507 -2.551 5.443 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.492 -1.347 3.210 1.00 0.00 C ATOM 391 CD1 ILE A 22 4.289 -1.750 5.910 1.00 0.00 C ATOM 0 H ILE A 22 4.730 -5.019 1.971 1.00 0.00 H new ATOM 0 HA ILE A 22 3.721 -3.727 4.326 1.00 0.00 H new ATOM 0 HB ILE A 22 6.449 -3.193 3.651 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.499 -3.536 5.910 1.00 0.00 H new ATOM 0 HG13 ILE A 22 6.421 -2.052 5.767 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.325 -0.738 3.561 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.582 -1.499 2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.553 -0.837 3.427 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.309 -1.658 6.996 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.313 -0.757 5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.377 -2.264 5.606 1.00 0.00 H new ATOM 403 N GLU A 23 2.863 -1.832 2.737 1.00 0.00 N ATOM 404 CA GLU A 23 2.006 -1.113 1.810 1.00 0.00 C ATOM 405 C GLU A 23 2.122 0.395 2.042 1.00 0.00 C ATOM 406 O GLU A 23 1.925 0.872 3.158 1.00 0.00 O ATOM 407 CB GLU A 23 0.554 -1.577 1.933 1.00 0.00 C ATOM 408 CG GLU A 23 -0.357 -0.783 0.994 1.00 0.00 C ATOM 409 CD GLU A 23 -1.746 -0.596 1.606 1.00 0.00 C ATOM 410 OE1 GLU A 23 -1.829 0.143 2.611 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.695 -1.196 1.056 1.00 0.00 O ATOM 0 H GLU A 23 2.932 -1.415 3.665 1.00 0.00 H new ATOM 0 HA GLU A 23 2.337 -1.331 0.795 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.487 -2.639 1.698 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.216 -1.456 2.962 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.087 0.191 0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.443 -1.303 0.040 1.00 0.00 H new ATOM 418 N GLY A 24 2.441 1.104 0.969 1.00 0.00 N ATOM 419 CA GLY A 24 2.586 2.548 1.041 1.00 0.00 C ATOM 420 C GLY A 24 1.792 3.235 -0.072 1.00 0.00 C ATOM 421 O GLY A 24 1.360 2.585 -1.023 1.00 0.00 O ATOM 0 H GLY A 24 2.603 0.705 0.044 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.241 2.904 2.012 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.639 2.816 0.960 1.00 0.00 H new ATOM 425 N ARG A 25 1.623 4.539 0.084 1.00 0.00 N ATOM 426 CA ARG A 25 0.889 5.322 -0.896 1.00 0.00 C ATOM 427 C ARG A 25 0.773 6.776 -0.436 1.00 0.00 C ATOM 428 O ARG A 25 0.515 7.041 0.737 1.00 0.00 O ATOM 429 CB ARG A 25 -0.513 4.751 -1.118 1.00 0.00 C ATOM 430 CG ARG A 25 -1.313 4.739 0.187 1.00 0.00 C ATOM 431 CD ARG A 25 -2.558 3.859 0.058 1.00 0.00 C ATOM 432 NE ARG A 25 -3.320 4.234 -1.154 1.00 0.00 N ATOM 433 CZ ARG A 25 -3.174 3.639 -2.346 1.00 0.00 C ATOM 434 NH1 ARG A 25 -2.294 2.639 -2.493 1.00 0.00 N ATOM 435 NH2 ARG A 25 -3.907 4.045 -3.392 1.00 0.00 N ATOM 0 H ARG A 25 1.982 5.074 0.875 1.00 0.00 H new ATOM 0 HA ARG A 25 1.440 5.278 -1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.038 5.346 -1.865 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.439 3.738 -1.513 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.686 4.371 0.999 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.607 5.756 0.447 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.268 2.810 0.005 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.186 3.972 0.942 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.998 4.992 -1.077 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -1.735 2.330 -1.698 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.183 2.186 -3.400 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.576 4.807 -3.281 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.796 3.592 -4.299 1.00 0.00 H new ATOM 449 N LEU A 26 0.970 7.681 -1.384 1.00 0.00 N ATOM 450 CA LEU A 26 0.890 9.102 -1.090 1.00 0.00 C ATOM 451 C LEU A 26 -0.232 9.347 -0.080 1.00 0.00 C ATOM 452 O LEU A 26 -1.408 9.189 -0.402 1.00 0.00 O ATOM 453 CB LEU A 26 0.743 9.908 -2.382 1.00 0.00 C ATOM 454 CG LEU A 26 -0.401 10.925 -2.410 1.00 0.00 C ATOM 455 CD1 LEU A 26 -0.247 11.955 -1.290 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.512 11.586 -3.786 1.00 0.00 C ATOM 0 H LEU A 26 1.185 7.458 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 26 1.815 9.449 -0.629 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.678 10.437 -2.566 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.604 9.211 -3.208 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.336 10.393 -2.231 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.073 12.665 -1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.255 11.447 -0.325 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.696 12.487 -1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.332 12.304 -3.780 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.420 12.101 -4.018 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.703 10.824 -4.541 1.00 0.00 H new ATOM 468 N TYR A 27 0.172 9.730 1.123 1.00 0.00 N ATOM 469 CA TYR A 27 -0.786 9.999 2.183 1.00 0.00 C ATOM 470 C TYR A 27 -1.879 10.956 1.704 1.00 0.00 C ATOM 471 O TYR A 27 -1.604 12.113 1.390 1.00 0.00 O ATOM 472 CB TYR A 27 0.007 10.671 3.306 1.00 0.00 C ATOM 473 CG TYR A 27 -0.528 10.375 4.708 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.851 10.022 4.882 1.00 0.00 C ATOM 475 CD2 TYR A 27 0.313 10.459 5.799 1.00 0.00 C ATOM 476 CE1 TYR A 27 -2.354 9.743 6.202 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.190 10.179 7.119 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.498 9.835 7.256 1.00 0.00 C ATOM 479 OH TYR A 27 -1.974 9.571 8.502 1.00 0.00 O ATOM 0 H TYR A 27 1.149 9.860 1.387 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.271 9.078 2.506 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.046 10.346 3.248 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.001 11.749 3.146 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -2.509 9.955 4.028 1.00 0.00 H new ATOM 0 HD2 TYR A 27 1.348 10.735 5.663 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -3.387 9.467 6.352 1.00 0.00 H new ATOM 0 HE2 TYR A 27 0.458 10.241 7.981 1.00 0.00 H new ATOM 0 HH TYR A 27 -1.721 10.297 9.109 1.00 0.00 H new ATOM 489 N ASP A 28 -3.098 10.437 1.663 1.00 0.00 N ATOM 490 CA ASP A 28 -4.235 11.231 1.227 1.00 0.00 C ATOM 491 C ASP A 28 -5.114 11.560 2.435 1.00 0.00 C ATOM 492 O ASP A 28 -4.770 11.225 3.568 1.00 0.00 O ATOM 493 CB ASP A 28 -5.088 10.462 0.217 1.00 0.00 C ATOM 494 CG ASP A 28 -4.405 10.176 -1.122 1.00 0.00 C ATOM 495 OD1 ASP A 28 -4.027 11.164 -1.789 1.00 0.00 O ATOM 496 OD2 ASP A 28 -4.276 8.977 -1.449 1.00 0.00 O ATOM 0 H ASP A 28 -3.323 9.477 1.924 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.854 12.139 0.760 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.388 9.514 0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -6.000 11.028 0.029 1.00 0.00 H new ATOM 501 N GLU A 29 -6.232 12.212 2.153 1.00 0.00 N ATOM 502 CA GLU A 29 -7.163 12.591 3.202 1.00 0.00 C ATOM 503 C GLU A 29 -7.857 11.350 3.769 1.00 0.00 C ATOM 504 O GLU A 29 -8.064 11.248 4.977 1.00 0.00 O ATOM 505 CB GLU A 29 -8.188 13.604 2.687 1.00 0.00 C ATOM 506 CG GLU A 29 -7.997 14.966 3.357 1.00 0.00 C ATOM 507 CD GLU A 29 -9.335 15.689 3.519 1.00 0.00 C ATOM 508 OE1 GLU A 29 -9.893 16.091 2.475 1.00 0.00 O ATOM 509 OE2 GLU A 29 -9.770 15.824 4.683 1.00 0.00 O ATOM 0 H GLU A 29 -6.514 12.488 1.212 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.601 13.069 4.004 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.089 13.709 1.607 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.196 13.237 2.881 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.531 14.833 4.333 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.319 15.577 2.761 1.00 0.00 H new ATOM 516 N LYS A 30 -8.196 10.438 2.870 1.00 0.00 N ATOM 517 CA LYS A 30 -8.861 9.208 3.266 1.00 0.00 C ATOM 518 C LYS A 30 -7.953 8.425 4.216 1.00 0.00 C ATOM 519 O LYS A 30 -8.415 7.890 5.222 1.00 0.00 O ATOM 520 CB LYS A 30 -9.294 8.412 2.033 1.00 0.00 C ATOM 521 CG LYS A 30 -10.786 8.602 1.754 1.00 0.00 C ATOM 522 CD LYS A 30 -11.606 7.458 2.355 1.00 0.00 C ATOM 523 CE LYS A 30 -12.069 6.485 1.268 1.00 0.00 C ATOM 524 NZ LYS A 30 -11.615 5.111 1.575 1.00 0.00 N ATOM 0 H LYS A 30 -8.023 10.526 1.869 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.778 9.430 3.812 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.715 8.732 1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.081 7.354 2.185 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.120 9.552 2.172 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.955 8.650 0.678 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.007 6.925 3.094 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.472 7.863 2.879 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -13.156 6.507 1.191 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.675 6.797 0.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -12.303 4.426 1.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -10.688 4.945 1.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -11.535 4.994 2.605 1.00 0.00 H new ATOM 538 N ARG A 31 -6.677 8.382 3.862 1.00 0.00 N ATOM 539 CA ARG A 31 -5.700 7.673 4.671 1.00 0.00 C ATOM 540 C ARG A 31 -5.666 8.248 6.088 1.00 0.00 C ATOM 541 O ARG A 31 -5.617 7.500 7.064 1.00 0.00 O ATOM 542 CB ARG A 31 -4.302 7.769 4.056 1.00 0.00 C ATOM 543 CG ARG A 31 -3.671 6.383 3.909 1.00 0.00 C ATOM 544 CD ARG A 31 -4.456 5.526 2.913 1.00 0.00 C ATOM 545 NE ARG A 31 -4.652 6.271 1.649 1.00 0.00 N ATOM 546 CZ ARG A 31 -5.489 5.889 0.675 1.00 0.00 C ATOM 547 NH1 ARG A 31 -6.211 4.769 0.812 1.00 0.00 N ATOM 548 NH2 ARG A 31 -5.603 6.627 -0.438 1.00 0.00 N ATOM 0 H ARG A 31 -6.297 8.826 3.026 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.998 6.625 4.707 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.363 8.250 3.080 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.668 8.397 4.682 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.639 6.483 3.574 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.644 5.887 4.879 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.920 4.597 2.718 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.422 5.253 3.338 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.117 7.128 1.511 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.124 4.206 1.658 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.848 4.479 0.070 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.053 7.479 -0.543 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -6.240 6.336 -1.180 1.00 0.00 H new ATOM 562 N ARG A 32 -5.694 9.570 6.157 1.00 0.00 N ATOM 563 CA ARG A 32 -5.668 10.254 7.439 1.00 0.00 C ATOM 564 C ARG A 32 -6.792 9.738 8.339 1.00 0.00 C ATOM 565 O ARG A 32 -6.593 9.542 9.537 1.00 0.00 O ATOM 566 CB ARG A 32 -5.820 11.766 7.260 1.00 0.00 C ATOM 567 CG ARG A 32 -4.513 12.395 6.772 1.00 0.00 C ATOM 568 CD ARG A 32 -4.122 13.591 7.643 1.00 0.00 C ATOM 569 NE ARG A 32 -2.648 13.686 7.739 1.00 0.00 N ATOM 570 CZ ARG A 32 -2.002 14.519 8.566 1.00 0.00 C ATOM 571 NH1 ARG A 32 -2.695 15.333 9.374 1.00 0.00 N ATOM 572 NH2 ARG A 32 -0.662 14.538 8.586 1.00 0.00 N ATOM 0 H ARG A 32 -5.734 10.187 5.346 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.703 10.050 7.904 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.616 11.973 6.545 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.115 12.220 8.206 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.717 11.650 6.792 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -4.624 12.716 5.736 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.527 14.509 7.218 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -4.553 13.483 8.638 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.089 13.080 7.138 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -3.715 15.319 9.360 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.203 15.967 10.003 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.134 13.918 7.972 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.170 15.172 9.216 1.00 0.00 H new ATOM 586 N GLN A 33 -7.949 9.532 7.727 1.00 0.00 N ATOM 587 CA GLN A 33 -9.106 9.043 8.458 1.00 0.00 C ATOM 588 C GLN A 33 -8.915 7.571 8.829 1.00 0.00 C ATOM 589 O GLN A 33 -9.502 7.090 9.797 1.00 0.00 O ATOM 590 CB GLN A 33 -10.390 9.243 7.651 1.00 0.00 C ATOM 591 CG GLN A 33 -11.292 10.291 8.307 1.00 0.00 C ATOM 592 CD GLN A 33 -12.665 9.702 8.638 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.992 9.429 9.781 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.446 9.522 7.577 1.00 0.00 N ATOM 0 H GLN A 33 -8.110 9.695 6.733 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.201 9.620 9.378 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.141 9.555 6.637 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.925 8.297 7.571 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.822 10.662 9.218 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -11.410 11.144 7.639 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -13.109 9.772 6.647 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.382 9.134 7.693 1.00 0.00 H new ATOM 603 N ILE A 34 -8.093 6.896 8.038 1.00 0.00 N ATOM 604 CA ILE A 34 -7.818 5.489 8.271 1.00 0.00 C ATOM 605 C ILE A 34 -6.881 5.348 9.473 1.00 0.00 C ATOM 606 O ILE A 34 -5.962 6.148 9.645 1.00 0.00 O ATOM 607 CB ILE A 34 -7.286 4.828 6.997 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.359 4.801 5.906 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.733 3.433 7.293 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.768 4.349 4.569 1.00 0.00 C ATOM 0 H ILE A 34 -7.609 7.298 7.235 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.737 4.958 8.518 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.458 5.428 6.620 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.164 4.127 6.199 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.798 5.793 5.797 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.362 2.986 6.371 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.918 3.510 8.013 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.525 2.808 7.706 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.551 4.338 3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.980 5.039 4.268 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.352 3.347 4.675 1.00 0.00 H new ATOM 622 N LYS A 35 -7.146 4.327 10.274 1.00 0.00 N ATOM 623 CA LYS A 35 -6.338 4.072 11.454 1.00 0.00 C ATOM 624 C LYS A 35 -6.043 2.574 11.551 1.00 0.00 C ATOM 625 O LYS A 35 -6.713 1.763 10.913 1.00 0.00 O ATOM 626 CB LYS A 35 -7.015 4.646 12.701 1.00 0.00 C ATOM 627 CG LYS A 35 -8.090 3.695 13.229 1.00 0.00 C ATOM 628 CD LYS A 35 -7.802 3.292 14.677 1.00 0.00 C ATOM 629 CE LYS A 35 -8.281 4.370 15.651 1.00 0.00 C ATOM 630 NZ LYS A 35 -7.274 4.595 16.712 1.00 0.00 N ATOM 0 H LYS A 35 -7.909 3.666 10.129 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.378 4.583 11.376 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -6.269 4.822 13.475 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.463 5.611 12.464 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -9.067 4.175 13.169 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.133 2.805 12.602 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -8.298 2.348 14.901 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.732 3.129 14.807 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.464 5.300 15.112 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -9.228 4.069 16.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.615 5.330 17.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.119 3.711 17.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -6.379 4.903 16.281 1.00 0.00 H new ATOM 644 N PRO A 36 -5.012 2.243 12.374 1.00 0.00 N ATOM 645 CA PRO A 36 -4.620 0.857 12.563 1.00 0.00 C ATOM 646 C PRO A 36 -5.618 0.121 13.459 1.00 0.00 C ATOM 647 O PRO A 36 -5.556 0.230 14.683 1.00 0.00 O ATOM 648 CB PRO A 36 -3.222 0.921 13.157 1.00 0.00 C ATOM 649 CG PRO A 36 -3.069 2.328 13.710 1.00 0.00 C ATOM 650 CD PRO A 36 -4.197 3.177 13.146 1.00 0.00 C ATOM 0 HA PRO A 36 -4.617 0.290 11.632 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.097 0.176 13.943 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.466 0.715 12.400 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.108 2.316 14.799 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.101 2.745 13.430 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.777 3.645 13.942 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.812 3.980 12.518 1.00 0.00 H new ATOM 658 N GLY A 37 -6.514 -0.612 12.815 1.00 0.00 N ATOM 659 CA GLY A 37 -7.524 -1.365 13.539 1.00 0.00 C ATOM 660 C GLY A 37 -8.767 -1.587 12.674 1.00 0.00 C ATOM 661 O GLY A 37 -9.495 -2.560 12.865 1.00 0.00 O ATOM 0 H GLY A 37 -6.562 -0.701 11.800 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.114 -2.327 13.847 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.800 -0.830 14.448 1.00 0.00 H new ATOM 665 N ASP A 38 -8.972 -0.669 11.741 1.00 0.00 N ATOM 666 CA ASP A 38 -10.114 -0.752 10.847 1.00 0.00 C ATOM 667 C ASP A 38 -9.854 -1.832 9.795 1.00 0.00 C ATOM 668 O ASP A 38 -8.834 -2.518 9.843 1.00 0.00 O ATOM 669 CB ASP A 38 -10.340 0.574 10.117 1.00 0.00 C ATOM 670 CG ASP A 38 -10.819 1.726 11.003 1.00 0.00 C ATOM 671 OD1 ASP A 38 -10.090 2.040 11.968 1.00 0.00 O ATOM 672 OD2 ASP A 38 -11.903 2.266 10.694 1.00 0.00 O ATOM 0 H ASP A 38 -8.366 0.136 11.585 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.994 -0.989 11.445 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.408 0.869 9.635 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.072 0.416 9.325 1.00 0.00 H new ATOM 677 N VAL A 39 -10.795 -1.950 8.870 1.00 0.00 N ATOM 678 CA VAL A 39 -10.682 -2.936 7.808 1.00 0.00 C ATOM 679 C VAL A 39 -11.092 -2.297 6.480 1.00 0.00 C ATOM 680 O VAL A 39 -11.979 -1.445 6.444 1.00 0.00 O ATOM 681 CB VAL A 39 -11.507 -4.177 8.155 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.482 -5.190 7.009 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.019 -4.812 9.459 1.00 0.00 C ATOM 0 H VAL A 39 -11.639 -1.379 8.834 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.649 -3.269 7.704 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.540 -3.863 8.301 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.076 -6.062 7.282 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.898 -4.734 6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.454 -5.497 6.817 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.622 -5.692 9.683 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.975 -5.105 9.352 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.112 -4.092 10.272 1.00 0.00 H new ATOM 693 N ILE A 40 -10.428 -2.734 5.420 1.00 0.00 N ATOM 694 CA ILE A 40 -10.712 -2.216 4.092 1.00 0.00 C ATOM 695 C ILE A 40 -11.059 -3.378 3.159 1.00 0.00 C ATOM 696 O ILE A 40 -10.233 -4.258 2.925 1.00 0.00 O ATOM 697 CB ILE A 40 -9.551 -1.352 3.594 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.959 -0.519 4.733 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.983 -0.482 2.412 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.718 -1.195 5.318 1.00 0.00 C ATOM 0 H ILE A 40 -9.694 -3.441 5.454 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.580 -1.558 4.118 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.762 -2.013 3.236 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.698 0.473 4.365 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.706 -0.383 5.515 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.140 0.122 2.077 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.320 -1.120 1.595 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.798 0.172 2.721 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.317 -0.583 6.126 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.988 -2.177 5.707 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.964 -1.308 4.539 1.00 0.00 H new ATOM 712 N SER A 41 -12.283 -3.343 2.653 1.00 0.00 N ATOM 713 CA SER A 41 -12.749 -4.382 1.751 1.00 0.00 C ATOM 714 C SER A 41 -12.526 -3.954 0.299 1.00 0.00 C ATOM 715 O SER A 41 -12.801 -2.811 -0.065 1.00 0.00 O ATOM 716 CB SER A 41 -14.227 -4.696 1.990 1.00 0.00 C ATOM 717 OG SER A 41 -14.703 -5.720 1.120 1.00 0.00 O ATOM 0 H SER A 41 -12.966 -2.612 2.851 1.00 0.00 H new ATOM 0 HA SER A 41 -12.176 -5.288 1.948 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.369 -5.005 3.026 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.818 -3.792 1.843 1.00 0.00 H new ATOM 0 HG SER A 41 -15.678 -5.658 1.044 1.00 0.00 H new ATOM 723 N PHE A 42 -12.029 -4.893 -0.492 1.00 0.00 N ATOM 724 CA PHE A 42 -11.765 -4.628 -1.896 1.00 0.00 C ATOM 725 C PHE A 42 -12.707 -5.434 -2.793 1.00 0.00 C ATOM 726 O PHE A 42 -12.866 -6.639 -2.607 1.00 0.00 O ATOM 727 CB PHE A 42 -10.324 -5.061 -2.170 1.00 0.00 C ATOM 728 CG PHE A 42 -9.271 -4.205 -1.462 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.649 -3.094 -0.775 1.00 0.00 C ATOM 730 CD2 PHE A 42 -7.959 -4.557 -1.519 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.672 -2.300 -0.117 1.00 0.00 C ATOM 732 CE2 PHE A 42 -6.982 -3.763 -0.861 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.359 -2.651 -0.174 1.00 0.00 C ATOM 0 H PHE A 42 -11.802 -5.839 -0.187 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.919 -3.570 -2.110 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.202 -6.099 -1.860 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.143 -5.026 -3.244 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.691 -2.815 -0.730 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.660 -5.440 -2.064 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.972 -1.417 0.429 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -5.940 -4.042 -0.906 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.616 -2.047 0.326 1.00 0.00 H new ATOM 743 N GLU A 43 -13.306 -4.736 -3.746 1.00 0.00 N ATOM 744 CA GLU A 43 -14.228 -5.372 -4.672 1.00 0.00 C ATOM 745 C GLU A 43 -15.380 -6.028 -3.908 1.00 0.00 C ATOM 746 O GLU A 43 -15.699 -7.193 -4.140 1.00 0.00 O ATOM 747 CB GLU A 43 -13.503 -6.391 -5.553 1.00 0.00 C ATOM 748 CG GLU A 43 -12.431 -5.713 -6.408 1.00 0.00 C ATOM 749 CD GLU A 43 -13.064 -4.779 -7.442 1.00 0.00 C ATOM 750 OE1 GLU A 43 -13.526 -5.308 -8.476 1.00 0.00 O ATOM 751 OE2 GLU A 43 -13.071 -3.558 -7.175 1.00 0.00 O ATOM 0 H GLU A 43 -13.171 -3.736 -3.897 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.643 -4.605 -5.326 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.044 -7.156 -4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.222 -6.896 -6.198 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.754 -5.147 -5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.832 -6.470 -6.915 1.00 0.00 H new ATOM 758 N GLY A 44 -15.972 -5.251 -3.013 1.00 0.00 N ATOM 759 CA GLY A 44 -17.082 -5.742 -2.214 1.00 0.00 C ATOM 760 C GLY A 44 -16.579 -6.527 -1.001 1.00 0.00 C ATOM 761 O GLY A 44 -16.856 -6.159 0.140 1.00 0.00 O ATOM 0 H GLY A 44 -15.704 -4.285 -2.823 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.694 -4.904 -1.881 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.721 -6.380 -2.825 1.00 0.00 H new ATOM 765 N GLY A 45 -15.848 -7.594 -1.289 1.00 0.00 N ATOM 766 CA GLY A 45 -15.304 -8.435 -0.236 1.00 0.00 C ATOM 767 C GLY A 45 -14.356 -9.489 -0.811 1.00 0.00 C ATOM 768 O GLY A 45 -14.235 -10.584 -0.265 1.00 0.00 O ATOM 0 H GLY A 45 -15.620 -7.895 -2.236 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.772 -7.818 0.488 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.117 -8.925 0.299 1.00 0.00 H new ATOM 772 N LYS A 46 -13.707 -9.121 -1.906 1.00 0.00 N ATOM 773 CA LYS A 46 -12.773 -10.021 -2.561 1.00 0.00 C ATOM 774 C LYS A 46 -11.471 -10.070 -1.760 1.00 0.00 C ATOM 775 O LYS A 46 -10.875 -11.134 -1.601 1.00 0.00 O ATOM 776 CB LYS A 46 -12.580 -9.621 -4.025 1.00 0.00 C ATOM 777 CG LYS A 46 -12.344 -10.851 -4.903 1.00 0.00 C ATOM 778 CD LYS A 46 -10.918 -11.378 -4.737 1.00 0.00 C ATOM 779 CE LYS A 46 -10.500 -12.220 -5.945 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.825 -13.646 -5.719 1.00 0.00 N ATOM 0 H LYS A 46 -13.810 -8.211 -2.356 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.173 -11.035 -2.582 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.459 -9.082 -4.377 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.733 -8.940 -4.111 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -13.057 -11.632 -4.640 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.522 -10.596 -5.948 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.229 -10.542 -4.616 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.852 -11.979 -3.830 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.010 -11.862 -6.839 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.430 -12.108 -6.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.535 -14.204 -6.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.319 -13.988 -4.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.849 -13.750 -5.573 1.00 0.00 H new ATOM 794 N LEU A 47 -11.067 -8.904 -1.276 1.00 0.00 N ATOM 795 CA LEU A 47 -9.846 -8.800 -0.495 1.00 0.00 C ATOM 796 C LEU A 47 -10.091 -7.886 0.707 1.00 0.00 C ATOM 797 O LEU A 47 -10.362 -6.697 0.542 1.00 0.00 O ATOM 798 CB LEU A 47 -8.681 -8.354 -1.380 1.00 0.00 C ATOM 799 CG LEU A 47 -7.393 -9.172 -1.256 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.834 -9.102 0.166 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.614 -10.615 -1.715 1.00 0.00 C ATOM 0 H LEU A 47 -11.564 -8.023 -1.410 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.561 -9.775 -0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.008 -8.384 -2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.451 -7.314 -1.148 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.645 -8.735 -1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.919 -9.692 0.227 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.615 -8.065 0.420 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.569 -9.500 0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.684 -11.175 -1.617 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.384 -11.079 -1.098 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.932 -10.620 -2.757 1.00 0.00 H new ATOM 813 N LYS A 48 -9.986 -8.474 1.889 1.00 0.00 N ATOM 814 CA LYS A 48 -10.193 -7.727 3.118 1.00 0.00 C ATOM 815 C LYS A 48 -8.853 -7.557 3.837 1.00 0.00 C ATOM 816 O LYS A 48 -8.150 -8.534 4.088 1.00 0.00 O ATOM 817 CB LYS A 48 -11.270 -8.394 3.975 1.00 0.00 C ATOM 818 CG LYS A 48 -12.503 -8.738 3.137 1.00 0.00 C ATOM 819 CD LYS A 48 -13.508 -7.584 3.140 1.00 0.00 C ATOM 820 CE LYS A 48 -14.935 -8.099 2.942 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.554 -8.427 4.246 1.00 0.00 N ATOM 0 H LYS A 48 -9.760 -9.460 2.022 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.567 -6.727 2.898 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.869 -9.301 4.428 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.554 -7.729 4.791 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.201 -8.959 2.113 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.976 -9.638 3.531 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.441 -7.041 4.083 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.259 -6.878 2.348 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.532 -7.345 2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.923 -8.984 2.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.522 -8.775 4.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.993 -9.162 4.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.583 -7.574 4.841 1.00 0.00 H new ATOM 835 N VAL A 49 -8.540 -6.307 4.149 1.00 0.00 N ATOM 836 CA VAL A 49 -7.297 -5.996 4.834 1.00 0.00 C ATOM 837 C VAL A 49 -7.590 -5.070 6.016 1.00 0.00 C ATOM 838 O VAL A 49 -8.557 -4.311 5.990 1.00 0.00 O ATOM 839 CB VAL A 49 -6.289 -5.405 3.847 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.065 -6.346 2.661 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.734 -4.021 3.371 1.00 0.00 C ATOM 0 H VAL A 49 -9.126 -5.499 3.940 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.845 -6.903 5.235 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.339 -5.291 4.368 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.344 -5.901 1.975 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.682 -7.301 3.021 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.009 -6.507 2.141 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.000 -3.624 2.670 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.702 -4.100 2.876 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.818 -3.351 4.227 1.00 0.00 H new ATOM 851 N ARG A 50 -6.736 -5.164 7.025 1.00 0.00 N ATOM 852 CA ARG A 50 -6.891 -4.344 8.215 1.00 0.00 C ATOM 853 C ARG A 50 -5.565 -3.668 8.570 1.00 0.00 C ATOM 854 O ARG A 50 -4.537 -4.333 8.687 1.00 0.00 O ATOM 855 CB ARG A 50 -7.363 -5.182 9.404 1.00 0.00 C ATOM 856 CG ARG A 50 -7.217 -4.406 10.715 1.00 0.00 C ATOM 857 CD ARG A 50 -6.180 -5.063 11.628 1.00 0.00 C ATOM 858 NE ARG A 50 -6.858 -5.892 12.650 1.00 0.00 N ATOM 859 CZ ARG A 50 -6.262 -6.876 13.336 1.00 0.00 C ATOM 860 NH1 ARG A 50 -4.972 -7.161 13.114 1.00 0.00 N ATOM 861 NH2 ARG A 50 -6.956 -7.575 14.244 1.00 0.00 N ATOM 0 H ARG A 50 -5.935 -5.795 7.043 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.643 -3.585 7.999 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.405 -5.468 9.261 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.784 -6.104 9.457 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.921 -3.379 10.503 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.179 -4.362 11.225 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.503 -5.680 11.038 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.573 -4.298 12.112 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.841 -5.702 12.844 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.444 -6.629 12.423 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -4.518 -7.910 13.636 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.938 -7.358 14.413 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.502 -8.324 14.766 1.00 0.00 H new ATOM 875 N VAL A 51 -5.631 -2.354 8.731 1.00 0.00 N ATOM 876 CA VAL A 51 -4.449 -1.582 9.071 1.00 0.00 C ATOM 877 C VAL A 51 -3.881 -2.083 10.400 1.00 0.00 C ATOM 878 O VAL A 51 -4.633 -2.464 11.296 1.00 0.00 O ATOM 879 CB VAL A 51 -4.786 -0.089 9.089 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.533 0.753 9.333 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.487 0.331 7.796 1.00 0.00 C ATOM 0 H VAL A 51 -6.485 -1.805 8.632 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.675 -1.718 8.316 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.474 0.089 9.915 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.801 1.810 9.341 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.094 0.482 10.293 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.810 0.568 8.539 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.715 1.396 7.835 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.834 0.131 6.947 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.412 -0.234 7.684 1.00 0.00 H new ATOM 891 N LYS A 52 -2.559 -2.066 10.486 1.00 0.00 N ATOM 892 CA LYS A 52 -1.882 -2.514 11.692 1.00 0.00 C ATOM 893 C LYS A 52 -1.206 -1.319 12.366 1.00 0.00 C ATOM 894 O LYS A 52 -1.244 -1.189 13.588 1.00 0.00 O ATOM 895 CB LYS A 52 -0.924 -3.663 11.372 1.00 0.00 C ATOM 896 CG LYS A 52 -1.377 -4.959 12.047 1.00 0.00 C ATOM 897 CD LYS A 52 -0.364 -5.412 13.100 1.00 0.00 C ATOM 898 CE LYS A 52 -0.820 -5.017 14.506 1.00 0.00 C ATOM 899 NZ LYS A 52 0.310 -4.458 15.280 1.00 0.00 N ATOM 0 H LYS A 52 -1.939 -1.749 9.741 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.601 -2.918 12.405 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.873 -3.809 10.293 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.081 -3.407 11.706 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.350 -4.809 12.514 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.501 -5.740 11.297 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.237 -6.493 13.046 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.608 -4.966 12.890 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -1.623 -4.282 14.441 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.226 -5.888 15.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.017 -4.195 16.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.064 -5.170 15.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.679 -3.615 14.796 1.00 0.00 H new ATOM 913 N ALA A 53 -0.603 -0.477 11.539 1.00 0.00 N ATOM 914 CA ALA A 53 0.081 0.703 12.041 1.00 0.00 C ATOM 915 C ALA A 53 0.331 1.672 10.884 1.00 0.00 C ATOM 916 O ALA A 53 0.455 1.253 9.734 1.00 0.00 O ATOM 917 CB ALA A 53 1.375 0.284 12.741 1.00 0.00 C ATOM 0 H ALA A 53 -0.574 -0.588 10.526 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.535 1.220 12.777 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.888 1.169 13.117 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.140 -0.381 13.572 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.020 -0.235 12.032 1.00 0.00 H new ATOM 923 N ILE A 54 0.398 2.950 11.228 1.00 0.00 N ATOM 924 CA ILE A 54 0.631 3.982 10.232 1.00 0.00 C ATOM 925 C ILE A 54 2.073 4.480 10.348 1.00 0.00 C ATOM 926 O ILE A 54 2.653 4.465 11.433 1.00 0.00 O ATOM 927 CB ILE A 54 -0.415 5.092 10.356 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.964 5.483 8.982 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.151 6.296 11.111 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.690 6.828 9.045 1.00 0.00 C ATOM 0 H ILE A 54 0.295 3.294 12.183 1.00 0.00 H new ATOM 0 HA ILE A 54 0.513 3.576 9.227 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.252 4.710 10.941 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.147 5.540 8.263 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.648 4.712 8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.612 7.071 11.185 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.454 5.988 12.112 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.015 6.688 10.575 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.070 7.083 8.056 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.521 6.760 9.747 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.996 7.601 9.377 1.00 0.00 H new ATOM 942 N ARG A 55 2.610 4.909 9.216 1.00 0.00 N ATOM 943 CA ARG A 55 3.973 5.411 9.177 1.00 0.00 C ATOM 944 C ARG A 55 4.146 6.388 8.012 1.00 0.00 C ATOM 945 O ARG A 55 3.678 6.129 6.905 1.00 0.00 O ATOM 946 CB ARG A 55 4.977 4.266 9.026 1.00 0.00 C ATOM 947 CG ARG A 55 4.994 3.383 10.276 1.00 0.00 C ATOM 948 CD ARG A 55 6.071 2.301 10.168 1.00 0.00 C ATOM 949 NE ARG A 55 6.404 1.784 11.514 1.00 0.00 N ATOM 950 CZ ARG A 55 7.207 0.734 11.738 1.00 0.00 C ATOM 951 NH1 ARG A 55 7.762 0.084 10.706 1.00 0.00 N ATOM 952 NH2 ARG A 55 7.453 0.335 12.993 1.00 0.00 N ATOM 0 H ARG A 55 2.126 4.919 8.318 1.00 0.00 H new ATOM 0 HA ARG A 55 4.164 5.926 10.119 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.719 3.664 8.155 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.973 4.672 8.850 1.00 0.00 H new ATOM 0 HG2 ARG A 55 5.178 3.998 11.157 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.018 2.917 10.410 1.00 0.00 H new ATOM 0 HD2 ARG A 55 5.719 1.488 9.534 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.964 2.710 9.695 1.00 0.00 H new ATOM 0 HE ARG A 55 5.997 2.256 12.322 1.00 0.00 H new ATOM 0 HH11 ARG A 55 7.573 0.388 9.751 1.00 0.00 H new ATOM 0 HH12 ARG A 55 8.373 -0.715 10.876 1.00 0.00 H new ATOM 0 HH21 ARG A 55 7.029 0.830 13.778 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.064 -0.464 13.164 1.00 0.00 H new ATOM 966 N VAL A 56 4.820 7.491 8.303 1.00 0.00 N ATOM 967 CA VAL A 56 5.061 8.509 7.294 1.00 0.00 C ATOM 968 C VAL A 56 6.565 8.623 7.039 1.00 0.00 C ATOM 969 O VAL A 56 7.369 8.423 7.949 1.00 0.00 O ATOM 970 CB VAL A 56 4.425 9.832 7.724 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.568 10.891 6.628 1.00 0.00 C ATOM 972 CG2 VAL A 56 2.957 9.636 8.108 1.00 0.00 C ATOM 0 H VAL A 56 5.207 7.702 9.223 1.00 0.00 H new ATOM 0 HA VAL A 56 4.592 8.230 6.350 1.00 0.00 H new ATOM 0 HB VAL A 56 4.957 10.188 8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.108 11.822 6.959 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.625 11.062 6.423 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.074 10.544 5.720 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.529 10.592 8.410 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.406 9.246 7.252 1.00 0.00 H new ATOM 0 HG23 VAL A 56 2.889 8.930 8.936 1.00 0.00 H new ATOM 982 N TYR A 57 6.900 8.944 5.798 1.00 0.00 N ATOM 983 CA TYR A 57 8.294 9.087 5.413 1.00 0.00 C ATOM 984 C TYR A 57 8.512 10.373 4.613 1.00 0.00 C ATOM 985 O TYR A 57 7.568 11.122 4.365 1.00 0.00 O ATOM 986 CB TYR A 57 8.610 7.886 4.520 1.00 0.00 C ATOM 987 CG TYR A 57 8.850 6.585 5.288 1.00 0.00 C ATOM 988 CD1 TYR A 57 7.780 5.869 5.785 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.138 6.128 5.486 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.007 4.644 6.508 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.364 4.904 6.209 1.00 0.00 C ATOM 992 CZ TYR A 57 9.288 4.222 6.685 1.00 0.00 C ATOM 993 OH TYR A 57 9.502 3.066 7.368 1.00 0.00 O ATOM 0 H TYR A 57 6.231 9.109 5.046 1.00 0.00 H new ATOM 0 HA TYR A 57 8.933 9.132 6.295 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.785 7.738 3.823 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.494 8.112 3.924 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.773 6.227 5.632 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.976 6.689 5.098 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.179 4.073 6.901 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.366 4.535 6.370 1.00 0.00 H new ATOM 0 HH TYR A 57 10.464 2.888 7.416 1.00 0.00 H new ATOM 1003 N ASN A 58 9.762 10.590 4.232 1.00 0.00 N ATOM 1004 CA ASN A 58 10.117 11.773 3.466 1.00 0.00 C ATOM 1005 C ASN A 58 9.676 11.585 2.013 1.00 0.00 C ATOM 1006 O ASN A 58 9.092 12.488 1.416 1.00 0.00 O ATOM 1007 CB ASN A 58 11.629 12.002 3.475 1.00 0.00 C ATOM 1008 CG ASN A 58 11.998 13.261 2.688 1.00 0.00 C ATOM 1009 OD1 ASN A 58 11.538 14.356 2.967 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.851 13.045 1.691 1.00 0.00 N ATOM 0 H ASN A 58 10.542 9.966 4.439 1.00 0.00 H new ATOM 0 HA ASN A 58 9.620 12.630 3.920 1.00 0.00 H new ATOM 0 HB2 ASN A 58 11.980 12.095 4.503 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.134 11.138 3.043 1.00 0.00 H new ATOM 0 HD21 ASN A 58 13.159 13.822 1.106 1.00 0.00 H new ATOM 0 HD22 ASN A 58 13.198 12.103 1.512 1.00 0.00 H new ATOM 1017 N SER A 59 9.972 10.405 1.486 1.00 0.00 N ATOM 1018 CA SER A 59 9.614 10.087 0.114 1.00 0.00 C ATOM 1019 C SER A 59 9.475 8.573 -0.052 1.00 0.00 C ATOM 1020 O SER A 59 9.816 7.811 0.851 1.00 0.00 O ATOM 1021 CB SER A 59 10.651 10.636 -0.867 1.00 0.00 C ATOM 1022 OG SER A 59 10.412 12.004 -1.187 1.00 0.00 O ATOM 0 H SER A 59 10.456 9.658 1.985 1.00 0.00 H new ATOM 0 HA SER A 59 8.658 10.560 -0.109 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.647 10.533 -0.437 1.00 0.00 H new ATOM 0 HB3 SER A 59 10.636 10.042 -1.781 1.00 0.00 H new ATOM 0 HG SER A 59 9.906 12.426 -0.461 1.00 0.00 H new ATOM 1028 N PHE A 60 8.973 8.181 -1.214 1.00 0.00 N ATOM 1029 CA PHE A 60 8.784 6.771 -1.511 1.00 0.00 C ATOM 1030 C PHE A 60 10.122 6.030 -1.522 1.00 0.00 C ATOM 1031 O PHE A 60 10.207 4.889 -1.069 1.00 0.00 O ATOM 1032 CB PHE A 60 8.157 6.687 -2.904 1.00 0.00 C ATOM 1033 CG PHE A 60 6.720 6.162 -2.909 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.456 4.899 -2.479 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.706 6.959 -3.343 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.122 4.412 -2.483 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.372 6.471 -3.347 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.108 5.208 -2.917 1.00 0.00 C ATOM 0 H PHE A 60 8.691 8.816 -1.961 1.00 0.00 H new ATOM 0 HA PHE A 60 8.151 6.312 -0.752 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.173 7.678 -3.359 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.772 6.040 -3.529 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.261 4.266 -2.135 1.00 0.00 H new ATOM 0 HD2 PHE A 60 5.915 7.962 -3.684 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.913 3.409 -2.141 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.567 7.103 -3.692 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.094 4.837 -2.920 1.00 0.00 H new ATOM 1048 N ARG A 61 11.134 6.708 -2.043 1.00 0.00 N ATOM 1049 CA ARG A 61 12.464 6.127 -2.119 1.00 0.00 C ATOM 1050 C ARG A 61 12.938 5.704 -0.727 1.00 0.00 C ATOM 1051 O ARG A 61 13.497 4.621 -0.561 1.00 0.00 O ATOM 1052 CB ARG A 61 13.466 7.121 -2.711 1.00 0.00 C ATOM 1053 CG ARG A 61 14.626 6.390 -3.390 1.00 0.00 C ATOM 1054 CD ARG A 61 15.961 6.761 -2.741 1.00 0.00 C ATOM 1055 NE ARG A 61 16.584 7.887 -3.472 1.00 0.00 N ATOM 1056 CZ ARG A 61 17.230 7.759 -4.639 1.00 0.00 C ATOM 1057 NH1 ARG A 61 17.342 6.554 -5.215 1.00 0.00 N ATOM 1058 NH2 ARG A 61 17.764 8.836 -5.231 1.00 0.00 N ATOM 0 H ARG A 61 11.060 7.654 -2.417 1.00 0.00 H new ATOM 0 HA ARG A 61 12.408 5.254 -2.769 1.00 0.00 H new ATOM 0 HB2 ARG A 61 12.963 7.763 -3.434 1.00 0.00 H new ATOM 0 HB3 ARG A 61 13.851 7.768 -1.923 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.471 5.313 -3.323 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.650 6.643 -4.450 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.804 7.036 -1.698 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.629 5.900 -2.746 1.00 0.00 H new ATOM 0 HE ARG A 61 16.517 8.819 -3.062 1.00 0.00 H new ATOM 0 HH11 ARG A 61 16.935 5.734 -4.765 1.00 0.00 H new ATOM 0 HH12 ARG A 61 17.834 6.457 -6.103 1.00 0.00 H new ATOM 0 HH21 ARG A 61 17.679 9.753 -4.793 1.00 0.00 H new ATOM 0 HH22 ARG A 61 18.256 8.738 -6.119 1.00 0.00 H new ATOM 1072 N GLU A 62 12.697 6.580 0.237 1.00 0.00 N ATOM 1073 CA GLU A 62 13.092 6.310 1.609 1.00 0.00 C ATOM 1074 C GLU A 62 12.345 5.088 2.147 1.00 0.00 C ATOM 1075 O GLU A 62 12.886 4.327 2.947 1.00 0.00 O ATOM 1076 CB GLU A 62 12.856 7.532 2.499 1.00 0.00 C ATOM 1077 CG GLU A 62 14.142 8.342 2.672 1.00 0.00 C ATOM 1078 CD GLU A 62 15.277 7.461 3.198 1.00 0.00 C ATOM 1079 OE1 GLU A 62 15.232 7.138 4.405 1.00 0.00 O ATOM 1080 OE2 GLU A 62 16.165 7.132 2.382 1.00 0.00 O ATOM 0 H GLU A 62 12.233 7.477 0.095 1.00 0.00 H new ATOM 0 HA GLU A 62 14.160 6.093 1.622 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.082 8.162 2.060 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.491 7.211 3.474 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.430 8.782 1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.967 9.167 3.363 1.00 0.00 H new ATOM 1087 N MET A 63 11.112 4.938 1.685 1.00 0.00 N ATOM 1088 CA MET A 63 10.285 3.821 2.109 1.00 0.00 C ATOM 1089 C MET A 63 10.727 2.523 1.432 1.00 0.00 C ATOM 1090 O MET A 63 10.887 1.497 2.092 1.00 0.00 O ATOM 1091 CB MET A 63 8.823 4.107 1.760 1.00 0.00 C ATOM 1092 CG MET A 63 7.980 4.278 3.026 1.00 0.00 C ATOM 1093 SD MET A 63 6.542 5.274 2.672 1.00 0.00 S ATOM 1094 CE MET A 63 5.858 4.355 1.303 1.00 0.00 C ATOM 0 H MET A 63 10.666 5.571 1.021 1.00 0.00 H new ATOM 0 HA MET A 63 10.394 3.701 3.187 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.760 5.010 1.152 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.422 3.290 1.160 1.00 0.00 H new ATOM 0 HG2 MET A 63 7.673 3.302 3.403 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.575 4.749 3.808 1.00 0.00 H new ATOM 0 HE1 MET A 63 4.789 4.555 1.229 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.349 4.659 0.379 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.017 3.289 1.465 1.00 0.00 H new ATOM 1104 N LEU A 64 10.911 2.609 0.122 1.00 0.00 N ATOM 1105 CA LEU A 64 11.332 1.454 -0.652 1.00 0.00 C ATOM 1106 C LEU A 64 12.791 1.131 -0.326 1.00 0.00 C ATOM 1107 O LEU A 64 13.193 -0.032 -0.348 1.00 0.00 O ATOM 1108 CB LEU A 64 11.071 1.683 -2.142 1.00 0.00 C ATOM 1109 CG LEU A 64 9.685 2.222 -2.505 1.00 0.00 C ATOM 1110 CD1 LEU A 64 9.790 3.372 -3.508 1.00 0.00 C ATOM 1111 CD2 LEU A 64 8.777 1.100 -3.012 1.00 0.00 C ATOM 0 H LEU A 64 10.776 3.461 -0.422 1.00 0.00 H new ATOM 0 HA LEU A 64 10.743 0.578 -0.380 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.820 2.379 -2.519 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.221 0.739 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 64 9.227 2.624 -1.601 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.792 3.737 -3.749 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.377 4.181 -3.074 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.277 3.019 -4.417 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.798 1.509 -3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.219 0.647 -3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.665 0.343 -2.235 1.00 0.00 H new ATOM 1123 N GLU A 65 13.545 2.180 -0.031 1.00 0.00 N ATOM 1124 CA GLU A 65 14.951 2.022 0.298 1.00 0.00 C ATOM 1125 C GLU A 65 15.105 1.489 1.724 1.00 0.00 C ATOM 1126 O GLU A 65 15.893 0.576 1.968 1.00 0.00 O ATOM 1127 CB GLU A 65 15.707 3.340 0.121 1.00 0.00 C ATOM 1128 CG GLU A 65 15.792 3.730 -1.356 1.00 0.00 C ATOM 1129 CD GLU A 65 17.203 3.505 -1.903 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.151 3.639 -1.099 1.00 0.00 O ATOM 1131 OE2 GLU A 65 17.302 3.203 -3.112 1.00 0.00 O ATOM 0 H GLU A 65 13.208 3.143 -0.013 1.00 0.00 H new ATOM 0 HA GLU A 65 15.386 1.297 -0.390 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.205 4.129 0.681 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.711 3.246 0.534 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.077 3.143 -1.932 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.515 4.777 -1.476 1.00 0.00 H new ATOM 1138 N LYS A 66 14.341 2.083 2.630 1.00 0.00 N ATOM 1139 CA LYS A 66 14.383 1.679 4.025 1.00 0.00 C ATOM 1140 C LYS A 66 13.483 0.458 4.225 1.00 0.00 C ATOM 1141 O LYS A 66 13.965 -0.624 4.556 1.00 0.00 O ATOM 1142 CB LYS A 66 14.031 2.858 4.934 1.00 0.00 C ATOM 1143 CG LYS A 66 14.668 2.694 6.316 1.00 0.00 C ATOM 1144 CD LYS A 66 13.749 3.239 7.411 1.00 0.00 C ATOM 1145 CE LYS A 66 13.898 4.756 7.547 1.00 0.00 C ATOM 1146 NZ LYS A 66 13.043 5.264 8.643 1.00 0.00 N ATOM 0 H LYS A 66 13.690 2.841 2.425 1.00 0.00 H new ATOM 0 HA LYS A 66 15.393 1.380 4.305 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.374 3.787 4.479 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.948 2.933 5.035 1.00 0.00 H new ATOM 0 HG2 LYS A 66 14.876 1.640 6.502 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.624 3.217 6.344 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.713 2.991 7.178 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.986 2.760 8.361 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.940 5.009 7.743 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.624 5.240 6.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.368 6.210 8.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.057 5.320 8.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 13.102 4.619 9.457 1.00 0.00 H new ATOM 1160 N GLU A 67 12.193 0.673 4.017 1.00 0.00 N ATOM 1161 CA GLU A 67 11.221 -0.396 4.171 1.00 0.00 C ATOM 1162 C GLU A 67 11.538 -1.543 3.209 1.00 0.00 C ATOM 1163 O GLU A 67 11.661 -2.693 3.627 1.00 0.00 O ATOM 1164 CB GLU A 67 9.797 0.121 3.957 1.00 0.00 C ATOM 1165 CG GLU A 67 8.845 -0.442 5.013 1.00 0.00 C ATOM 1166 CD GLU A 67 9.107 -1.931 5.250 1.00 0.00 C ATOM 1167 OE1 GLU A 67 9.170 -2.664 4.239 1.00 0.00 O ATOM 1168 OE2 GLU A 67 9.239 -2.302 6.436 1.00 0.00 O ATOM 0 H GLU A 67 11.798 1.572 3.743 1.00 0.00 H new ATOM 0 HA GLU A 67 11.285 -0.774 5.191 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.791 1.210 4.001 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.450 -0.160 2.963 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.968 0.106 5.947 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.813 -0.297 4.692 1.00 0.00 H new ATOM 1175 N GLY A 68 11.660 -1.190 1.937 1.00 0.00 N ATOM 1176 CA GLY A 68 11.960 -2.176 0.913 1.00 0.00 C ATOM 1177 C GLY A 68 11.027 -2.017 -0.290 1.00 0.00 C ATOM 1178 O GLY A 68 9.809 -1.954 -0.131 1.00 0.00 O ATOM 0 H GLY A 68 11.557 -0.235 1.593 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.996 -2.068 0.591 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.858 -3.179 1.327 1.00 0.00 H new ATOM 1182 N LEU A 69 11.635 -1.959 -1.466 1.00 0.00 N ATOM 1183 CA LEU A 69 10.874 -1.809 -2.695 1.00 0.00 C ATOM 1184 C LEU A 69 9.973 -3.031 -2.883 1.00 0.00 C ATOM 1185 O LEU A 69 8.752 -2.901 -2.960 1.00 0.00 O ATOM 1186 CB LEU A 69 11.810 -1.547 -3.876 1.00 0.00 C ATOM 1187 CG LEU A 69 11.187 -1.675 -5.267 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.458 -0.389 -5.663 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.237 -2.081 -6.303 1.00 0.00 C ATOM 0 H LEU A 69 12.646 -2.013 -1.594 1.00 0.00 H new ATOM 0 HA LEU A 69 10.222 -0.937 -2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.219 -0.542 -3.774 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.649 -2.240 -3.810 1.00 0.00 H new ATOM 0 HG LEU A 69 10.442 -2.470 -5.235 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.025 -0.508 -6.656 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.666 -0.184 -4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.164 0.441 -5.672 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.768 -2.165 -7.283 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.022 -1.326 -6.340 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.670 -3.042 -6.025 1.00 0.00 H new ATOM 1201 N GLU A 70 10.610 -4.191 -2.953 1.00 0.00 N ATOM 1202 CA GLU A 70 9.881 -5.435 -3.132 1.00 0.00 C ATOM 1203 C GLU A 70 9.027 -5.732 -1.898 1.00 0.00 C ATOM 1204 O GLU A 70 8.170 -6.614 -1.929 1.00 0.00 O ATOM 1205 CB GLU A 70 10.837 -6.593 -3.428 1.00 0.00 C ATOM 1206 CG GLU A 70 10.904 -6.877 -4.930 1.00 0.00 C ATOM 1207 CD GLU A 70 11.742 -8.125 -5.215 1.00 0.00 C ATOM 1208 OE1 GLU A 70 12.957 -8.072 -4.924 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.150 -9.104 -5.717 1.00 0.00 O ATOM 0 H GLU A 70 11.623 -4.295 -2.889 1.00 0.00 H new ATOM 0 HA GLU A 70 9.219 -5.325 -3.991 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.832 -6.352 -3.055 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.506 -7.487 -2.899 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.897 -7.013 -5.323 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.335 -6.020 -5.447 1.00 0.00 H new ATOM 1216 N ASN A 71 9.291 -4.978 -0.840 1.00 0.00 N ATOM 1217 CA ASN A 71 8.557 -5.150 0.402 1.00 0.00 C ATOM 1218 C ASN A 71 7.411 -4.137 0.456 1.00 0.00 C ATOM 1219 O ASN A 71 6.732 -4.017 1.475 1.00 0.00 O ATOM 1220 CB ASN A 71 9.460 -4.907 1.613 1.00 0.00 C ATOM 1221 CG ASN A 71 10.503 -6.017 1.751 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.668 -6.624 2.797 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.196 -6.249 0.640 1.00 0.00 N ATOM 0 H ASN A 71 10.002 -4.247 -0.818 1.00 0.00 H new ATOM 0 HA ASN A 71 8.180 -6.172 0.433 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.960 -3.944 1.511 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.855 -4.857 2.518 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.916 -6.972 0.629 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.008 -5.704 -0.202 1.00 0.00 H new ATOM 1230 N VAL A 72 7.231 -3.435 -0.653 1.00 0.00 N ATOM 1231 CA VAL A 72 6.179 -2.437 -0.744 1.00 0.00 C ATOM 1232 C VAL A 72 5.491 -2.551 -2.106 1.00 0.00 C ATOM 1233 O VAL A 72 4.267 -2.648 -2.181 1.00 0.00 O ATOM 1234 CB VAL A 72 6.755 -1.044 -0.480 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.716 0.042 -0.766 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.286 -0.933 0.950 1.00 0.00 C ATOM 0 H VAL A 72 7.796 -3.538 -1.496 1.00 0.00 H new ATOM 0 HA VAL A 72 5.420 -2.610 0.019 1.00 0.00 H new ATOM 0 HB VAL A 72 7.593 -0.893 -1.161 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.151 1.022 -0.570 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.407 -0.016 -1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.849 -0.105 -0.122 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.690 0.066 1.112 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.474 -1.115 1.655 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.073 -1.671 1.104 1.00 0.00 H new ATOM 1246 N LEU A 73 6.308 -2.537 -3.149 1.00 0.00 N ATOM 1247 CA LEU A 73 5.793 -2.638 -4.504 1.00 0.00 C ATOM 1248 C LEU A 73 6.317 -3.922 -5.150 1.00 0.00 C ATOM 1249 O LEU A 73 7.313 -3.897 -5.870 1.00 0.00 O ATOM 1250 CB LEU A 73 6.122 -1.372 -5.298 1.00 0.00 C ATOM 1251 CG LEU A 73 5.223 -1.083 -6.502 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.149 -0.052 -6.150 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.052 -0.655 -7.715 1.00 0.00 C ATOM 0 H LEU A 73 7.323 -2.457 -3.083 1.00 0.00 H new ATOM 0 HA LEU A 73 4.705 -2.707 -4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.074 -0.519 -4.621 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.152 -1.444 -5.648 1.00 0.00 H new ATOM 0 HG LEU A 73 4.708 -2.005 -6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.524 0.135 -7.023 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.531 -0.433 -5.337 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.625 0.878 -5.839 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.389 -0.456 -8.557 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.612 0.248 -7.473 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.746 -1.452 -7.981 1.00 0.00 H new ATOM 1265 N PRO A 74 5.603 -5.043 -4.861 1.00 0.00 N ATOM 1266 CA PRO A 74 5.986 -6.335 -5.406 1.00 0.00 C ATOM 1267 C PRO A 74 5.614 -6.438 -6.886 1.00 0.00 C ATOM 1268 O PRO A 74 4.435 -6.412 -7.237 1.00 0.00 O ATOM 1269 CB PRO A 74 5.265 -7.356 -4.540 1.00 0.00 C ATOM 1270 CG PRO A 74 4.147 -6.597 -3.844 1.00 0.00 C ATOM 1271 CD PRO A 74 4.417 -5.110 -4.012 1.00 0.00 C ATOM 0 HA PRO A 74 7.063 -6.500 -5.381 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.866 -8.170 -5.146 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.945 -7.802 -3.814 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.181 -6.861 -4.275 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.107 -6.861 -2.787 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.570 -4.603 -4.474 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.591 -4.628 -3.050 1.00 0.00 H new ATOM 1279 N GLY A 75 6.641 -6.552 -7.715 1.00 0.00 N ATOM 1280 CA GLY A 75 6.437 -6.658 -9.149 1.00 0.00 C ATOM 1281 C GLY A 75 7.314 -5.657 -9.904 1.00 0.00 C ATOM 1282 O GLY A 75 7.808 -5.954 -10.991 1.00 0.00 O ATOM 0 H GLY A 75 7.617 -6.573 -7.420 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.669 -7.671 -9.479 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.388 -6.478 -9.385 1.00 0.00 H new ATOM 1286 N VAL A 76 7.481 -4.491 -9.298 1.00 0.00 N ATOM 1287 CA VAL A 76 8.290 -3.444 -9.899 1.00 0.00 C ATOM 1288 C VAL A 76 9.571 -4.058 -10.467 1.00 0.00 C ATOM 1289 O VAL A 76 9.992 -5.131 -10.039 1.00 0.00 O ATOM 1290 CB VAL A 76 8.559 -2.338 -8.876 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.833 -2.627 -8.079 1.00 0.00 C ATOM 1292 CG2 VAL A 76 8.635 -0.970 -9.555 1.00 0.00 C ATOM 0 H VAL A 76 7.070 -4.248 -8.397 1.00 0.00 H new ATOM 0 HA VAL A 76 7.757 -2.978 -10.728 1.00 0.00 H new ATOM 0 HB VAL A 76 7.724 -2.318 -8.176 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.001 -1.826 -7.359 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.724 -3.574 -7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.682 -2.687 -8.760 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.827 -0.202 -8.806 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.442 -0.972 -10.288 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.690 -0.760 -10.056 1.00 0.00 H new ATOM 1302 N LYS A 77 10.155 -3.349 -11.422 1.00 0.00 N ATOM 1303 CA LYS A 77 11.380 -3.811 -12.052 1.00 0.00 C ATOM 1304 C LYS A 77 12.580 -3.365 -11.214 1.00 0.00 C ATOM 1305 O LYS A 77 13.599 -4.053 -11.168 1.00 0.00 O ATOM 1306 CB LYS A 77 11.441 -3.346 -13.509 1.00 0.00 C ATOM 1307 CG LYS A 77 10.386 -4.060 -14.357 1.00 0.00 C ATOM 1308 CD LYS A 77 10.790 -4.078 -15.833 1.00 0.00 C ATOM 1309 CE LYS A 77 11.418 -5.420 -16.213 1.00 0.00 C ATOM 1310 NZ LYS A 77 11.812 -5.423 -17.639 1.00 0.00 N ATOM 0 H LYS A 77 9.803 -2.459 -11.774 1.00 0.00 H new ATOM 0 HA LYS A 77 11.403 -4.900 -12.087 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.283 -2.269 -13.558 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.433 -3.542 -13.916 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.257 -5.081 -13.999 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.424 -3.559 -14.245 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.915 -3.893 -16.456 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.498 -3.273 -16.030 1.00 0.00 H new ATOM 0 HE2 LYS A 77 12.291 -5.610 -15.588 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.709 -6.226 -16.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.236 -6.341 -17.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.972 -5.264 -18.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.505 -4.666 -17.809 1.00 0.00 H new ATOM 1324 N SER A 78 12.419 -2.218 -10.572 1.00 0.00 N ATOM 1325 CA SER A 78 13.476 -1.673 -9.737 1.00 0.00 C ATOM 1326 C SER A 78 12.996 -0.389 -9.057 1.00 0.00 C ATOM 1327 O SER A 78 11.919 0.116 -9.366 1.00 0.00 O ATOM 1328 CB SER A 78 14.739 -1.398 -10.557 1.00 0.00 C ATOM 1329 OG SER A 78 15.856 -1.089 -9.729 1.00 0.00 O ATOM 0 H SER A 78 11.572 -1.651 -10.613 1.00 0.00 H new ATOM 0 HA SER A 78 13.724 -2.411 -8.974 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.971 -2.270 -11.168 1.00 0.00 H new ATOM 0 HB3 SER A 78 14.554 -0.569 -11.241 1.00 0.00 H new ATOM 0 HG SER A 78 16.642 -0.922 -10.289 1.00 0.00 H new ATOM 1335 N ILE A 79 13.820 0.101 -8.142 1.00 0.00 N ATOM 1336 CA ILE A 79 13.493 1.316 -7.415 1.00 0.00 C ATOM 1337 C ILE A 79 13.219 2.444 -8.411 1.00 0.00 C ATOM 1338 O ILE A 79 12.386 3.313 -8.158 1.00 0.00 O ATOM 1339 CB ILE A 79 14.590 1.645 -6.400 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.746 0.518 -5.377 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.330 2.995 -5.730 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.529 0.994 -4.152 1.00 0.00 C ATOM 0 H ILE A 79 14.713 -0.321 -7.888 1.00 0.00 H new ATOM 0 HA ILE A 79 12.582 1.177 -6.832 1.00 0.00 H new ATOM 0 HB ILE A 79 15.536 1.728 -6.935 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.763 0.163 -5.069 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.260 -0.326 -5.836 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.124 3.205 -5.013 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.308 3.779 -6.487 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.372 2.965 -5.211 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.626 0.174 -3.441 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.521 1.326 -4.460 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.000 1.822 -3.681 1.00 0.00 H new ATOM 1354 N GLU A 80 13.936 2.393 -9.525 1.00 0.00 N ATOM 1355 CA GLU A 80 13.780 3.400 -10.561 1.00 0.00 C ATOM 1356 C GLU A 80 12.379 3.322 -11.171 1.00 0.00 C ATOM 1357 O GLU A 80 11.675 4.327 -11.248 1.00 0.00 O ATOM 1358 CB GLU A 80 14.857 3.249 -11.638 1.00 0.00 C ATOM 1359 CG GLU A 80 15.829 4.430 -11.611 1.00 0.00 C ATOM 1360 CD GLU A 80 15.771 5.218 -12.921 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.755 5.918 -13.118 1.00 0.00 O ATOM 1362 OE2 GLU A 80 16.745 5.102 -13.696 1.00 0.00 O ATOM 0 H GLU A 80 14.626 1.671 -9.732 1.00 0.00 H new ATOM 0 HA GLU A 80 13.902 4.383 -10.107 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.404 2.319 -11.482 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.388 3.182 -12.620 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.585 5.087 -10.776 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.843 4.067 -11.445 1.00 0.00 H new ATOM 1369 N GLU A 81 12.017 2.118 -11.590 1.00 0.00 N ATOM 1370 CA GLU A 81 10.713 1.896 -12.191 1.00 0.00 C ATOM 1371 C GLU A 81 9.605 2.203 -11.182 1.00 0.00 C ATOM 1372 O GLU A 81 8.518 2.636 -11.562 1.00 0.00 O ATOM 1373 CB GLU A 81 10.591 0.466 -12.722 1.00 0.00 C ATOM 1374 CG GLU A 81 10.977 0.395 -14.200 1.00 0.00 C ATOM 1375 CD GLU A 81 10.148 1.377 -15.032 1.00 0.00 C ATOM 1376 OE1 GLU A 81 8.955 1.072 -15.245 1.00 0.00 O ATOM 1377 OE2 GLU A 81 10.726 2.409 -15.435 1.00 0.00 O ATOM 0 H GLU A 81 12.604 1.286 -11.525 1.00 0.00 H new ATOM 0 HA GLU A 81 10.604 2.573 -13.038 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.234 -0.197 -12.142 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.568 0.112 -12.592 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.037 0.621 -14.314 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.826 -0.619 -14.571 1.00 0.00 H new ATOM 1384 N GLY A 82 9.918 1.967 -9.917 1.00 0.00 N ATOM 1385 CA GLY A 82 8.962 2.213 -8.850 1.00 0.00 C ATOM 1386 C GLY A 82 8.548 3.685 -8.813 1.00 0.00 C ATOM 1387 O GLY A 82 7.365 3.999 -8.699 1.00 0.00 O ATOM 0 H GLY A 82 10.821 1.608 -9.606 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.081 1.587 -8.995 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.400 1.931 -7.893 1.00 0.00 H new ATOM 1391 N ILE A 83 9.548 4.550 -8.913 1.00 0.00 N ATOM 1392 CA ILE A 83 9.303 5.982 -8.892 1.00 0.00 C ATOM 1393 C ILE A 83 8.427 6.363 -10.087 1.00 0.00 C ATOM 1394 O ILE A 83 7.684 7.341 -10.030 1.00 0.00 O ATOM 1395 CB ILE A 83 10.624 6.750 -8.828 1.00 0.00 C ATOM 1396 CG1 ILE A 83 11.100 6.904 -7.382 1.00 0.00 C ATOM 1397 CG2 ILE A 83 10.509 8.100 -9.540 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.579 6.534 -7.250 1.00 0.00 C ATOM 0 H ILE A 83 10.529 4.286 -9.009 1.00 0.00 H new ATOM 0 HA ILE A 83 8.754 6.262 -7.993 1.00 0.00 H new ATOM 0 HB ILE A 83 11.381 6.171 -9.356 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.948 7.932 -7.053 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.502 6.268 -6.729 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.462 8.626 -9.480 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.249 7.939 -10.586 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.734 8.699 -9.062 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.892 6.652 -6.213 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.724 5.498 -7.557 1.00 0.00 H new ATOM 0 HD13 ILE A 83 13.176 7.188 -7.886 1.00 0.00 H new ATOM 1410 N GLN A 84 8.543 5.569 -11.142 1.00 0.00 N ATOM 1411 CA GLN A 84 7.771 5.811 -12.349 1.00 0.00 C ATOM 1412 C GLN A 84 6.295 5.487 -12.108 1.00 0.00 C ATOM 1413 O GLN A 84 5.414 6.179 -12.616 1.00 0.00 O ATOM 1414 CB GLN A 84 8.325 5.004 -13.525 1.00 0.00 C ATOM 1415 CG GLN A 84 9.346 5.821 -14.318 1.00 0.00 C ATOM 1416 CD GLN A 84 8.753 7.161 -14.758 1.00 0.00 C ATOM 1417 OE1 GLN A 84 7.713 7.231 -15.391 1.00 0.00 O ATOM 1418 NE2 GLN A 84 9.471 8.218 -14.388 1.00 0.00 N ATOM 0 H GLN A 84 9.160 4.758 -11.186 1.00 0.00 H new ATOM 0 HA GLN A 84 7.854 6.867 -12.605 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.792 4.091 -13.156 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.508 4.702 -14.180 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.232 5.994 -13.707 1.00 0.00 H new ATOM 0 HG3 GLN A 84 9.668 5.257 -15.193 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.333 8.089 -13.859 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.159 9.158 -14.633 1.00 0.00 H new ATOM 1427 N VAL A 85 6.071 4.436 -11.334 1.00 0.00 N ATOM 1428 CA VAL A 85 4.717 4.013 -11.020 1.00 0.00 C ATOM 1429 C VAL A 85 4.029 5.096 -10.188 1.00 0.00 C ATOM 1430 O VAL A 85 2.824 5.311 -10.316 1.00 0.00 O ATOM 1431 CB VAL A 85 4.743 2.650 -10.324 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.535 2.484 -9.400 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.813 1.514 -11.346 1.00 0.00 C ATOM 0 H VAL A 85 6.804 3.864 -10.915 1.00 0.00 H new ATOM 0 HA VAL A 85 4.135 3.886 -11.933 1.00 0.00 H new ATOM 0 HB VAL A 85 5.643 2.603 -9.710 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.577 1.507 -8.918 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.548 3.265 -8.640 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.617 2.561 -9.983 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.830 0.557 -10.825 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.940 1.557 -11.998 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.718 1.618 -11.944 1.00 0.00 H new ATOM 1443 N TYR A 86 4.823 5.750 -9.353 1.00 0.00 N ATOM 1444 CA TYR A 86 4.305 6.806 -8.500 1.00 0.00 C ATOM 1445 C TYR A 86 4.103 8.101 -9.291 1.00 0.00 C ATOM 1446 O TYR A 86 3.433 9.020 -8.823 1.00 0.00 O ATOM 1447 CB TYR A 86 5.368 7.040 -7.425 1.00 0.00 C ATOM 1448 CG TYR A 86 5.950 5.754 -6.835 1.00 0.00 C ATOM 1449 CD1 TYR A 86 5.207 4.590 -6.850 1.00 0.00 C ATOM 1450 CD2 TYR A 86 7.217 5.757 -6.289 1.00 0.00 C ATOM 1451 CE1 TYR A 86 5.754 3.380 -6.294 1.00 0.00 C ATOM 1452 CE2 TYR A 86 7.764 4.546 -5.734 1.00 0.00 C ATOM 1453 CZ TYR A 86 7.006 3.417 -5.764 1.00 0.00 C ATOM 1454 OH TYR A 86 7.523 2.274 -5.240 1.00 0.00 O ATOM 0 H TYR A 86 5.821 5.569 -9.249 1.00 0.00 H new ATOM 0 HA TYR A 86 3.341 6.521 -8.079 1.00 0.00 H new ATOM 0 HB2 TYR A 86 6.178 7.631 -7.852 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.932 7.632 -6.620 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.216 4.587 -7.279 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.798 6.667 -6.278 1.00 0.00 H new ATOM 0 HE1 TYR A 86 5.183 2.463 -6.298 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.754 4.534 -5.303 1.00 0.00 H new ATOM 0 HH TYR A 86 6.805 1.620 -5.109 1.00 0.00 H new ATOM 1464 N ARG A 87 4.695 8.131 -10.476 1.00 0.00 N ATOM 1465 CA ARG A 87 4.589 9.297 -11.336 1.00 0.00 C ATOM 1466 C ARG A 87 3.207 9.350 -11.991 1.00 0.00 C ATOM 1467 O ARG A 87 2.536 10.380 -11.950 1.00 0.00 O ATOM 1468 CB ARG A 87 5.662 9.277 -12.426 1.00 0.00 C ATOM 1469 CG ARG A 87 6.325 10.648 -12.569 1.00 0.00 C ATOM 1470 CD ARG A 87 7.210 10.958 -11.360 1.00 0.00 C ATOM 1471 NE ARG A 87 8.159 12.044 -11.692 1.00 0.00 N ATOM 1472 CZ ARG A 87 9.313 12.256 -11.047 1.00 0.00 C ATOM 1473 NH1 ARG A 87 9.670 11.459 -10.031 1.00 0.00 N ATOM 1474 NH2 ARG A 87 10.112 13.267 -11.417 1.00 0.00 N ATOM 0 H ARG A 87 5.250 7.366 -10.861 1.00 0.00 H new ATOM 0 HA ARG A 87 4.735 10.181 -10.715 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.416 8.528 -12.185 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.215 8.985 -13.376 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.925 10.673 -13.479 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.559 11.417 -12.671 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.591 11.251 -10.512 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.758 10.064 -11.061 1.00 0.00 H new ATOM 0 HE ARG A 87 7.919 12.670 -12.460 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.062 10.690 -9.748 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.549 11.621 -9.540 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.841 13.875 -12.190 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.991 13.428 -10.926 1.00 0.00 H new ATOM 1488 N ARG A 88 2.823 8.226 -12.579 1.00 0.00 N ATOM 1489 CA ARG A 88 1.534 8.131 -13.241 1.00 0.00 C ATOM 1490 C ARG A 88 0.402 8.223 -12.216 1.00 0.00 C ATOM 1491 O ARG A 88 -0.660 8.772 -12.505 1.00 0.00 O ATOM 1492 CB ARG A 88 1.407 6.817 -14.014 1.00 0.00 C ATOM 1493 CG ARG A 88 1.328 5.624 -13.059 1.00 0.00 C ATOM 1494 CD ARG A 88 1.631 4.315 -13.791 1.00 0.00 C ATOM 1495 NE ARG A 88 0.391 3.523 -13.946 1.00 0.00 N ATOM 1496 CZ ARG A 88 0.366 2.202 -14.171 1.00 0.00 C ATOM 1497 NH1 ARG A 88 1.514 1.518 -14.269 1.00 0.00 N ATOM 1498 NH2 ARG A 88 -0.806 1.566 -14.299 1.00 0.00 N ATOM 0 H ARG A 88 3.382 7.374 -12.610 1.00 0.00 H new ATOM 0 HA ARG A 88 1.461 8.961 -13.943 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.516 6.845 -14.641 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.262 6.698 -14.680 1.00 0.00 H new ATOM 0 HG2 ARG A 88 2.036 5.760 -12.242 1.00 0.00 H new ATOM 0 HG3 ARG A 88 0.334 5.575 -12.614 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.061 4.527 -14.770 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.372 3.741 -13.235 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.501 4.013 -13.877 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.406 2.003 -14.172 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.496 0.513 -14.440 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -1.680 2.087 -14.225 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.825 0.561 -14.470 1.00 0.00 H new ATOM 1512 N PHE A 89 0.668 7.676 -11.038 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.315 7.689 -9.968 1.00 0.00 C ATOM 1514 C PHE A 89 -0.207 8.971 -9.140 1.00 0.00 C ATOM 1515 O PHE A 89 -1.187 9.697 -8.981 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.014 6.488 -9.070 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.678 5.188 -9.526 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -1.976 5.193 -9.933 1.00 0.00 C ATOM 1519 CD2 PHE A 89 0.029 4.026 -9.524 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.592 3.986 -10.357 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.587 2.819 -9.947 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.885 2.825 -10.355 1.00 0.00 C ATOM 0 H PHE A 89 1.550 7.221 -10.802 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.321 7.642 -10.386 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.065 6.338 -9.031 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.342 6.715 -8.055 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.538 6.115 -9.934 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.059 4.022 -9.200 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.622 3.990 -10.681 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.026 1.896 -9.945 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.354 1.907 -10.677 1.00 0.00 H new ATOM 1532 N TYR A 90 0.994 9.210 -8.632 1.00 0.00 N ATOM 1533 CA TYR A 90 1.243 10.391 -7.824 1.00 0.00 C ATOM 1534 C TYR A 90 2.256 11.316 -8.503 1.00 0.00 C ATOM 1535 O TYR A 90 2.491 11.209 -9.705 1.00 0.00 O ATOM 1536 CB TYR A 90 1.836 9.884 -6.508 1.00 0.00 C ATOM 1537 CG TYR A 90 1.308 8.515 -6.075 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.043 8.245 -6.139 1.00 0.00 C ATOM 1539 CD2 TYR A 90 2.184 7.551 -5.620 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.540 6.956 -5.731 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.688 6.262 -5.212 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.350 6.028 -5.288 1.00 0.00 C ATOM 1543 OH TYR A 90 -0.118 4.811 -4.903 1.00 0.00 O ATOM 0 H TYR A 90 1.805 8.605 -8.765 1.00 0.00 H new ATOM 0 HA TYR A 90 0.323 10.957 -7.678 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.920 9.829 -6.607 1.00 0.00 H new ATOM 0 HB3 TYR A 90 1.624 10.609 -5.722 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.728 9.000 -6.495 1.00 0.00 H new ATOM 0 HD2 TYR A 90 3.242 7.763 -5.570 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.595 6.732 -5.776 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.363 5.499 -4.854 1.00 0.00 H new ATOM 0 HH TYR A 90 0.631 4.250 -4.611 1.00 0.00 H new ATOM 1553 N ASP A 91 2.828 12.204 -7.702 1.00 0.00 N ATOM 1554 CA ASP A 91 3.810 13.147 -8.210 1.00 0.00 C ATOM 1555 C ASP A 91 4.752 13.556 -7.076 1.00 0.00 C ATOM 1556 O ASP A 91 4.544 13.176 -5.925 1.00 0.00 O ATOM 1557 CB ASP A 91 3.134 14.412 -8.743 1.00 0.00 C ATOM 1558 CG ASP A 91 3.001 14.481 -10.266 1.00 0.00 C ATOM 1559 OD1 ASP A 91 4.057 14.615 -10.922 1.00 0.00 O ATOM 1560 OD2 ASP A 91 1.847 14.399 -10.739 1.00 0.00 O ATOM 0 H ASP A 91 2.630 12.290 -6.705 1.00 0.00 H new ATOM 0 HA ASP A 91 4.357 12.662 -9.019 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.140 14.488 -8.303 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.700 15.279 -8.403 1.00 0.00 H new ATOM 1565 N GLU A 92 5.767 14.325 -7.442 1.00 0.00 N ATOM 1566 CA GLU A 92 6.742 14.790 -6.470 1.00 0.00 C ATOM 1567 C GLU A 92 6.157 15.932 -5.637 1.00 0.00 C ATOM 1568 O GLU A 92 6.446 16.049 -4.447 1.00 0.00 O ATOM 1569 CB GLU A 92 8.039 15.220 -7.157 1.00 0.00 C ATOM 1570 CG GLU A 92 9.066 14.086 -7.150 1.00 0.00 C ATOM 1571 CD GLU A 92 10.242 14.416 -6.229 1.00 0.00 C ATOM 1572 OE1 GLU A 92 11.187 15.067 -6.726 1.00 0.00 O ATOM 1573 OE2 GLU A 92 10.170 14.011 -5.049 1.00 0.00 O ATOM 0 H GLU A 92 5.935 14.638 -8.398 1.00 0.00 H new ATOM 0 HA GLU A 92 6.982 13.964 -5.800 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.829 15.519 -8.184 1.00 0.00 H new ATOM 0 HB3 GLU A 92 8.452 16.092 -6.650 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.590 13.162 -6.821 1.00 0.00 H new ATOM 0 HG3 GLU A 92 9.430 13.914 -8.163 1.00 0.00 H new ATOM 1580 N GLU A 93 5.345 16.747 -6.295 1.00 0.00 N ATOM 1581 CA GLU A 93 4.717 17.876 -5.630 1.00 0.00 C ATOM 1582 C GLU A 93 3.670 17.386 -4.627 1.00 0.00 C ATOM 1583 O GLU A 93 3.722 17.736 -3.449 1.00 0.00 O ATOM 1584 CB GLU A 93 4.096 18.835 -6.647 1.00 0.00 C ATOM 1585 CG GLU A 93 4.583 20.267 -6.418 1.00 0.00 C ATOM 1586 CD GLU A 93 5.712 20.624 -7.387 1.00 0.00 C ATOM 1587 OE1 GLU A 93 5.622 20.180 -8.552 1.00 0.00 O ATOM 1588 OE2 GLU A 93 6.640 21.333 -6.941 1.00 0.00 O ATOM 0 H GLU A 93 5.108 16.648 -7.282 1.00 0.00 H new ATOM 0 HA GLU A 93 5.485 18.425 -5.085 1.00 0.00 H new ATOM 0 HB2 GLU A 93 4.354 18.517 -7.657 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.009 18.800 -6.569 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.754 20.962 -6.548 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.932 20.376 -5.391 1.00 0.00 H new ATOM 1595 N LYS A 94 2.743 16.585 -5.132 1.00 0.00 N ATOM 1596 CA LYS A 94 1.686 16.044 -4.296 1.00 0.00 C ATOM 1597 C LYS A 94 2.307 15.325 -3.096 1.00 0.00 C ATOM 1598 O LYS A 94 1.889 15.535 -1.958 1.00 0.00 O ATOM 1599 CB LYS A 94 0.747 15.162 -5.122 1.00 0.00 C ATOM 1600 CG LYS A 94 -0.649 15.780 -5.211 1.00 0.00 C ATOM 1601 CD LYS A 94 -1.637 15.036 -4.311 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.050 15.602 -4.461 1.00 0.00 C ATOM 1603 NZ LYS A 94 -3.787 15.503 -3.181 1.00 0.00 N ATOM 0 H LYS A 94 2.702 16.298 -6.110 1.00 0.00 H new ATOM 0 HA LYS A 94 1.065 16.848 -3.900 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.155 15.030 -6.124 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.682 14.172 -4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.605 16.829 -4.919 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.998 15.750 -6.243 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.638 13.976 -4.564 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.318 15.115 -3.272 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.999 16.644 -4.778 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.585 15.058 -5.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.744 15.892 -3.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.852 14.506 -2.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.284 16.042 -2.448 1.00 0.00 H new ATOM 1617 N GLU A 95 3.294 14.493 -3.392 1.00 0.00 N ATOM 1618 CA GLU A 95 3.977 13.743 -2.352 1.00 0.00 C ATOM 1619 C GLU A 95 4.737 14.692 -1.423 1.00 0.00 C ATOM 1620 O GLU A 95 4.590 14.624 -0.204 1.00 0.00 O ATOM 1621 CB GLU A 95 4.918 12.698 -2.957 1.00 0.00 C ATOM 1622 CG GLU A 95 5.063 11.489 -2.031 1.00 0.00 C ATOM 1623 CD GLU A 95 5.450 10.237 -2.820 1.00 0.00 C ATOM 1624 OE1 GLU A 95 4.543 9.675 -3.472 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.643 9.870 -2.755 1.00 0.00 O ATOM 0 H GLU A 95 3.637 14.322 -4.337 1.00 0.00 H new ATOM 0 HA GLU A 95 3.228 13.213 -1.763 1.00 0.00 H new ATOM 0 HB2 GLU A 95 4.535 12.375 -3.925 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.897 13.144 -3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.820 11.695 -1.274 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.125 11.315 -1.504 1.00 0.00 H new ATOM 1632 N LYS A 96 5.533 15.557 -2.036 1.00 0.00 N ATOM 1633 CA LYS A 96 6.316 16.519 -1.280 1.00 0.00 C ATOM 1634 C LYS A 96 5.380 17.359 -0.408 1.00 0.00 C ATOM 1635 O LYS A 96 5.820 17.992 0.550 1.00 0.00 O ATOM 1636 CB LYS A 96 7.194 17.350 -2.217 1.00 0.00 C ATOM 1637 CG LYS A 96 8.358 16.518 -2.759 1.00 0.00 C ATOM 1638 CD LYS A 96 9.621 16.733 -1.922 1.00 0.00 C ATOM 1639 CE LYS A 96 10.312 18.045 -2.297 1.00 0.00 C ATOM 1640 NZ LYS A 96 10.195 19.026 -1.195 1.00 0.00 N ATOM 0 H LYS A 96 5.652 15.611 -3.048 1.00 0.00 H new ATOM 0 HA LYS A 96 7.004 16.006 -0.608 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.594 17.726 -3.046 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.580 18.219 -1.684 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.089 15.462 -2.753 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.553 16.791 -3.796 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.362 16.744 -0.863 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.308 15.900 -2.073 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.363 17.859 -2.516 1.00 0.00 H new ATOM 0 HE3 LYS A 96 9.864 18.452 -3.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.098 19.983 -1.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.358 18.803 -0.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.047 18.983 -0.600 1.00 0.00 H new ATOM 1654 N LYS A 97 4.106 17.337 -0.772 1.00 0.00 N ATOM 1655 CA LYS A 97 3.104 18.089 -0.035 1.00 0.00 C ATOM 1656 C LYS A 97 2.848 17.407 1.310 1.00 0.00 C ATOM 1657 O LYS A 97 3.057 18.006 2.364 1.00 0.00 O ATOM 1658 CB LYS A 97 1.843 18.273 -0.882 1.00 0.00 C ATOM 1659 CG LYS A 97 1.290 19.693 -0.740 1.00 0.00 C ATOM 1660 CD LYS A 97 0.265 19.993 -1.835 1.00 0.00 C ATOM 1661 CE LYS A 97 0.951 20.506 -3.103 1.00 0.00 C ATOM 1662 NZ LYS A 97 0.263 21.714 -3.612 1.00 0.00 N ATOM 0 H LYS A 97 3.745 16.810 -1.567 1.00 0.00 H new ATOM 0 HA LYS A 97 3.464 19.095 0.181 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.071 18.070 -1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.086 17.552 -0.575 1.00 0.00 H new ATOM 0 HG2 LYS A 97 0.826 19.810 0.239 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.107 20.413 -0.794 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.302 19.091 -2.064 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.448 20.736 -1.477 1.00 0.00 H new ATOM 0 HE2 LYS A 97 1.995 20.737 -2.891 1.00 0.00 H new ATOM 0 HE3 LYS A 97 0.946 19.728 -3.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 0.741 22.049 -4.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -0.726 21.483 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.290 22.460 -2.888 1.00 0.00 H new ATOM 1676 N TYR A 98 2.399 16.163 1.230 1.00 0.00 N ATOM 1677 CA TYR A 98 2.112 15.392 2.428 1.00 0.00 C ATOM 1678 C TYR A 98 3.232 14.392 2.718 1.00 0.00 C ATOM 1679 O TYR A 98 3.805 14.393 3.807 1.00 0.00 O ATOM 1680 CB TYR A 98 0.821 14.625 2.137 1.00 0.00 C ATOM 1681 CG TYR A 98 -0.396 15.521 1.901 1.00 0.00 C ATOM 1682 CD1 TYR A 98 -1.157 15.947 2.971 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.734 15.903 0.619 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -2.303 16.791 2.749 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.880 16.746 0.397 1.00 0.00 C ATOM 1686 CZ TYR A 98 -2.607 17.149 1.473 1.00 0.00 C ATOM 1687 OH TYR A 98 -3.689 17.945 1.263 1.00 0.00 O ATOM 0 H TYR A 98 2.227 15.670 0.354 1.00 0.00 H new ATOM 0 HA TYR A 98 2.022 16.048 3.294 1.00 0.00 H new ATOM 0 HB2 TYR A 98 0.973 13.998 1.259 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.611 13.957 2.973 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -0.893 15.648 3.975 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.139 15.570 -0.218 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -2.907 17.132 3.577 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.156 17.051 -0.602 1.00 0.00 H new ATOM 0 HH TYR A 98 -3.785 18.121 0.304 1.00 0.00 H new ATOM 1697 N GLY A 99 3.512 13.561 1.725 1.00 0.00 N ATOM 1698 CA GLY A 99 4.553 12.556 1.859 1.00 0.00 C ATOM 1699 C GLY A 99 3.993 11.151 1.632 1.00 0.00 C ATOM 1700 O GLY A 99 2.803 10.989 1.362 1.00 0.00 O ATOM 0 H GLY A 99 3.035 13.563 0.823 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.349 12.754 1.141 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.997 12.618 2.852 1.00 0.00 H new ATOM 1704 N VAL A 100 4.876 10.170 1.749 1.00 0.00 N ATOM 1705 CA VAL A 100 4.484 8.784 1.560 1.00 0.00 C ATOM 1706 C VAL A 100 4.253 8.133 2.925 1.00 0.00 C ATOM 1707 O VAL A 100 5.151 8.107 3.764 1.00 0.00 O ATOM 1708 CB VAL A 100 5.533 8.054 0.719 1.00 0.00 C ATOM 1709 CG1 VAL A 100 4.875 7.043 -0.223 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.399 9.046 -0.060 1.00 0.00 C ATOM 0 H VAL A 100 5.862 10.308 1.972 1.00 0.00 H new ATOM 0 HA VAL A 100 3.546 8.724 1.009 1.00 0.00 H new ATOM 0 HB VAL A 100 6.183 7.504 1.399 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.643 6.538 -0.809 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.322 6.307 0.361 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.190 7.562 -0.893 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.136 8.501 -0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.768 9.636 -0.724 1.00 0.00 H new ATOM 0 HG23 VAL A 100 6.911 9.709 0.638 1.00 0.00 H new ATOM 1720 N VAL A 101 3.043 7.623 3.104 1.00 0.00 N ATOM 1721 CA VAL A 101 2.683 6.973 4.353 1.00 0.00 C ATOM 1722 C VAL A 101 2.653 5.458 4.145 1.00 0.00 C ATOM 1723 O VAL A 101 1.746 4.933 3.501 1.00 0.00 O ATOM 1724 CB VAL A 101 1.355 7.531 4.869 1.00 0.00 C ATOM 1725 CG1 VAL A 101 0.198 7.129 3.952 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.095 7.085 6.309 1.00 0.00 C ATOM 0 H VAL A 101 2.300 7.647 2.406 1.00 0.00 H new ATOM 0 HA VAL A 101 3.429 7.181 5.120 1.00 0.00 H new ATOM 0 HB VAL A 101 1.424 8.619 4.863 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.734 7.538 4.341 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.375 7.520 2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.127 6.042 3.910 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.145 7.495 6.651 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.056 5.997 6.351 1.00 0.00 H new ATOM 0 HG23 VAL A 101 1.898 7.445 6.952 1.00 0.00 H new ATOM 1736 N ALA A 102 3.658 4.796 4.702 1.00 0.00 N ATOM 1737 CA ALA A 102 3.758 3.352 4.585 1.00 0.00 C ATOM 1738 C ALA A 102 2.895 2.696 5.665 1.00 0.00 C ATOM 1739 O ALA A 102 3.318 2.572 6.813 1.00 0.00 O ATOM 1740 CB ALA A 102 5.227 2.933 4.679 1.00 0.00 C ATOM 0 H ALA A 102 4.409 5.234 5.235 1.00 0.00 H new ATOM 0 HA ALA A 102 3.385 3.019 3.617 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.303 1.849 4.591 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.792 3.403 3.873 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.635 3.249 5.639 1.00 0.00 H new ATOM 1746 N ILE A 103 1.700 2.293 5.258 1.00 0.00 N ATOM 1747 CA ILE A 103 0.773 1.653 6.176 1.00 0.00 C ATOM 1748 C ILE A 103 0.884 0.134 6.029 1.00 0.00 C ATOM 1749 O ILE A 103 0.914 -0.385 4.915 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.644 2.189 5.967 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -1.107 1.969 4.525 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.742 3.659 6.382 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -1.032 3.269 3.721 1.00 0.00 C ATOM 0 H ILE A 103 1.352 2.397 4.305 1.00 0.00 H new ATOM 0 HA ILE A 103 1.031 1.894 7.207 1.00 0.00 H new ATOM 0 HB ILE A 103 -1.319 1.627 6.612 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.486 1.208 4.052 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.130 1.593 4.521 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.760 4.015 6.223 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.484 3.757 7.436 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.052 4.253 5.782 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -1.366 3.085 2.700 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -1.673 4.020 4.183 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -0.003 3.629 3.707 1.00 0.00 H new ATOM 1765 N GLU A 104 0.941 -0.536 7.171 1.00 0.00 N ATOM 1766 CA GLU A 104 1.048 -1.985 7.184 1.00 0.00 C ATOM 1767 C GLU A 104 -0.339 -2.620 7.065 1.00 0.00 C ATOM 1768 O GLU A 104 -1.115 -2.607 8.019 1.00 0.00 O ATOM 1769 CB GLU A 104 1.767 -2.470 8.444 1.00 0.00 C ATOM 1770 CG GLU A 104 2.606 -3.716 8.150 1.00 0.00 C ATOM 1771 CD GLU A 104 3.888 -3.724 8.986 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.349 -2.613 9.327 1.00 0.00 O ATOM 1773 OE2 GLU A 104 4.377 -4.840 9.265 1.00 0.00 O ATOM 0 H GLU A 104 0.915 -0.102 8.094 1.00 0.00 H new ATOM 0 HA GLU A 104 1.643 -2.294 6.325 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.409 -1.677 8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.036 -2.694 9.221 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.022 -4.611 8.365 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.859 -3.747 7.090 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.608 -3.161 5.886 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.887 -3.800 5.630 1.00 0.00 C ATOM 1782 C ILE A 105 -1.763 -5.303 5.889 1.00 0.00 C ATOM 1783 O ILE A 105 -0.734 -5.905 5.587 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.385 -3.458 4.224 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -1.368 -3.883 3.163 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.742 -1.974 4.115 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -1.285 -5.407 3.062 1.00 0.00 C ATOM 0 H ILE A 105 0.039 -3.170 5.097 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.646 -3.420 6.314 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.298 -4.023 4.038 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.650 -3.466 2.196 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.387 -3.478 3.411 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -3.093 -1.757 3.106 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.528 -1.735 4.832 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.860 -1.371 4.329 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.555 -5.682 2.301 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.979 -5.819 4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.262 -5.807 2.790 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.825 -5.865 6.446 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.848 -7.285 6.750 1.00 0.00 C ATOM 1801 C GLU A 106 -4.159 -7.910 6.269 1.00 0.00 C ATOM 1802 O GLU A 106 -5.185 -7.801 6.938 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.641 -7.530 8.246 1.00 0.00 C ATOM 1804 CG GLU A 106 -1.229 -7.127 8.677 1.00 0.00 C ATOM 1805 CD GLU A 106 -0.210 -8.200 8.290 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -0.547 -9.392 8.465 1.00 0.00 O ATOM 1807 OE2 GLU A 106 0.882 -7.806 7.828 1.00 0.00 O ATOM 0 H GLU A 106 -3.677 -5.362 6.695 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.024 -7.763 6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -3.375 -6.961 8.816 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -2.808 -8.583 8.472 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.959 -6.179 8.211 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -1.205 -6.970 9.755 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.080 -8.569 5.081 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.248 -9.211 4.502 1.00 0.00 C ATOM 1816 C PRO A 107 -5.581 -10.509 5.240 1.00 0.00 C ATOM 1817 O PRO A 107 -4.868 -11.503 5.108 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.892 -9.432 3.042 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.377 -9.332 2.962 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.882 -8.718 4.261 1.00 0.00 C ATOM 0 HA PRO A 107 -6.149 -8.604 4.590 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.238 -10.407 2.699 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.367 -8.684 2.407 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.937 -10.318 2.813 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.079 -8.718 2.112 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.147 -9.359 4.747 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.400 -7.756 4.086 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.666 -10.459 5.999 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.102 -11.619 6.758 1.00 0.00 C ATOM 1830 C LEU A 108 -7.665 -12.669 5.797 1.00 0.00 C ATOM 1831 O LEU A 108 -8.874 -12.894 5.757 1.00 0.00 O ATOM 1832 CB LEU A 108 -8.082 -11.203 7.857 1.00 0.00 C ATOM 1833 CG LEU A 108 -7.883 -9.802 8.438 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.017 -8.866 8.014 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.723 -9.856 9.958 1.00 0.00 C ATOM 0 H LEU A 108 -7.256 -9.634 6.105 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.258 -12.077 7.273 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -9.094 -11.269 7.458 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -8.013 -11.925 8.670 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.958 -9.392 8.031 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.851 -7.877 8.441 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -9.041 -8.793 6.927 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.968 -9.261 8.372 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.583 -8.847 10.345 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.616 -10.295 10.403 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.855 -10.465 10.211 1.00 0.00 H new ATOM 1847 N GLU A 109 -6.762 -13.283 5.047 1.00 0.00 N ATOM 1848 CA GLU A 109 -7.153 -14.304 4.090 1.00 0.00 C ATOM 1849 C GLU A 109 -6.035 -15.334 3.925 1.00 0.00 C ATOM 1850 O GLU A 109 -5.989 -16.052 2.927 1.00 0.00 O ATOM 1851 CB GLU A 109 -7.526 -13.679 2.744 1.00 0.00 C ATOM 1852 CG GLU A 109 -8.884 -14.189 2.259 1.00 0.00 C ATOM 1853 CD GLU A 109 -9.928 -13.070 2.277 1.00 0.00 C ATOM 1854 OE1 GLU A 109 -9.670 -12.043 1.614 1.00 0.00 O ATOM 1855 OE2 GLU A 109 -10.961 -13.269 2.953 1.00 0.00 O ATOM 0 H GLU A 109 -5.760 -13.093 5.083 1.00 0.00 H new ATOM 0 HA GLU A 109 -8.036 -14.815 4.474 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -7.554 -12.593 2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.760 -13.915 2.005 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -8.788 -14.585 1.248 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.216 -15.011 2.893 1.00 0.00 H new ATOM 1862 N TYR A 110 -5.160 -15.374 4.919 1.00 0.00 N ATOM 1863 CA TYR A 110 -4.044 -16.305 4.897 1.00 0.00 C ATOM 1864 C TYR A 110 -4.448 -17.630 4.247 1.00 0.00 C ATOM 1865 O TYR A 110 -5.321 -18.333 4.753 1.00 0.00 O ATOM 1866 CB TYR A 110 -3.678 -16.559 6.360 1.00 0.00 C ATOM 1867 CG TYR A 110 -4.886 -16.731 7.283 1.00 0.00 C ATOM 1868 CD1 TYR A 110 -5.460 -15.627 7.881 1.00 0.00 C ATOM 1869 CD2 TYR A 110 -5.402 -17.989 7.519 1.00 0.00 C ATOM 1870 CE1 TYR A 110 -6.597 -15.788 8.749 1.00 0.00 C ATOM 1871 CE2 TYR A 110 -6.539 -18.150 8.388 1.00 0.00 C ATOM 1872 CZ TYR A 110 -7.080 -17.041 8.960 1.00 0.00 C ATOM 1873 OH TYR A 110 -8.154 -17.194 9.781 1.00 0.00 O ATOM 0 H TYR A 110 -5.201 -14.777 5.745 1.00 0.00 H new ATOM 0 HA TYR A 110 -3.213 -15.894 4.323 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -3.059 -17.454 6.419 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -3.073 -15.728 6.722 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -5.056 -14.642 7.698 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -4.953 -18.853 7.052 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -7.056 -14.932 9.222 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -6.953 -19.129 8.581 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.390 -18.144 9.838 1.00 0.00 H new TER 1883 TYR A 110