USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1123 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 130 HIS : no HD1:sc= -0.307 X(o=-0.41,f=-0.21) USER MOD Set 1.2: A 139 HIS : no HD1:sc= -0.103 X(o=-0.41,f=-0.19) USER MOD Set 2.1: A 89 GLN : amide:sc= 0.149 K(o=0.53,f=-1.2) USER MOD Set 2.2: A 117 THR OG1 : rot 180:sc= 0.231 USER MOD Set 2.3: A 119 THR OG1 : rot 150:sc= 0.146 USER MOD Set 3.1: A 91 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 116 THR OG1 : rot 116:sc= -0.0992 USER MOD Single : A 1 MET CE :methyl 165:sc= -0.0558 (180deg=-0.653) USER MOD Single : A 1 MET N :NH3+ 153:sc= 1.97 (180deg=0.63) USER MOD Single : A 3 HIS : no HE2:sc= 1.13 K(o=1.1,f=-9!) USER MOD Single : A 7 TYR OH : rot 30:sc= -0.237 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0657 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= -0.591 K(o=-0.59,f=-5.9!) USER MOD Single : A 16 ASN : amide:sc= -0.0535 X(o=-0.054,f=0.2) USER MOD Single : A 17 HIS : no HD1:sc= -0.269 X(o=-0.27,f=0.0072) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 156:sc= -0.0341 (180deg=-0.554) USER MOD Single : A 23 HIS : no HE2:sc= -0.267 X(o=-0.27,f=-0.027) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.201 X(o=-0.2,f=-0.013) USER MOD Single : A 35 CYS SG : rot 4:sc= -0.755 USER MOD Single : A 36 THR OG1 : rot -59:sc= 1.02 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0499 USER MOD Single : A 48 HIS : no HE2:sc= 0.671 K(o=0.67,f=-2.2!) USER MOD Single : A 49 ASN : amide:sc= -0.141 K(o=-0.14,f=-1.8) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 62 CYS SG : rot 180:sc= -0.0127 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.488 X(o=-0.49,f=-0.49) USER MOD Single : A 74 MET CE :methyl 168:sc= -0.327 (180deg=-0.848) USER MOD Single : A 84 CYS SG : rot 2:sc= -0.307 USER MOD Single : A 86 SER OG : rot 180:sc= 0.00594 USER MOD Single : A 87 MET CE :methyl 172:sc= -0.15 (180deg=-0.305) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.816 K(o=-0.82,f=-0.011) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.606 K(o=-0.61,f=-0.11) USER MOD Single : A 112 CYS SG : rot 180:sc= -3.04! USER MOD Single : A 115 TYR OH : rot 80:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.29 K(o=0.29,f=-1.1) USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=-0.0071) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.815 -4.772 5.938 1.00 0.00 N ATOM 2 CA MET A 1 -15.869 -4.515 7.389 1.00 0.00 C ATOM 3 C MET A 1 -14.841 -3.476 7.808 1.00 0.00 C ATOM 4 O MET A 1 -15.172 -2.636 8.638 1.00 0.00 O ATOM 5 CB MET A 1 -15.760 -5.787 8.255 1.00 0.00 C ATOM 6 CG MET A 1 -17.123 -6.240 8.796 1.00 0.00 C ATOM 7 SD MET A 1 -17.510 -5.818 10.522 1.00 0.00 S ATOM 8 CE MET A 1 -17.045 -4.071 10.598 1.00 0.00 C ATOM 0 H1 MET A 1 -16.151 -5.737 5.744 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.421 -4.088 5.441 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.835 -4.673 5.604 1.00 0.00 H new ATOM 0 HA MET A 1 -16.865 -4.114 7.576 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.321 -6.590 7.664 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.084 -5.599 9.089 1.00 0.00 H new ATOM 0 HG2 MET A 1 -17.898 -5.812 8.161 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.186 -7.323 8.690 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.469 -3.620 11.496 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.959 -3.985 10.627 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.427 -3.554 9.718 1.00 0.00 H new ATOM 18 N ALA A 2 -13.611 -3.514 7.290 1.00 0.00 N ATOM 19 CA ALA A 2 -12.602 -2.511 7.583 1.00 0.00 C ATOM 20 C ALA A 2 -11.980 -2.132 6.251 1.00 0.00 C ATOM 21 O ALA A 2 -11.070 -2.803 5.794 1.00 0.00 O ATOM 22 CB ALA A 2 -11.576 -3.061 8.578 1.00 0.00 C ATOM 0 H ALA A 2 -13.293 -4.246 6.655 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.028 -1.627 8.058 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -10.827 -2.298 8.787 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.080 -3.339 9.504 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.090 -3.939 8.152 1.00 0.00 H new ATOM 28 N HIS A 3 -12.522 -1.115 5.588 1.00 0.00 N ATOM 29 CA HIS A 3 -12.056 -0.644 4.291 1.00 0.00 C ATOM 30 C HIS A 3 -10.583 -0.226 4.417 1.00 0.00 C ATOM 31 O HIS A 3 -10.203 0.411 5.414 1.00 0.00 O ATOM 32 CB HIS A 3 -12.877 0.585 3.898 1.00 0.00 C ATOM 33 CG HIS A 3 -14.286 0.299 3.464 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.423 0.863 3.999 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.650 -0.404 2.349 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.462 0.471 3.246 1.00 0.00 C ATOM 37 NE2 HIS A 3 -16.045 -0.355 2.269 1.00 0.00 N ATOM 0 H HIS A 3 -13.316 -0.584 5.947 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.163 -1.430 3.543 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -12.907 1.269 4.746 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.362 1.103 3.089 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -15.467 1.469 4.819 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -13.985 -0.903 1.660 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.487 0.775 3.402 1.00 0.00 H new ATOM 45 N ILE A 4 -9.766 -0.540 3.409 1.00 0.00 N ATOM 46 CA ILE A 4 -8.361 -0.142 3.321 1.00 0.00 C ATOM 47 C ILE A 4 -8.065 0.370 1.909 1.00 0.00 C ATOM 48 O ILE A 4 -8.777 0.024 0.959 1.00 0.00 O ATOM 49 CB ILE A 4 -7.417 -1.305 3.688 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.511 -2.476 2.682 1.00 0.00 C ATOM 51 CG2 ILE A 4 -7.692 -1.752 5.132 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.394 -3.511 2.831 1.00 0.00 C ATOM 0 H ILE A 4 -10.073 -1.094 2.609 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.182 0.656 4.041 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.388 -0.950 3.626 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.473 -2.973 2.807 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.489 -2.075 1.669 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.025 -2.574 5.392 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.520 -0.917 5.811 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.727 -2.083 5.220 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.528 -4.300 2.091 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.429 -3.029 2.676 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.428 -3.942 3.832 1.00 0.00 H new ATOM 64 N PHE A 5 -6.992 1.140 1.748 1.00 0.00 N ATOM 65 CA PHE A 5 -6.412 1.382 0.435 1.00 0.00 C ATOM 66 C PHE A 5 -5.413 0.237 0.215 1.00 0.00 C ATOM 67 O PHE A 5 -4.710 -0.155 1.157 1.00 0.00 O ATOM 68 CB PHE A 5 -5.773 2.785 0.437 1.00 0.00 C ATOM 69 CG PHE A 5 -5.455 3.418 -0.912 1.00 0.00 C ATOM 70 CD1 PHE A 5 -6.432 3.487 -1.924 1.00 0.00 C ATOM 71 CD2 PHE A 5 -4.189 3.991 -1.147 1.00 0.00 C ATOM 72 CE1 PHE A 5 -6.131 4.079 -3.165 1.00 0.00 C ATOM 73 CE2 PHE A 5 -3.882 4.566 -2.395 1.00 0.00 C ATOM 74 CZ PHE A 5 -4.855 4.620 -3.406 1.00 0.00 C ATOM 0 H PHE A 5 -6.507 1.607 2.514 1.00 0.00 H new ATOM 0 HA PHE A 5 -7.131 1.384 -0.384 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -6.441 3.458 0.974 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.847 2.731 1.009 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -7.418 3.083 -1.747 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -3.447 3.989 -0.362 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.885 4.118 -3.937 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -2.895 4.967 -2.575 1.00 0.00 H new ATOM 0 HZ PHE A 5 -4.626 5.073 -4.359 1.00 0.00 H new ATOM 84 N VAL A 6 -5.354 -0.331 -0.992 1.00 0.00 N ATOM 85 CA VAL A 6 -4.144 -1.034 -1.427 1.00 0.00 C ATOM 86 C VAL A 6 -3.073 0.024 -1.702 1.00 0.00 C ATOM 87 O VAL A 6 -3.312 1.218 -1.538 1.00 0.00 O ATOM 88 CB VAL A 6 -4.392 -1.902 -2.677 1.00 0.00 C ATOM 89 CG1 VAL A 6 -5.110 -3.207 -2.355 1.00 0.00 C ATOM 90 CG2 VAL A 6 -5.170 -1.178 -3.771 1.00 0.00 C ATOM 0 H VAL A 6 -6.113 -0.320 -1.673 1.00 0.00 H new ATOM 0 HA VAL A 6 -3.820 -1.720 -0.644 1.00 0.00 H new ATOM 0 HB VAL A 6 -3.391 -2.123 -3.049 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -5.258 -3.777 -3.272 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -4.509 -3.791 -1.658 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -6.078 -2.988 -1.904 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -5.309 -1.846 -4.621 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -6.143 -0.874 -3.385 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -4.614 -0.296 -4.090 1.00 0.00 H new ATOM 100 N TYR A 7 -1.895 -0.383 -2.166 1.00 0.00 N ATOM 101 CA TYR A 7 -0.853 0.558 -2.517 1.00 0.00 C ATOM 102 C TYR A 7 -0.249 0.222 -3.867 1.00 0.00 C ATOM 103 O TYR A 7 -0.374 1.022 -4.796 1.00 0.00 O ATOM 104 CB TYR A 7 0.150 0.668 -1.363 1.00 0.00 C ATOM 105 CG TYR A 7 0.568 2.100 -1.150 1.00 0.00 C ATOM 106 CD1 TYR A 7 -0.415 3.075 -0.889 1.00 0.00 C ATOM 107 CD2 TYR A 7 1.912 2.471 -1.289 1.00 0.00 C ATOM 108 CE1 TYR A 7 -0.078 4.434 -0.857 1.00 0.00 C ATOM 109 CE2 TYR A 7 2.259 3.826 -1.236 1.00 0.00 C ATOM 110 CZ TYR A 7 1.265 4.814 -1.053 1.00 0.00 C ATOM 111 OH TYR A 7 1.599 6.128 -1.074 1.00 0.00 O ATOM 0 H TYR A 7 -1.644 -1.362 -2.305 1.00 0.00 H new ATOM 0 HA TYR A 7 -1.268 1.557 -2.648 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -0.296 0.275 -0.449 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.027 0.057 -1.578 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -1.436 2.772 -0.712 1.00 0.00 H new ATOM 0 HD2 TYR A 7 2.673 1.719 -1.436 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.838 5.182 -0.684 1.00 0.00 H new ATOM 0 HE2 TYR A 7 3.294 4.119 -1.336 1.00 0.00 H new ATOM 0 HH TYR A 7 0.983 6.631 -0.502 1.00 0.00 H new ATOM 121 N GLY A 8 0.291 -0.981 -4.042 1.00 0.00 N ATOM 122 CA GLY A 8 0.888 -1.363 -5.312 1.00 0.00 C ATOM 123 C GLY A 8 1.120 -2.856 -5.400 1.00 0.00 C ATOM 124 O GLY A 8 0.842 -3.462 -6.436 1.00 0.00 O ATOM 0 H GLY A 8 0.326 -1.703 -3.322 1.00 0.00 H new ATOM 0 HA2 GLY A 8 0.238 -1.048 -6.128 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.836 -0.840 -5.439 1.00 0.00 H new ATOM 128 N THR A 9 1.600 -3.468 -4.321 1.00 0.00 N ATOM 129 CA THR A 9 1.857 -4.895 -4.217 1.00 0.00 C ATOM 130 C THR A 9 0.623 -5.722 -4.590 1.00 0.00 C ATOM 131 O THR A 9 0.791 -6.810 -5.144 1.00 0.00 O ATOM 132 CB THR A 9 2.383 -5.193 -2.794 1.00 0.00 C ATOM 133 OG1 THR A 9 1.736 -4.357 -1.861 1.00 0.00 O ATOM 134 CG2 THR A 9 3.877 -4.890 -2.683 1.00 0.00 C ATOM 0 H THR A 9 1.828 -2.962 -3.465 1.00 0.00 H new ATOM 0 HA THR A 9 2.620 -5.191 -4.937 1.00 0.00 H new ATOM 0 HB THR A 9 2.192 -6.247 -2.595 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.071 -4.551 -0.961 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.219 -5.109 -1.671 1.00 0.00 H new ATOM 0 HG22 THR A 9 4.427 -5.507 -3.393 1.00 0.00 H new ATOM 0 HG23 THR A 9 4.052 -3.837 -2.905 1.00 0.00 H new ATOM 142 N LEU A 10 -0.594 -5.209 -4.381 1.00 0.00 N ATOM 143 CA LEU A 10 -1.841 -5.871 -4.739 1.00 0.00 C ATOM 144 C LEU A 10 -2.736 -4.865 -5.452 1.00 0.00 C ATOM 145 O LEU A 10 -3.640 -4.298 -4.858 1.00 0.00 O ATOM 146 CB LEU A 10 -2.556 -6.448 -3.508 1.00 0.00 C ATOM 147 CG LEU A 10 -1.694 -7.330 -2.594 1.00 0.00 C ATOM 148 CD1 LEU A 10 -1.049 -6.529 -1.462 1.00 0.00 C ATOM 149 CD2 LEU A 10 -2.604 -8.351 -1.947 1.00 0.00 C ATOM 0 H LEU A 10 -0.737 -4.297 -3.946 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.617 -6.711 -5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.950 -5.621 -2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.411 -7.033 -3.847 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.908 -7.779 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.449 -7.195 -0.841 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.411 -5.752 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.827 -6.068 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.019 -8.995 -1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.370 -7.839 -1.365 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.079 -8.956 -2.719 1.00 0.00 H new ATOM 161 N LYS A 11 -2.463 -4.572 -6.720 1.00 0.00 N ATOM 162 CA LYS A 11 -3.353 -3.748 -7.530 1.00 0.00 C ATOM 163 C LYS A 11 -3.242 -4.184 -8.980 1.00 0.00 C ATOM 164 O LYS A 11 -4.063 -4.984 -9.412 1.00 0.00 O ATOM 165 CB LYS A 11 -3.088 -2.263 -7.233 1.00 0.00 C ATOM 166 CG LYS A 11 -3.854 -1.287 -8.156 1.00 0.00 C ATOM 167 CD LYS A 11 -2.920 -0.367 -8.965 1.00 0.00 C ATOM 168 CE LYS A 11 -3.687 0.392 -10.055 1.00 0.00 C ATOM 169 NZ LYS A 11 -2.827 1.303 -10.835 1.00 0.00 N ATOM 0 H LYS A 11 -1.629 -4.895 -7.210 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.404 -3.888 -7.276 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -3.361 -2.056 -6.198 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.019 -2.070 -7.326 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.477 -1.859 -8.844 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.524 -0.675 -7.552 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -2.438 0.345 -8.295 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.128 -0.961 -9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.154 -0.325 -10.730 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.491 0.966 -9.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.399 1.788 -11.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -2.401 2.007 -10.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.074 0.756 -11.300 1.00 0.00 H new ATOM 183 N ARG A 12 -2.205 -3.747 -9.699 1.00 0.00 N ATOM 184 CA ARG A 12 -2.020 -4.059 -11.109 1.00 0.00 C ATOM 185 C ARG A 12 -1.732 -5.553 -11.293 1.00 0.00 C ATOM 186 O ARG A 12 -2.667 -6.317 -11.489 1.00 0.00 O ATOM 187 CB ARG A 12 -0.985 -3.081 -11.683 1.00 0.00 C ATOM 188 CG ARG A 12 -0.702 -3.286 -13.168 1.00 0.00 C ATOM 189 CD ARG A 12 0.384 -2.311 -13.651 1.00 0.00 C ATOM 190 NE ARG A 12 1.010 -2.764 -14.904 1.00 0.00 N ATOM 191 CZ ARG A 12 0.892 -2.235 -16.125 1.00 0.00 C ATOM 192 NH1 ARG A 12 0.180 -1.137 -16.360 1.00 0.00 N ATOM 193 NH2 ARG A 12 1.460 -2.853 -17.145 1.00 0.00 N ATOM 0 H ARG A 12 -1.466 -3.161 -9.310 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.927 -3.907 -11.694 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -1.337 -2.061 -11.527 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.053 -3.185 -11.127 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.381 -4.313 -13.344 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.616 -3.135 -13.742 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -0.054 -1.324 -13.800 1.00 0.00 H new ATOM 0 HD3 ARG A 12 1.148 -2.207 -12.880 1.00 0.00 H new ATOM 0 HE ARG A 12 1.610 -3.586 -14.831 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.301 -0.667 -15.593 1.00 0.00 H new ATOM 0 HH12 ARG A 12 0.115 -0.765 -17.307 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.978 -3.719 -16.993 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.381 -2.465 -18.085 1.00 0.00 H new ATOM 207 N GLY A 13 -0.480 -6.004 -11.175 1.00 0.00 N ATOM 208 CA GLY A 13 -0.147 -7.404 -11.439 1.00 0.00 C ATOM 209 C GLY A 13 1.146 -7.844 -10.773 1.00 0.00 C ATOM 210 O GLY A 13 1.815 -8.769 -11.229 1.00 0.00 O ATOM 0 H GLY A 13 0.313 -5.424 -10.901 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.963 -8.037 -11.090 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -0.064 -7.555 -12.515 1.00 0.00 H new ATOM 214 N GLN A 14 1.490 -7.167 -9.677 1.00 0.00 N ATOM 215 CA GLN A 14 2.628 -7.463 -8.831 1.00 0.00 C ATOM 216 C GLN A 14 2.598 -8.920 -8.339 1.00 0.00 C ATOM 217 O GLN A 14 1.522 -9.529 -8.307 1.00 0.00 O ATOM 218 CB GLN A 14 2.543 -6.486 -7.656 1.00 0.00 C ATOM 219 CG GLN A 14 3.304 -5.186 -7.880 1.00 0.00 C ATOM 220 CD GLN A 14 2.804 -4.380 -9.092 1.00 0.00 C ATOM 221 OE1 GLN A 14 3.470 -4.246 -10.106 1.00 0.00 O ATOM 222 NE2 GLN A 14 1.605 -3.835 -9.057 1.00 0.00 N ATOM 0 H GLN A 14 0.955 -6.364 -9.347 1.00 0.00 H new ATOM 0 HA GLN A 14 3.564 -7.349 -9.378 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.495 -6.254 -7.464 1.00 0.00 H new ATOM 0 HB3 GLN A 14 2.931 -6.974 -6.762 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.223 -4.569 -6.985 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.361 -5.413 -8.016 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.026 -3.930 -8.223 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.256 -3.318 -9.864 1.00 0.00 H new ATOM 231 N PRO A 15 3.725 -9.469 -7.837 1.00 0.00 N ATOM 232 CA PRO A 15 3.826 -10.886 -7.507 1.00 0.00 C ATOM 233 C PRO A 15 2.878 -11.303 -6.374 1.00 0.00 C ATOM 234 O PRO A 15 2.621 -12.492 -6.175 1.00 0.00 O ATOM 235 CB PRO A 15 5.301 -11.129 -7.154 1.00 0.00 C ATOM 236 CG PRO A 15 5.834 -9.760 -6.741 1.00 0.00 C ATOM 237 CD PRO A 15 4.976 -8.784 -7.533 1.00 0.00 C ATOM 0 HA PRO A 15 3.515 -11.502 -8.351 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.400 -11.853 -6.345 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.851 -11.527 -8.007 1.00 0.00 H new ATOM 0 HG2 PRO A 15 5.736 -9.599 -5.667 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.891 -9.652 -6.984 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.790 -7.878 -6.956 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.482 -8.480 -8.449 1.00 0.00 H new ATOM 245 N ASN A 16 2.347 -10.342 -5.625 1.00 0.00 N ATOM 246 CA ASN A 16 1.696 -10.541 -4.344 1.00 0.00 C ATOM 247 C ASN A 16 0.189 -10.664 -4.505 1.00 0.00 C ATOM 248 O ASN A 16 -0.439 -11.169 -3.590 1.00 0.00 O ATOM 249 CB ASN A 16 2.045 -9.358 -3.415 1.00 0.00 C ATOM 250 CG ASN A 16 3.494 -8.917 -3.568 1.00 0.00 C ATOM 251 OD1 ASN A 16 4.426 -9.599 -3.162 1.00 0.00 O ATOM 252 ND2 ASN A 16 3.698 -7.839 -4.309 1.00 0.00 N ATOM 0 H ASN A 16 2.362 -9.363 -5.910 1.00 0.00 H new ATOM 0 HA ASN A 16 2.054 -11.472 -3.905 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.386 -8.518 -3.635 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.861 -9.644 -2.380 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.648 -7.561 -4.554 1.00 0.00 H new ATOM 0 HD22 ASN A 16 2.905 -7.287 -4.635 1.00 0.00 H new ATOM 259 N HIS A 17 -0.404 -10.238 -5.630 1.00 0.00 N ATOM 260 CA HIS A 17 -1.852 -10.032 -5.734 1.00 0.00 C ATOM 261 C HIS A 17 -2.647 -11.271 -5.295 1.00 0.00 C ATOM 262 O HIS A 17 -3.623 -11.125 -4.561 1.00 0.00 O ATOM 263 CB HIS A 17 -2.217 -9.563 -7.161 1.00 0.00 C ATOM 264 CG HIS A 17 -3.561 -8.869 -7.311 1.00 0.00 C ATOM 265 ND1 HIS A 17 -3.815 -7.747 -8.078 1.00 0.00 N ATOM 266 CD2 HIS A 17 -4.768 -9.277 -6.802 1.00 0.00 C ATOM 267 CE1 HIS A 17 -5.128 -7.472 -7.989 1.00 0.00 C ATOM 268 NE2 HIS A 17 -5.750 -8.391 -7.241 1.00 0.00 N ATOM 0 H HIS A 17 0.106 -10.028 -6.488 1.00 0.00 H new ATOM 0 HA HIS A 17 -2.139 -9.243 -5.039 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -1.439 -8.884 -7.509 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -2.202 -10.430 -7.822 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -4.929 -10.137 -6.169 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.613 -6.627 -8.456 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -6.748 -8.434 -7.033 1.00 0.00 H new ATOM 276 N LYS A 18 -2.208 -12.485 -5.658 1.00 0.00 N ATOM 277 CA LYS A 18 -2.901 -13.744 -5.350 1.00 0.00 C ATOM 278 C LYS A 18 -3.307 -13.923 -3.887 1.00 0.00 C ATOM 279 O LYS A 18 -4.242 -14.665 -3.600 1.00 0.00 O ATOM 280 CB LYS A 18 -2.094 -14.945 -5.880 1.00 0.00 C ATOM 281 CG LYS A 18 -0.767 -15.265 -5.175 1.00 0.00 C ATOM 282 CD LYS A 18 -0.935 -16.125 -3.919 1.00 0.00 C ATOM 283 CE LYS A 18 0.417 -16.539 -3.348 1.00 0.00 C ATOM 284 NZ LYS A 18 0.997 -17.704 -4.041 1.00 0.00 N ATOM 0 H LYS A 18 -1.345 -12.622 -6.184 1.00 0.00 H new ATOM 0 HA LYS A 18 -3.854 -13.692 -5.877 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.728 -15.830 -5.824 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -1.883 -14.771 -6.935 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.109 -15.781 -5.874 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.275 -14.331 -4.903 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.495 -15.569 -3.167 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -1.519 -17.014 -4.159 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.108 -15.699 -3.418 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.303 -16.771 -2.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.914 -17.942 -3.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 0.353 -18.516 -3.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 1.133 -17.477 -5.047 1.00 0.00 H new ATOM 298 N VAL A 19 -2.625 -13.273 -2.945 1.00 0.00 N ATOM 299 CA VAL A 19 -2.923 -13.437 -1.530 1.00 0.00 C ATOM 300 C VAL A 19 -4.283 -12.818 -1.186 1.00 0.00 C ATOM 301 O VAL A 19 -4.970 -13.330 -0.303 1.00 0.00 O ATOM 302 CB VAL A 19 -1.747 -12.900 -0.686 1.00 0.00 C ATOM 303 CG1 VAL A 19 -0.426 -13.558 -1.127 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.597 -11.380 -0.748 1.00 0.00 C ATOM 0 H VAL A 19 -1.861 -12.627 -3.141 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.020 -14.494 -1.284 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.977 -13.159 0.347 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.394 -13.169 -0.523 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.495 -14.638 -0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.241 -13.334 -2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.752 -11.072 -0.132 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.425 -11.073 -1.780 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.507 -10.909 -0.376 1.00 0.00 H new ATOM 314 N MET A 20 -4.721 -11.771 -1.900 1.00 0.00 N ATOM 315 CA MET A 20 -6.054 -11.198 -1.722 1.00 0.00 C ATOM 316 C MET A 20 -7.126 -11.957 -2.507 1.00 0.00 C ATOM 317 O MET A 20 -8.254 -11.477 -2.589 1.00 0.00 O ATOM 318 CB MET A 20 -6.080 -9.697 -2.055 1.00 0.00 C ATOM 319 CG MET A 20 -6.024 -9.320 -3.543 1.00 0.00 C ATOM 320 SD MET A 20 -7.106 -7.940 -4.019 1.00 0.00 S ATOM 321 CE MET A 20 -6.526 -6.649 -2.887 1.00 0.00 C ATOM 0 H MET A 20 -4.161 -11.303 -2.612 1.00 0.00 H new ATOM 0 HA MET A 20 -6.295 -11.307 -0.665 1.00 0.00 H new ATOM 0 HB2 MET A 20 -6.988 -9.270 -1.630 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.238 -9.222 -1.552 1.00 0.00 H new ATOM 0 HG2 MET A 20 -4.996 -9.063 -3.800 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.292 -10.195 -4.136 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.754 -5.669 -3.305 1.00 0.00 H new ATOM 0 HE2 MET A 20 -7.025 -6.758 -1.924 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.449 -6.743 -2.750 1.00 0.00 H new ATOM 331 N LEU A 21 -6.779 -13.083 -3.137 1.00 0.00 N ATOM 332 CA LEU A 21 -7.654 -13.899 -3.970 1.00 0.00 C ATOM 333 C LEU A 21 -7.862 -15.264 -3.304 1.00 0.00 C ATOM 334 O LEU A 21 -8.057 -16.269 -3.989 1.00 0.00 O ATOM 335 CB LEU A 21 -7.072 -14.012 -5.393 1.00 0.00 C ATOM 336 CG LEU A 21 -6.692 -12.679 -6.071 1.00 0.00 C ATOM 337 CD1 LEU A 21 -6.107 -12.940 -7.459 1.00 0.00 C ATOM 338 CD2 LEU A 21 -7.869 -11.712 -6.218 1.00 0.00 C ATOM 0 H LEU A 21 -5.835 -13.465 -3.074 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.633 -13.429 -4.066 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.184 -14.643 -5.353 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.799 -14.524 -6.023 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.957 -12.211 -5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.843 -11.992 -7.927 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -5.215 -13.560 -7.367 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.845 -13.455 -8.074 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.529 -10.796 -6.702 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.647 -12.176 -6.824 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.270 -11.474 -5.233 1.00 0.00 H new ATOM 350 N ASP A 22 -7.748 -15.326 -1.975 1.00 0.00 N ATOM 351 CA ASP A 22 -7.938 -16.525 -1.170 1.00 0.00 C ATOM 352 C ASP A 22 -8.701 -16.147 0.091 1.00 0.00 C ATOM 353 O ASP A 22 -8.144 -15.572 1.031 1.00 0.00 O ATOM 354 CB ASP A 22 -6.582 -17.150 -0.838 1.00 0.00 C ATOM 355 CG ASP A 22 -6.708 -18.499 -0.143 1.00 0.00 C ATOM 356 OD1 ASP A 22 -7.799 -19.114 -0.126 1.00 0.00 O ATOM 357 OD2 ASP A 22 -5.652 -19.026 0.258 1.00 0.00 O ATOM 0 H ASP A 22 -7.512 -14.508 -1.413 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.515 -17.267 -1.722 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -6.009 -17.272 -1.757 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -6.020 -16.469 -0.200 1.00 0.00 H new ATOM 362 N HIS A 23 -10.008 -16.397 0.085 1.00 0.00 N ATOM 363 CA HIS A 23 -10.938 -15.787 1.025 1.00 0.00 C ATOM 364 C HIS A 23 -10.690 -16.167 2.492 1.00 0.00 C ATOM 365 O HIS A 23 -11.083 -15.421 3.393 1.00 0.00 O ATOM 366 CB HIS A 23 -12.357 -16.136 0.576 1.00 0.00 C ATOM 367 CG HIS A 23 -13.411 -15.434 1.381 1.00 0.00 C ATOM 368 ND1 HIS A 23 -14.389 -16.006 2.157 1.00 0.00 N ATOM 369 CD2 HIS A 23 -13.545 -14.080 1.462 1.00 0.00 C ATOM 370 CE1 HIS A 23 -15.105 -15.003 2.683 1.00 0.00 C ATOM 371 NE2 HIS A 23 -14.623 -13.803 2.306 1.00 0.00 N ATOM 0 H HIS A 23 -10.452 -17.033 -0.577 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.784 -14.708 1.006 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -12.475 -15.874 -0.476 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.503 -17.213 0.655 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -14.541 -17.004 2.305 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -12.926 -13.350 0.962 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.961 -15.139 3.328 1.00 0.00 H new ATOM 379 N SER A 24 -10.017 -17.289 2.751 1.00 0.00 N ATOM 380 CA SER A 24 -9.589 -17.667 4.098 1.00 0.00 C ATOM 381 C SER A 24 -8.452 -16.776 4.610 1.00 0.00 C ATOM 382 O SER A 24 -8.372 -16.489 5.808 1.00 0.00 O ATOM 383 CB SER A 24 -9.184 -19.127 4.149 1.00 0.00 C ATOM 384 OG SER A 24 -10.157 -19.950 3.528 1.00 0.00 O ATOM 0 H SER A 24 -9.753 -17.962 2.031 1.00 0.00 H new ATOM 0 HA SER A 24 -10.444 -17.520 4.758 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.222 -19.258 3.653 1.00 0.00 H new ATOM 0 HB3 SER A 24 -9.052 -19.435 5.186 1.00 0.00 H new ATOM 0 HG SER A 24 -9.871 -20.886 3.573 1.00 0.00 H new ATOM 390 N HIS A 25 -7.570 -16.297 3.723 1.00 0.00 N ATOM 391 CA HIS A 25 -6.578 -15.307 4.115 1.00 0.00 C ATOM 392 C HIS A 25 -7.310 -13.987 4.346 1.00 0.00 C ATOM 393 O HIS A 25 -7.046 -13.326 5.345 1.00 0.00 O ATOM 394 CB HIS A 25 -5.421 -15.220 3.120 1.00 0.00 C ATOM 395 CG HIS A 25 -4.652 -16.521 2.975 1.00 0.00 C ATOM 396 ND1 HIS A 25 -3.579 -16.727 2.143 1.00 0.00 N ATOM 397 CD2 HIS A 25 -4.839 -17.688 3.677 1.00 0.00 C ATOM 398 CE1 HIS A 25 -3.151 -17.987 2.315 1.00 0.00 C ATOM 399 NE2 HIS A 25 -3.868 -18.607 3.266 1.00 0.00 N ATOM 0 H HIS A 25 -7.528 -16.579 2.744 1.00 0.00 H new ATOM 0 HA HIS A 25 -6.089 -15.598 5.045 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.811 -14.926 2.145 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.735 -14.435 3.439 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -5.604 -17.865 4.418 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -2.341 -18.441 1.764 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -3.732 -19.555 3.617 1.00 0.00 H new ATOM 407 N GLY A 26 -8.321 -13.684 3.525 1.00 0.00 N ATOM 408 CA GLY A 26 -9.391 -12.771 3.879 1.00 0.00 C ATOM 409 C GLY A 26 -10.093 -12.213 2.650 1.00 0.00 C ATOM 410 O GLY A 26 -9.691 -12.444 1.508 1.00 0.00 O ATOM 0 H GLY A 26 -8.412 -14.075 2.587 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.116 -13.288 4.507 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.986 -11.949 4.470 1.00 0.00 H new ATOM 414 N LEU A 27 -11.170 -11.469 2.890 1.00 0.00 N ATOM 415 CA LEU A 27 -11.936 -10.811 1.842 1.00 0.00 C ATOM 416 C LEU A 27 -11.153 -9.656 1.229 1.00 0.00 C ATOM 417 O LEU A 27 -10.532 -8.891 1.963 1.00 0.00 O ATOM 418 CB LEU A 27 -13.244 -10.292 2.449 1.00 0.00 C ATOM 419 CG LEU A 27 -14.171 -9.596 1.435 1.00 0.00 C ATOM 420 CD1 LEU A 27 -14.654 -10.585 0.371 1.00 0.00 C ATOM 421 CD2 LEU A 27 -15.376 -8.996 2.153 1.00 0.00 C ATOM 0 H LEU A 27 -11.537 -11.306 3.828 1.00 0.00 H new ATOM 0 HA LEU A 27 -12.144 -11.528 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.779 -11.127 2.902 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.008 -9.592 3.251 1.00 0.00 H new ATOM 0 HG LEU A 27 -13.605 -8.803 0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.307 -10.071 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.796 -10.994 -0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -15.204 -11.395 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -16.025 -8.506 1.427 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.929 -9.787 2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -15.036 -8.265 2.887 1.00 0.00 H new ATOM 433 N ALA A 28 -11.263 -9.486 -0.088 1.00 0.00 N ATOM 434 CA ALA A 28 -10.953 -8.254 -0.791 1.00 0.00 C ATOM 435 C ALA A 28 -11.828 -8.174 -2.041 1.00 0.00 C ATOM 436 O ALA A 28 -11.592 -8.923 -2.989 1.00 0.00 O ATOM 437 CB ALA A 28 -9.465 -8.210 -1.148 1.00 0.00 C ATOM 0 H ALA A 28 -11.581 -10.229 -0.710 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.161 -7.394 -0.155 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.245 -7.282 -1.675 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.870 -8.260 -0.236 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.219 -9.057 -1.788 1.00 0.00 H new ATOM 443 N ALA A 29 -12.820 -7.283 -2.058 1.00 0.00 N ATOM 444 CA ALA A 29 -13.676 -7.017 -3.210 1.00 0.00 C ATOM 445 C ALA A 29 -13.385 -5.612 -3.718 1.00 0.00 C ATOM 446 O ALA A 29 -13.264 -4.692 -2.911 1.00 0.00 O ATOM 447 CB ALA A 29 -15.150 -7.169 -2.823 1.00 0.00 C ATOM 0 H ALA A 29 -13.055 -6.711 -1.247 1.00 0.00 H new ATOM 0 HA ALA A 29 -13.469 -7.736 -4.003 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.777 -6.968 -3.692 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.331 -8.185 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -15.392 -6.463 -2.029 1.00 0.00 H new ATOM 453 N PHE A 30 -13.255 -5.450 -5.035 1.00 0.00 N ATOM 454 CA PHE A 30 -13.021 -4.166 -5.685 1.00 0.00 C ATOM 455 C PHE A 30 -14.228 -3.267 -5.434 1.00 0.00 C ATOM 456 O PHE A 30 -15.311 -3.483 -5.980 1.00 0.00 O ATOM 457 CB PHE A 30 -12.763 -4.377 -7.181 1.00 0.00 C ATOM 458 CG PHE A 30 -12.526 -3.126 -8.006 1.00 0.00 C ATOM 459 CD1 PHE A 30 -13.613 -2.465 -8.611 1.00 0.00 C ATOM 460 CD2 PHE A 30 -11.215 -2.696 -8.287 1.00 0.00 C ATOM 461 CE1 PHE A 30 -13.395 -1.420 -9.524 1.00 0.00 C ATOM 462 CE2 PHE A 30 -11.004 -1.674 -9.228 1.00 0.00 C ATOM 463 CZ PHE A 30 -12.088 -1.052 -9.865 1.00 0.00 C ATOM 0 H PHE A 30 -13.311 -6.228 -5.692 1.00 0.00 H new ATOM 0 HA PHE A 30 -12.136 -3.681 -5.272 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -11.895 -5.028 -7.290 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.616 -4.909 -7.603 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -14.623 -2.764 -8.371 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -10.375 -3.150 -7.782 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -14.235 -0.901 -9.962 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.997 -1.364 -9.463 1.00 0.00 H new ATOM 0 HZ PHE A 30 -11.915 -0.294 -10.614 1.00 0.00 H new ATOM 473 N ARG A 31 -14.044 -2.256 -4.595 1.00 0.00 N ATOM 474 CA ARG A 31 -15.067 -1.301 -4.200 1.00 0.00 C ATOM 475 C ARG A 31 -14.750 0.012 -4.908 1.00 0.00 C ATOM 476 O ARG A 31 -14.798 1.085 -4.312 1.00 0.00 O ATOM 477 CB ARG A 31 -15.067 -1.241 -2.656 1.00 0.00 C ATOM 478 CG ARG A 31 -16.212 -0.448 -1.998 1.00 0.00 C ATOM 479 CD ARG A 31 -17.437 -1.284 -1.612 1.00 0.00 C ATOM 480 NE ARG A 31 -17.509 -1.461 -0.150 1.00 0.00 N ATOM 481 CZ ARG A 31 -18.530 -1.943 0.565 1.00 0.00 C ATOM 482 NH1 ARG A 31 -19.566 -2.527 -0.006 1.00 0.00 N ATOM 483 NH2 ARG A 31 -18.517 -1.811 1.882 1.00 0.00 N ATOM 0 H ARG A 31 -13.142 -2.073 -4.155 1.00 0.00 H new ATOM 0 HA ARG A 31 -16.081 -1.572 -4.493 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -15.096 -2.262 -2.275 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.121 -0.807 -2.332 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.828 0.042 -1.103 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.529 0.340 -2.682 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -18.344 -0.796 -1.969 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.387 -2.258 -2.099 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.682 -1.183 0.378 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.603 -2.621 -1.021 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -20.330 -2.885 0.568 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -17.734 -1.346 2.340 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.290 -2.175 2.439 1.00 0.00 H new ATOM 497 N GLY A 32 -14.415 -0.070 -6.195 1.00 0.00 N ATOM 498 CA GLY A 32 -14.050 1.098 -6.964 1.00 0.00 C ATOM 499 C GLY A 32 -12.567 1.420 -6.812 1.00 0.00 C ATOM 500 O GLY A 32 -11.734 0.571 -6.479 1.00 0.00 O ATOM 0 H GLY A 32 -14.392 -0.943 -6.721 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -14.282 0.931 -8.016 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -14.645 1.951 -6.638 1.00 0.00 H new ATOM 504 N ARG A 33 -12.203 2.651 -7.162 1.00 0.00 N ATOM 505 CA ARG A 33 -10.810 3.076 -7.339 1.00 0.00 C ATOM 506 C ARG A 33 -10.524 4.294 -6.479 1.00 0.00 C ATOM 507 O ARG A 33 -11.465 4.955 -6.051 1.00 0.00 O ATOM 508 CB ARG A 33 -10.556 3.381 -8.812 1.00 0.00 C ATOM 509 CG ARG A 33 -10.804 2.145 -9.682 1.00 0.00 C ATOM 510 CD ARG A 33 -10.901 2.551 -11.133 1.00 0.00 C ATOM 511 NE ARG A 33 -9.618 2.895 -11.741 1.00 0.00 N ATOM 512 CZ ARG A 33 -8.865 2.025 -12.419 1.00 0.00 C ATOM 513 NH1 ARG A 33 -8.884 0.723 -12.135 1.00 0.00 N ATOM 514 NH2 ARG A 33 -8.112 2.482 -13.408 1.00 0.00 N ATOM 0 H ARG A 33 -12.877 3.397 -7.334 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.141 2.274 -7.026 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -11.206 4.194 -9.136 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -9.529 3.722 -8.944 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -9.994 1.427 -9.549 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -11.724 1.649 -9.371 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -11.352 1.736 -11.698 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.572 3.406 -11.216 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.279 3.852 -11.642 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.482 0.373 -11.387 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.300 0.077 -12.666 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.117 3.476 -13.635 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.527 1.840 -13.942 1.00 0.00 H new ATOM 528 N GLY A 34 -9.258 4.669 -6.275 1.00 0.00 N ATOM 529 CA GLY A 34 -8.964 5.866 -5.502 1.00 0.00 C ATOM 530 C GLY A 34 -7.516 6.302 -5.585 1.00 0.00 C ATOM 531 O GLY A 34 -6.675 5.599 -6.135 1.00 0.00 O ATOM 0 H GLY A 34 -8.441 4.170 -6.628 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.600 6.679 -5.852 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.221 5.686 -4.458 1.00 0.00 H new ATOM 535 N CYS A 35 -7.225 7.481 -5.050 1.00 0.00 N ATOM 536 CA CYS A 35 -5.888 8.066 -5.030 1.00 0.00 C ATOM 537 C CYS A 35 -5.626 8.704 -3.665 1.00 0.00 C ATOM 538 O CYS A 35 -6.560 9.182 -3.018 1.00 0.00 O ATOM 539 CB CYS A 35 -5.792 9.116 -6.141 1.00 0.00 C ATOM 540 SG CYS A 35 -5.843 8.351 -7.787 1.00 0.00 S ATOM 0 H CYS A 35 -7.928 8.072 -4.607 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.138 7.294 -5.199 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -6.613 9.826 -6.043 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.867 9.681 -6.030 1.00 0.00 H new ATOM 0 HG CYS A 35 -6.040 7.072 -7.665 1.00 0.00 H new ATOM 546 N THR A 36 -4.370 8.729 -3.218 1.00 0.00 N ATOM 547 CA THR A 36 -3.989 9.518 -2.050 1.00 0.00 C ATOM 548 C THR A 36 -4.077 10.992 -2.452 1.00 0.00 C ATOM 549 O THR A 36 -3.484 11.391 -3.458 1.00 0.00 O ATOM 550 CB THR A 36 -2.596 9.118 -1.535 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.660 8.943 -2.570 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.623 7.774 -0.816 1.00 0.00 C ATOM 0 H THR A 36 -3.602 8.213 -3.647 1.00 0.00 H new ATOM 0 HA THR A 36 -4.663 9.331 -1.214 1.00 0.00 H new ATOM 0 HB THR A 36 -2.312 9.939 -0.876 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.975 8.245 -3.181 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.620 7.528 -0.468 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.300 7.831 0.037 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.969 7.001 -1.502 1.00 0.00 H new ATOM 560 N VAL A 37 -4.910 11.763 -1.750 1.00 0.00 N ATOM 561 CA VAL A 37 -5.186 13.153 -2.106 1.00 0.00 C ATOM 562 C VAL A 37 -4.056 13.989 -1.515 1.00 0.00 C ATOM 563 O VAL A 37 -3.437 14.789 -2.213 1.00 0.00 O ATOM 564 CB VAL A 37 -6.543 13.631 -1.552 1.00 0.00 C ATOM 565 CG1 VAL A 37 -7.083 14.752 -2.435 1.00 0.00 C ATOM 566 CG2 VAL A 37 -7.555 12.499 -1.389 1.00 0.00 C ATOM 0 H VAL A 37 -5.410 11.441 -0.921 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.240 13.255 -3.190 1.00 0.00 H new ATOM 0 HB VAL A 37 -6.378 14.014 -0.545 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -8.043 15.092 -2.045 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.378 15.583 -2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.215 14.383 -3.452 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.489 12.900 -0.996 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.739 12.033 -2.357 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.160 11.755 -0.698 1.00 0.00 H new ATOM 576 N GLU A 38 -3.771 13.751 -0.232 1.00 0.00 N ATOM 577 CA GLU A 38 -2.512 14.099 0.380 1.00 0.00 C ATOM 578 C GLU A 38 -1.430 13.392 -0.419 1.00 0.00 C ATOM 579 O GLU A 38 -1.506 12.179 -0.626 1.00 0.00 O ATOM 580 CB GLU A 38 -2.480 13.585 1.827 1.00 0.00 C ATOM 581 CG GLU A 38 -3.110 14.492 2.883 1.00 0.00 C ATOM 582 CD GLU A 38 -2.743 15.978 2.798 1.00 0.00 C ATOM 583 OE1 GLU A 38 -1.777 16.428 3.452 1.00 0.00 O ATOM 584 OE2 GLU A 38 -3.492 16.741 2.140 1.00 0.00 O ATOM 0 H GLU A 38 -4.426 13.304 0.409 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.367 15.179 0.388 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.987 12.620 1.858 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.441 13.408 2.104 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -4.194 14.401 2.811 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.824 14.123 3.868 1.00 0.00 H new ATOM 591 N SER A 39 -0.407 14.139 -0.817 1.00 0.00 N ATOM 592 CA SER A 39 0.849 13.556 -1.240 1.00 0.00 C ATOM 593 C SER A 39 1.394 12.708 -0.083 1.00 0.00 C ATOM 594 O SER A 39 1.195 13.088 1.080 1.00 0.00 O ATOM 595 CB SER A 39 1.820 14.695 -1.584 1.00 0.00 C ATOM 596 OG SER A 39 1.161 15.812 -2.161 1.00 0.00 O ATOM 0 H SER A 39 -0.429 15.158 -0.854 1.00 0.00 H new ATOM 0 HA SER A 39 0.721 12.924 -2.119 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.340 15.011 -0.680 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.578 14.326 -2.276 1.00 0.00 H new ATOM 0 HG SER A 39 1.817 16.511 -2.361 1.00 0.00 H new ATOM 602 N PHE A 40 2.120 11.626 -0.359 1.00 0.00 N ATOM 603 CA PHE A 40 2.948 11.002 0.667 1.00 0.00 C ATOM 604 C PHE A 40 4.311 10.694 0.041 1.00 0.00 C ATOM 605 O PHE A 40 4.394 10.426 -1.160 1.00 0.00 O ATOM 606 CB PHE A 40 2.284 9.706 1.150 1.00 0.00 C ATOM 607 CG PHE A 40 1.216 9.890 2.205 1.00 0.00 C ATOM 608 CD1 PHE A 40 -0.110 10.138 1.812 1.00 0.00 C ATOM 609 CD2 PHE A 40 1.536 9.798 3.576 1.00 0.00 C ATOM 610 CE1 PHE A 40 -1.110 10.322 2.779 1.00 0.00 C ATOM 611 CE2 PHE A 40 0.535 9.999 4.544 1.00 0.00 C ATOM 612 CZ PHE A 40 -0.784 10.281 4.142 1.00 0.00 C ATOM 0 H PHE A 40 2.151 11.170 -1.271 1.00 0.00 H new ATOM 0 HA PHE A 40 3.066 11.666 1.523 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.842 9.200 0.292 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.056 9.046 1.547 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.360 10.187 0.763 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.547 9.574 3.882 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.131 10.495 2.473 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.778 9.937 5.594 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.546 10.466 4.885 1.00 0.00 H new ATOM 622 N PRO A 41 5.376 10.641 0.854 1.00 0.00 N ATOM 623 CA PRO A 41 6.747 10.391 0.429 1.00 0.00 C ATOM 624 C PRO A 41 6.959 8.916 0.120 1.00 0.00 C ATOM 625 O PRO A 41 7.223 8.108 1.019 1.00 0.00 O ATOM 626 CB PRO A 41 7.628 10.843 1.590 1.00 0.00 C ATOM 627 CG PRO A 41 6.708 10.689 2.791 1.00 0.00 C ATOM 628 CD PRO A 41 5.347 11.041 2.247 1.00 0.00 C ATOM 0 HA PRO A 41 6.989 10.931 -0.486 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.522 10.226 1.683 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.963 11.873 1.466 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.731 9.673 3.185 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.998 11.353 3.605 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.559 10.518 2.790 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.148 12.108 2.346 1.00 0.00 H new ATOM 636 N LEU A 42 6.847 8.544 -1.150 1.00 0.00 N ATOM 637 CA LEU A 42 6.994 7.165 -1.569 1.00 0.00 C ATOM 638 C LEU A 42 8.429 6.967 -2.060 1.00 0.00 C ATOM 639 O LEU A 42 8.770 7.493 -3.119 1.00 0.00 O ATOM 640 CB LEU A 42 5.970 6.889 -2.696 1.00 0.00 C ATOM 641 CG LEU A 42 5.571 5.421 -2.917 1.00 0.00 C ATOM 642 CD1 LEU A 42 5.047 5.192 -4.343 1.00 0.00 C ATOM 643 CD2 LEU A 42 6.662 4.393 -2.615 1.00 0.00 C ATOM 0 H LEU A 42 6.652 9.192 -1.913 1.00 0.00 H new ATOM 0 HA LEU A 42 6.805 6.471 -0.750 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.066 7.460 -2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.378 7.276 -3.630 1.00 0.00 H new ATOM 0 HG LEU A 42 4.782 5.254 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.774 4.144 -4.466 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.171 5.818 -4.514 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.824 5.451 -5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.279 3.390 -2.803 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.524 4.578 -3.256 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.962 4.477 -1.570 1.00 0.00 H new ATOM 655 N VAL A 43 9.270 6.234 -1.325 1.00 0.00 N ATOM 656 CA VAL A 43 10.628 5.901 -1.755 1.00 0.00 C ATOM 657 C VAL A 43 10.789 4.385 -1.802 1.00 0.00 C ATOM 658 O VAL A 43 10.159 3.675 -1.010 1.00 0.00 O ATOM 659 CB VAL A 43 11.694 6.565 -0.851 1.00 0.00 C ATOM 660 CG1 VAL A 43 11.456 8.074 -0.762 1.00 0.00 C ATOM 661 CG2 VAL A 43 11.770 6.014 0.586 1.00 0.00 C ATOM 0 H VAL A 43 9.025 5.854 -0.411 1.00 0.00 H new ATOM 0 HA VAL A 43 10.786 6.300 -2.757 1.00 0.00 H new ATOM 0 HB VAL A 43 12.641 6.327 -1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 43 12.215 8.525 -0.122 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.515 8.511 -1.759 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.468 8.262 -0.341 1.00 0.00 H new ATOM 0 HG21 VAL A 43 12.546 6.544 1.138 1.00 0.00 H new ATOM 0 HG22 VAL A 43 10.810 6.157 1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.008 4.951 0.556 1.00 0.00 H new ATOM 671 N ILE A 44 11.672 3.899 -2.676 1.00 0.00 N ATOM 672 CA ILE A 44 12.153 2.522 -2.636 1.00 0.00 C ATOM 673 C ILE A 44 13.369 2.522 -1.712 1.00 0.00 C ATOM 674 O ILE A 44 14.214 3.412 -1.817 1.00 0.00 O ATOM 675 CB ILE A 44 12.461 1.956 -4.042 1.00 0.00 C ATOM 676 CG1 ILE A 44 11.272 2.162 -5.011 1.00 0.00 C ATOM 677 CG2 ILE A 44 12.757 0.444 -3.908 1.00 0.00 C ATOM 678 CD1 ILE A 44 11.578 1.820 -6.471 1.00 0.00 C ATOM 0 H ILE A 44 12.073 4.453 -3.433 1.00 0.00 H new ATOM 0 HA ILE A 44 11.382 1.853 -2.252 1.00 0.00 H new ATOM 0 HB ILE A 44 13.321 2.486 -4.451 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.435 1.550 -4.675 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.949 3.202 -4.954 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.977 0.028 -4.891 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.615 0.298 -3.252 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.888 -0.061 -3.486 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.690 1.993 -7.079 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.392 2.450 -6.829 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.870 0.773 -6.546 1.00 0.00 H new ATOM 690 N ALA A 45 13.461 1.542 -0.808 1.00 0.00 N ATOM 691 CA ALA A 45 14.632 1.368 0.033 1.00 0.00 C ATOM 692 C ALA A 45 14.918 -0.117 0.261 1.00 0.00 C ATOM 693 O ALA A 45 14.076 -0.996 0.037 1.00 0.00 O ATOM 694 CB ALA A 45 14.428 2.101 1.362 1.00 0.00 C ATOM 0 H ALA A 45 12.726 0.854 -0.645 1.00 0.00 H new ATOM 0 HA ALA A 45 15.498 1.797 -0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.309 1.968 1.990 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.275 3.163 1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 45 13.554 1.694 1.871 1.00 0.00 H new ATOM 700 N GLY A 46 16.102 -0.380 0.804 1.00 0.00 N ATOM 701 CA GLY A 46 16.489 -1.670 1.330 1.00 0.00 C ATOM 702 C GLY A 46 16.911 -2.656 0.247 1.00 0.00 C ATOM 703 O GLY A 46 16.805 -2.412 -0.958 1.00 0.00 O ATOM 0 H GLY A 46 16.835 0.324 0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 46 17.312 -1.537 2.032 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.655 -2.091 1.892 1.00 0.00 H new ATOM 707 N GLU A 47 17.376 -3.813 0.704 1.00 0.00 N ATOM 708 CA GLU A 47 18.153 -4.767 -0.086 1.00 0.00 C ATOM 709 C GLU A 47 17.282 -5.714 -0.907 1.00 0.00 C ATOM 710 O GLU A 47 17.780 -6.507 -1.710 1.00 0.00 O ATOM 711 CB GLU A 47 19.062 -5.505 0.902 1.00 0.00 C ATOM 712 CG GLU A 47 20.258 -6.198 0.245 1.00 0.00 C ATOM 713 CD GLU A 47 21.564 -5.927 0.995 1.00 0.00 C ATOM 714 OE1 GLU A 47 21.601 -6.109 2.236 1.00 0.00 O ATOM 715 OE2 GLU A 47 22.539 -5.492 0.345 1.00 0.00 O ATOM 0 H GLU A 47 17.219 -4.124 1.663 1.00 0.00 H new ATOM 0 HA GLU A 47 18.744 -4.244 -0.838 1.00 0.00 H new ATOM 0 HB2 GLU A 47 19.428 -4.795 1.644 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.472 -6.249 1.437 1.00 0.00 H new ATOM 0 HG2 GLU A 47 20.078 -7.272 0.208 1.00 0.00 H new ATOM 0 HG3 GLU A 47 20.354 -5.855 -0.785 1.00 0.00 H new ATOM 722 N HIS A 48 15.970 -5.601 -0.715 1.00 0.00 N ATOM 723 CA HIS A 48 14.953 -6.410 -1.354 1.00 0.00 C ATOM 724 C HIS A 48 13.985 -5.558 -2.182 1.00 0.00 C ATOM 725 O HIS A 48 12.966 -6.068 -2.651 1.00 0.00 O ATOM 726 CB HIS A 48 14.260 -7.238 -0.267 1.00 0.00 C ATOM 727 CG HIS A 48 15.078 -8.445 0.109 1.00 0.00 C ATOM 728 ND1 HIS A 48 15.020 -9.686 -0.489 1.00 0.00 N ATOM 729 CD2 HIS A 48 16.073 -8.478 1.049 1.00 0.00 C ATOM 730 CE1 HIS A 48 15.959 -10.456 0.087 1.00 0.00 C ATOM 731 NE2 HIS A 48 16.613 -9.768 1.042 1.00 0.00 N ATOM 0 H HIS A 48 15.576 -4.908 -0.078 1.00 0.00 H new ATOM 0 HA HIS A 48 15.405 -7.090 -2.077 1.00 0.00 H new ATOM 0 HB2 HIS A 48 14.096 -6.619 0.615 1.00 0.00 H new ATOM 0 HB3 HIS A 48 13.279 -7.557 -0.620 1.00 0.00 H new ATOM 0 HD1 HIS A 48 14.381 -9.968 -1.233 1.00 0.00 H new ATOM 0 HD2 HIS A 48 16.384 -7.658 1.680 1.00 0.00 H new ATOM 0 HE1 HIS A 48 16.161 -11.483 -0.179 1.00 0.00 H new ATOM 739 N ASN A 49 14.312 -4.273 -2.381 1.00 0.00 N ATOM 740 CA ASN A 49 13.572 -3.309 -3.197 1.00 0.00 C ATOM 741 C ASN A 49 12.138 -3.186 -2.672 1.00 0.00 C ATOM 742 O ASN A 49 11.162 -3.474 -3.357 1.00 0.00 O ATOM 743 CB ASN A 49 13.650 -3.702 -4.682 1.00 0.00 C ATOM 744 CG ASN A 49 15.082 -3.944 -5.146 1.00 0.00 C ATOM 745 OD1 ASN A 49 16.029 -3.360 -4.629 1.00 0.00 O ATOM 746 ND2 ASN A 49 15.279 -4.803 -6.122 1.00 0.00 N ATOM 0 H ASN A 49 15.142 -3.861 -1.954 1.00 0.00 H new ATOM 0 HA ASN A 49 14.023 -2.320 -3.119 1.00 0.00 H new ATOM 0 HB2 ASN A 49 13.060 -4.604 -4.848 1.00 0.00 H new ATOM 0 HB3 ASN A 49 13.203 -2.913 -5.287 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.225 -4.988 -6.455 1.00 0.00 H new ATOM 0 HD22 ASN A 49 14.486 -5.284 -6.546 1.00 0.00 H new ATOM 753 N ILE A 50 12.055 -2.788 -1.402 1.00 0.00 N ATOM 754 CA ILE A 50 10.862 -2.746 -0.571 1.00 0.00 C ATOM 755 C ILE A 50 10.466 -1.275 -0.427 1.00 0.00 C ATOM 756 O ILE A 50 11.078 -0.576 0.375 1.00 0.00 O ATOM 757 CB ILE A 50 11.049 -3.519 0.758 1.00 0.00 C ATOM 758 CG1 ILE A 50 11.233 -5.019 0.443 1.00 0.00 C ATOM 759 CG2 ILE A 50 9.818 -3.310 1.653 1.00 0.00 C ATOM 760 CD1 ILE A 50 11.621 -5.883 1.645 1.00 0.00 C ATOM 0 H ILE A 50 12.880 -2.465 -0.896 1.00 0.00 H new ATOM 0 HA ILE A 50 10.030 -3.275 -1.036 1.00 0.00 H new ATOM 0 HB ILE A 50 11.929 -3.150 1.284 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.305 -5.404 0.021 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.000 -5.124 -0.325 1.00 0.00 H new ATOM 0 HG21 ILE A 50 9.951 -3.855 2.588 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.699 -2.248 1.866 1.00 0.00 H new ATOM 0 HG23 ILE A 50 8.929 -3.679 1.141 1.00 0.00 H new ATOM 0 HD11 ILE A 50 11.728 -6.920 1.328 1.00 0.00 H new ATOM 0 HD12 ILE A 50 12.566 -5.530 2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 50 10.845 -5.815 2.408 1.00 0.00 H new ATOM 772 N PRO A 51 9.643 -0.707 -1.333 1.00 0.00 N ATOM 773 CA PRO A 51 9.131 0.637 -1.127 1.00 0.00 C ATOM 774 C PRO A 51 8.351 0.744 0.177 1.00 0.00 C ATOM 775 O PRO A 51 7.492 -0.089 0.465 1.00 0.00 O ATOM 776 CB PRO A 51 8.246 0.940 -2.335 1.00 0.00 C ATOM 777 CG PRO A 51 7.736 -0.447 -2.717 1.00 0.00 C ATOM 778 CD PRO A 51 8.943 -1.341 -2.438 1.00 0.00 C ATOM 0 HA PRO A 51 9.943 1.359 -1.043 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.431 1.618 -2.083 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.808 1.405 -3.145 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.871 -0.738 -2.121 1.00 0.00 H new ATOM 0 HG3 PRO A 51 7.432 -0.492 -3.763 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.631 -2.353 -2.178 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.584 -1.421 -3.316 1.00 0.00 H new ATOM 786 N TRP A 52 8.607 1.809 0.930 1.00 0.00 N ATOM 787 CA TRP A 52 7.932 2.101 2.188 1.00 0.00 C ATOM 788 C TRP A 52 6.870 3.162 1.943 1.00 0.00 C ATOM 789 O TRP A 52 6.659 3.608 0.808 1.00 0.00 O ATOM 790 CB TRP A 52 8.967 2.546 3.234 1.00 0.00 C ATOM 791 CG TRP A 52 9.949 1.472 3.551 1.00 0.00 C ATOM 792 CD1 TRP A 52 11.025 1.149 2.804 1.00 0.00 C ATOM 793 CD2 TRP A 52 9.883 0.475 4.608 1.00 0.00 C ATOM 794 NE1 TRP A 52 11.596 -0.005 3.291 1.00 0.00 N ATOM 795 CE2 TRP A 52 10.922 -0.472 4.393 1.00 0.00 C ATOM 796 CE3 TRP A 52 9.025 0.252 5.703 1.00 0.00 C ATOM 797 CZ2 TRP A 52 11.083 -1.599 5.202 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.191 -0.867 6.535 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.217 -1.794 6.287 1.00 0.00 C ATOM 0 H TRP A 52 9.305 2.508 0.676 1.00 0.00 H new ATOM 0 HA TRP A 52 7.436 1.211 2.577 1.00 0.00 H new ATOM 0 HB2 TRP A 52 9.498 3.424 2.866 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.452 2.845 4.147 1.00 0.00 H new ATOM 0 HD1 TRP A 52 11.384 1.710 1.954 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.416 -0.456 2.885 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.228 0.952 5.905 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.866 -2.313 4.994 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.525 -1.016 7.372 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.338 -2.653 6.930 1.00 0.00 H new ATOM 810 N LEU A 53 6.235 3.644 3.006 1.00 0.00 N ATOM 811 CA LEU A 53 5.558 4.922 2.969 1.00 0.00 C ATOM 812 C LEU A 53 5.770 5.590 4.314 1.00 0.00 C ATOM 813 O LEU A 53 5.167 5.178 5.312 1.00 0.00 O ATOM 814 CB LEU A 53 4.084 4.758 2.577 1.00 0.00 C ATOM 815 CG LEU A 53 3.499 6.109 2.126 1.00 0.00 C ATOM 816 CD1 LEU A 53 4.050 6.494 0.745 1.00 0.00 C ATOM 817 CD2 LEU A 53 1.971 6.034 2.121 1.00 0.00 C ATOM 0 H LEU A 53 6.179 3.162 3.903 1.00 0.00 H new ATOM 0 HA LEU A 53 5.973 5.569 2.196 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.993 4.028 1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.516 4.372 3.424 1.00 0.00 H new ATOM 0 HG LEU A 53 3.799 6.887 2.828 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.628 7.451 0.439 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.136 6.576 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.778 5.728 0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.561 6.992 1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.647 5.253 1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.615 5.804 3.125 1.00 0.00 H new ATOM 829 N LEU A 54 6.698 6.551 4.377 1.00 0.00 N ATOM 830 CA LEU A 54 6.857 7.353 5.571 1.00 0.00 C ATOM 831 C LEU A 54 5.552 8.125 5.768 1.00 0.00 C ATOM 832 O LEU A 54 5.010 8.678 4.807 1.00 0.00 O ATOM 833 CB LEU A 54 8.063 8.291 5.432 1.00 0.00 C ATOM 834 CG LEU A 54 9.401 7.691 4.946 1.00 0.00 C ATOM 835 CD1 LEU A 54 9.598 6.171 4.992 1.00 0.00 C ATOM 836 CD2 LEU A 54 9.853 8.220 3.588 1.00 0.00 C ATOM 0 H LEU A 54 7.339 6.783 3.618 1.00 0.00 H new ATOM 0 HA LEU A 54 7.054 6.730 6.443 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.786 9.089 4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 54 8.239 8.754 6.403 1.00 0.00 H new ATOM 0 HG LEU A 54 10.045 8.065 5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 54 10.590 5.921 4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 54 9.502 5.823 6.020 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.843 5.687 4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.799 7.754 3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.100 7.984 2.836 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.984 9.301 3.644 1.00 0.00 H new ATOM 848 N TYR A 55 5.004 8.122 6.981 1.00 0.00 N ATOM 849 CA TYR A 55 3.754 8.814 7.254 1.00 0.00 C ATOM 850 C TYR A 55 3.996 10.324 7.228 1.00 0.00 C ATOM 851 O TYR A 55 4.397 10.906 8.238 1.00 0.00 O ATOM 852 CB TYR A 55 3.154 8.368 8.590 1.00 0.00 C ATOM 853 CG TYR A 55 1.763 8.945 8.802 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.688 8.529 7.994 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.562 9.967 9.747 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.575 9.136 8.105 1.00 0.00 C ATOM 857 CE2 TYR A 55 0.302 10.583 9.863 1.00 0.00 C ATOM 858 CZ TYR A 55 -0.771 10.174 9.042 1.00 0.00 C ATOM 859 OH TYR A 55 -1.993 10.758 9.185 1.00 0.00 O ATOM 0 H TYR A 55 5.408 7.647 7.788 1.00 0.00 H new ATOM 0 HA TYR A 55 3.030 8.559 6.481 1.00 0.00 H new ATOM 0 HB2 TYR A 55 3.105 7.280 8.622 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.806 8.682 9.405 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.836 7.733 7.279 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.376 10.280 10.385 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.391 8.810 7.477 1.00 0.00 H new ATOM 0 HE2 TYR A 55 0.155 11.373 10.584 1.00 0.00 H new ATOM 0 HH TYR A 55 -1.945 11.452 9.875 1.00 0.00 H new ATOM 869 N LEU A 56 3.793 10.963 6.073 1.00 0.00 N ATOM 870 CA LEU A 56 3.984 12.399 5.927 1.00 0.00 C ATOM 871 C LEU A 56 2.948 12.970 4.939 1.00 0.00 C ATOM 872 O LEU A 56 3.285 13.213 3.779 1.00 0.00 O ATOM 873 CB LEU A 56 5.456 12.692 5.549 1.00 0.00 C ATOM 874 CG LEU A 56 6.157 13.852 6.288 1.00 0.00 C ATOM 875 CD1 LEU A 56 5.223 14.915 6.879 1.00 0.00 C ATOM 876 CD2 LEU A 56 7.064 13.330 7.407 1.00 0.00 C ATOM 0 H LEU A 56 3.492 10.496 5.217 1.00 0.00 H new ATOM 0 HA LEU A 56 3.806 12.912 6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.035 11.784 5.719 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.495 12.900 4.480 1.00 0.00 H new ATOM 0 HG LEU A 56 6.736 14.342 5.505 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.815 15.684 7.376 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.636 15.368 6.080 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.553 14.449 7.602 1.00 0.00 H new ATOM 0 HD21 LEU A 56 7.543 14.171 7.909 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.468 12.770 8.127 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.827 12.678 6.982 1.00 0.00 H new ATOM 888 N PRO A 57 1.683 13.161 5.363 1.00 0.00 N ATOM 889 CA PRO A 57 0.648 13.766 4.527 1.00 0.00 C ATOM 890 C PRO A 57 1.111 15.157 4.082 1.00 0.00 C ATOM 891 O PRO A 57 1.435 16.013 4.917 1.00 0.00 O ATOM 892 CB PRO A 57 -0.628 13.778 5.372 1.00 0.00 C ATOM 893 CG PRO A 57 -0.156 13.643 6.808 1.00 0.00 C ATOM 894 CD PRO A 57 1.178 12.910 6.708 1.00 0.00 C ATOM 0 HA PRO A 57 0.453 13.213 3.608 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -1.188 14.702 5.227 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.290 12.957 5.096 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -0.038 14.619 7.280 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.872 13.083 7.409 1.00 0.00 H new ATOM 0 HD2 PRO A 57 1.878 13.273 7.460 1.00 0.00 H new ATOM 0 HD3 PRO A 57 1.049 11.842 6.882 1.00 0.00 H new ATOM 902 N GLY A 58 1.214 15.346 2.768 1.00 0.00 N ATOM 903 CA GLY A 58 1.562 16.596 2.112 1.00 0.00 C ATOM 904 C GLY A 58 3.016 16.684 1.657 1.00 0.00 C ATOM 905 O GLY A 58 3.440 17.759 1.240 1.00 0.00 O ATOM 0 H GLY A 58 1.048 14.591 2.102 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.914 16.731 1.246 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.357 17.420 2.795 1.00 0.00 H new ATOM 909 N LYS A 59 3.806 15.610 1.745 1.00 0.00 N ATOM 910 CA LYS A 59 5.157 15.527 1.185 1.00 0.00 C ATOM 911 C LYS A 59 5.175 14.465 0.102 1.00 0.00 C ATOM 912 O LYS A 59 4.267 13.648 0.031 1.00 0.00 O ATOM 913 CB LYS A 59 6.156 15.143 2.283 1.00 0.00 C ATOM 914 CG LYS A 59 6.669 16.340 3.077 1.00 0.00 C ATOM 915 CD LYS A 59 5.568 17.081 3.835 1.00 0.00 C ATOM 916 CE LYS A 59 6.095 17.797 5.075 1.00 0.00 C ATOM 917 NZ LYS A 59 5.122 18.799 5.542 1.00 0.00 N ATOM 0 H LYS A 59 3.517 14.754 2.219 1.00 0.00 H new ATOM 0 HA LYS A 59 5.437 16.495 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.681 14.439 2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 59 7.002 14.626 1.830 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.423 16.000 3.787 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.162 17.034 2.396 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.100 17.808 3.171 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.794 16.373 4.130 1.00 0.00 H new ATOM 0 HE2 LYS A 59 6.289 17.073 5.866 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.044 18.281 4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.495 19.278 6.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.958 19.499 4.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.225 18.328 5.779 1.00 0.00 H new ATOM 931 N GLY A 60 6.240 14.414 -0.691 1.00 0.00 N ATOM 932 CA GLY A 60 6.272 13.518 -1.834 1.00 0.00 C ATOM 933 C GLY A 60 5.241 13.969 -2.853 1.00 0.00 C ATOM 934 O GLY A 60 5.008 15.169 -3.000 1.00 0.00 O ATOM 0 H GLY A 60 7.081 14.976 -0.563 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.266 13.516 -2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 60 6.063 12.496 -1.516 1.00 0.00 H new ATOM 938 N HIS A 61 4.673 13.021 -3.583 1.00 0.00 N ATOM 939 CA HIS A 61 3.699 13.255 -4.639 1.00 0.00 C ATOM 940 C HIS A 61 2.449 12.432 -4.333 1.00 0.00 C ATOM 941 O HIS A 61 2.419 11.700 -3.336 1.00 0.00 O ATOM 942 CB HIS A 61 4.340 12.897 -5.986 1.00 0.00 C ATOM 943 CG HIS A 61 5.603 13.679 -6.266 1.00 0.00 C ATOM 944 ND1 HIS A 61 5.755 15.048 -6.180 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.817 13.148 -6.610 1.00 0.00 C ATOM 946 CE1 HIS A 61 7.025 15.337 -6.501 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.722 14.209 -6.729 1.00 0.00 N ATOM 0 H HIS A 61 4.885 12.032 -3.452 1.00 0.00 H new ATOM 0 HA HIS A 61 3.398 14.301 -4.693 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.568 11.831 -6.002 1.00 0.00 H new ATOM 0 HB3 HIS A 61 3.621 13.081 -6.784 1.00 0.00 H new ATOM 0 HD2 HIS A 61 7.036 12.101 -6.762 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.431 16.336 -6.567 1.00 0.00 H new ATOM 0 HE2 HIS A 61 8.716 14.140 -6.946 1.00 0.00 H new ATOM 955 N CYS A 62 1.406 12.559 -5.158 1.00 0.00 N ATOM 956 CA CYS A 62 0.264 11.664 -5.046 1.00 0.00 C ATOM 957 C CYS A 62 0.700 10.249 -5.298 1.00 0.00 C ATOM 958 O CYS A 62 1.733 10.013 -5.910 1.00 0.00 O ATOM 959 CB CYS A 62 -0.894 12.030 -5.975 1.00 0.00 C ATOM 960 SG CYS A 62 -0.416 12.445 -7.674 1.00 0.00 S ATOM 0 H CYS A 62 1.333 13.260 -5.895 1.00 0.00 H new ATOM 0 HA CYS A 62 -0.115 11.769 -4.029 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -1.593 11.195 -6.005 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -1.428 12.878 -5.547 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.478 12.735 -8.365 1.00 0.00 H new ATOM 966 N VAL A 63 -0.127 9.307 -4.867 1.00 0.00 N ATOM 967 CA VAL A 63 0.041 7.922 -5.218 1.00 0.00 C ATOM 968 C VAL A 63 -1.323 7.357 -5.594 1.00 0.00 C ATOM 969 O VAL A 63 -2.251 7.347 -4.771 1.00 0.00 O ATOM 970 CB VAL A 63 0.807 7.150 -4.120 1.00 0.00 C ATOM 971 CG1 VAL A 63 1.096 5.710 -4.559 1.00 0.00 C ATOM 972 CG2 VAL A 63 2.147 7.819 -3.762 1.00 0.00 C ATOM 0 H VAL A 63 -0.930 9.491 -4.265 1.00 0.00 H new ATOM 0 HA VAL A 63 0.680 7.808 -6.094 1.00 0.00 H new ATOM 0 HB VAL A 63 0.161 7.156 -3.242 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.636 5.190 -3.768 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.156 5.194 -4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.702 5.720 -5.465 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.647 7.239 -2.986 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.780 7.862 -4.648 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.963 8.830 -3.398 1.00 0.00 H new ATOM 982 N THR A 64 -1.476 6.984 -6.864 1.00 0.00 N ATOM 983 CA THR A 64 -2.727 6.466 -7.400 1.00 0.00 C ATOM 984 C THR A 64 -2.891 4.986 -7.009 1.00 0.00 C ATOM 985 O THR A 64 -1.890 4.305 -6.737 1.00 0.00 O ATOM 986 CB THR A 64 -2.775 6.725 -8.922 1.00 0.00 C ATOM 987 OG1 THR A 64 -1.797 5.985 -9.638 1.00 0.00 O ATOM 988 CG2 THR A 64 -2.536 8.202 -9.266 1.00 0.00 C ATOM 0 H THR A 64 -0.726 7.035 -7.553 1.00 0.00 H new ATOM 0 HA THR A 64 -3.583 6.986 -6.969 1.00 0.00 H new ATOM 0 HB THR A 64 -3.777 6.412 -9.216 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.872 6.184 -10.595 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.579 8.335 -10.347 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.304 8.814 -8.794 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.555 8.506 -8.902 1.00 0.00 H new ATOM 996 N GLY A 65 -4.118 4.452 -6.995 1.00 0.00 N ATOM 997 CA GLY A 65 -4.363 3.081 -6.575 1.00 0.00 C ATOM 998 C GLY A 65 -5.830 2.682 -6.705 1.00 0.00 C ATOM 999 O GLY A 65 -6.546 3.187 -7.576 1.00 0.00 O ATOM 0 H GLY A 65 -4.958 4.959 -7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.752 2.406 -7.175 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.048 2.960 -5.539 1.00 0.00 H new ATOM 1003 N GLU A 66 -6.271 1.727 -5.882 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.606 1.129 -5.922 1.00 0.00 C ATOM 1005 C GLU A 66 -8.165 0.934 -4.502 1.00 0.00 C ATOM 1006 O GLU A 66 -7.423 1.048 -3.522 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.552 -0.177 -6.741 1.00 0.00 C ATOM 1008 CG GLU A 66 -7.853 0.125 -8.216 1.00 0.00 C ATOM 1009 CD GLU A 66 -7.245 -0.860 -9.213 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -7.633 -2.037 -9.233 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -6.418 -0.427 -10.053 1.00 0.00 O ATOM 0 H GLU A 66 -5.686 1.336 -5.143 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.302 1.802 -6.422 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.568 -0.636 -6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -8.276 -0.892 -6.351 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -8.934 0.139 -8.355 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -7.489 1.126 -8.448 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.471 0.676 -4.382 1.00 0.00 N ATOM 1019 CA ILE A 67 -10.197 0.587 -3.121 1.00 0.00 C ATOM 1020 C ILE A 67 -10.688 -0.851 -3.039 1.00 0.00 C ATOM 1021 O ILE A 67 -11.367 -1.329 -3.947 1.00 0.00 O ATOM 1022 CB ILE A 67 -11.356 1.618 -3.095 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -10.785 3.056 -3.111 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -12.299 1.464 -1.889 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -11.863 4.146 -3.082 1.00 0.00 C ATOM 0 H ILE A 67 -10.069 0.518 -5.193 1.00 0.00 H new ATOM 0 HA ILE A 67 -9.576 0.825 -2.258 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.950 1.424 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -10.126 3.186 -2.252 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -10.174 3.185 -4.004 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -13.083 2.220 -1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.750 0.472 -1.904 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -11.733 1.591 -0.966 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -11.389 5.127 -3.095 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -12.508 4.043 -3.955 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -12.460 4.044 -2.176 1.00 0.00 H new ATOM 1037 N TYR A 68 -10.407 -1.527 -1.923 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.961 -2.844 -1.659 1.00 0.00 C ATOM 1039 C TYR A 68 -11.718 -2.815 -0.343 1.00 0.00 C ATOM 1040 O TYR A 68 -11.202 -2.400 0.699 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.912 -3.962 -1.718 1.00 0.00 C ATOM 1042 CG TYR A 68 -9.309 -4.131 -3.102 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -8.304 -3.245 -3.520 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -9.770 -5.126 -3.988 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -7.752 -3.359 -4.806 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -9.210 -5.250 -5.276 1.00 0.00 C ATOM 1047 CZ TYR A 68 -8.180 -4.374 -5.685 1.00 0.00 C ATOM 1048 OH TYR A 68 -7.575 -4.487 -6.899 1.00 0.00 O ATOM 0 H TYR A 68 -9.794 -1.176 -1.187 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.661 -3.087 -2.458 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.117 -3.746 -1.004 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.371 -4.901 -1.409 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.954 -2.473 -2.850 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -10.557 -5.797 -3.678 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.992 -2.662 -5.125 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -9.568 -6.014 -5.950 1.00 0.00 H new ATOM 0 HH TYR A 68 -7.974 -5.232 -7.395 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.963 -3.263 -0.425 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.746 -3.758 0.680 1.00 0.00 C ATOM 1060 C GLU A 69 -13.021 -4.990 1.201 1.00 0.00 C ATOM 1061 O GLU A 69 -13.017 -6.024 0.531 1.00 0.00 O ATOM 1062 CB GLU A 69 -15.139 -4.096 0.144 1.00 0.00 C ATOM 1063 CG GLU A 69 -16.112 -4.633 1.197 1.00 0.00 C ATOM 1064 CD GLU A 69 -17.332 -5.339 0.547 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -17.861 -4.865 -0.482 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -17.780 -6.410 1.040 1.00 0.00 O ATOM 0 H GLU A 69 -13.471 -3.289 -1.309 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.860 -3.038 1.491 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.568 -3.201 -0.306 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.039 -4.835 -0.651 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.591 -5.334 1.849 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -16.459 -3.812 1.824 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.382 -4.877 2.363 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.817 -6.025 3.046 1.00 0.00 C ATOM 1075 C VAL A 70 -12.556 -6.213 4.367 1.00 0.00 C ATOM 1076 O VAL A 70 -13.213 -5.293 4.887 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.280 -5.927 3.169 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.578 -5.604 1.840 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -9.781 -4.937 4.214 1.00 0.00 C ATOM 0 H VAL A 70 -12.245 -3.991 2.850 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.966 -6.931 2.458 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.014 -6.933 3.495 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.501 -5.550 2.001 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.798 -6.386 1.113 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.937 -4.646 1.462 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -8.691 -4.939 4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.139 -3.937 3.968 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.155 -5.225 5.196 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.441 -7.415 4.919 1.00 0.00 N ATOM 1090 CA ASP A 71 -13.001 -7.760 6.214 1.00 0.00 C ATOM 1091 C ASP A 71 -11.858 -8.030 7.178 1.00 0.00 C ATOM 1092 O ASP A 71 -10.686 -8.013 6.792 1.00 0.00 O ATOM 1093 CB ASP A 71 -14.035 -8.902 6.117 1.00 0.00 C ATOM 1094 CG ASP A 71 -15.458 -8.459 5.764 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -15.655 -7.336 5.247 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -16.416 -9.186 6.087 1.00 0.00 O ATOM 0 H ASP A 71 -11.948 -8.187 4.470 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.577 -6.923 6.608 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.696 -9.616 5.366 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -14.061 -9.430 7.070 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.209 -8.223 8.447 1.00 0.00 N ATOM 1102 CA GLU A 72 -11.272 -8.313 9.560 1.00 0.00 C ATOM 1103 C GLU A 72 -10.192 -9.335 9.269 1.00 0.00 C ATOM 1104 O GLU A 72 -9.023 -9.052 9.507 1.00 0.00 O ATOM 1105 CB GLU A 72 -12.020 -8.682 10.844 1.00 0.00 C ATOM 1106 CG GLU A 72 -12.567 -7.453 11.566 1.00 0.00 C ATOM 1107 CD GLU A 72 -11.821 -7.169 12.860 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -12.045 -7.898 13.854 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -11.003 -6.236 12.890 1.00 0.00 O ATOM 0 H GLU A 72 -13.182 -8.324 8.736 1.00 0.00 H new ATOM 0 HA GLU A 72 -10.796 -7.342 9.693 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.842 -9.355 10.603 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.349 -9.224 11.510 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -12.495 -6.586 10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -13.625 -7.602 11.783 1.00 0.00 H new ATOM 1116 N GLN A 73 -10.552 -10.495 8.715 1.00 0.00 N ATOM 1117 CA GLN A 73 -9.586 -11.556 8.518 1.00 0.00 C ATOM 1118 C GLN A 73 -8.474 -11.129 7.563 1.00 0.00 C ATOM 1119 O GLN A 73 -7.321 -11.474 7.805 1.00 0.00 O ATOM 1120 CB GLN A 73 -10.306 -12.827 8.047 1.00 0.00 C ATOM 1121 CG GLN A 73 -9.487 -14.103 8.228 1.00 0.00 C ATOM 1122 CD GLN A 73 -8.990 -14.244 9.663 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -9.761 -14.093 10.613 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -7.703 -14.440 9.856 1.00 0.00 N ATOM 0 H GLN A 73 -11.497 -10.714 8.401 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.099 -11.776 9.468 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.243 -12.927 8.595 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.563 -12.718 6.993 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.095 -14.968 7.965 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.637 -14.092 7.546 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.080 -14.563 9.057 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.328 -14.469 10.804 1.00 0.00 H new ATOM 1133 N MET A 74 -8.805 -10.339 6.535 1.00 0.00 N ATOM 1134 CA MET A 74 -7.816 -9.828 5.597 1.00 0.00 C ATOM 1135 C MET A 74 -6.913 -8.845 6.317 1.00 0.00 C ATOM 1136 O MET A 74 -5.694 -8.987 6.275 1.00 0.00 O ATOM 1137 CB MET A 74 -8.531 -9.161 4.412 1.00 0.00 C ATOM 1138 CG MET A 74 -7.627 -8.299 3.529 1.00 0.00 C ATOM 1139 SD MET A 74 -6.156 -9.128 2.917 1.00 0.00 S ATOM 1140 CE MET A 74 -6.931 -10.581 2.171 1.00 0.00 C ATOM 0 H MET A 74 -9.760 -10.041 6.336 1.00 0.00 H new ATOM 0 HA MET A 74 -7.204 -10.643 5.210 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.987 -9.936 3.796 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.341 -8.541 4.795 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.207 -7.944 2.677 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.322 -7.419 4.096 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.201 -11.107 1.556 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.290 -11.246 2.957 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.770 -10.267 1.550 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.496 -7.834 6.963 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.690 -6.801 7.601 1.00 0.00 C ATOM 1152 C LEU A 75 -5.770 -7.423 8.660 1.00 0.00 C ATOM 1153 O LEU A 75 -4.610 -7.047 8.764 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.590 -5.686 8.168 1.00 0.00 C ATOM 1155 CG LEU A 75 -7.069 -4.287 7.787 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -8.062 -3.215 8.229 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -5.699 -3.926 8.361 1.00 0.00 C ATOM 0 H LEU A 75 -8.504 -7.712 7.056 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.045 -6.333 6.857 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.606 -5.811 7.792 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -7.638 -5.774 9.253 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.959 -4.323 6.703 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.682 -2.231 7.954 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.021 -3.383 7.739 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.193 -3.264 9.310 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.421 -2.923 8.036 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.741 -3.956 9.450 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.956 -4.641 8.007 1.00 0.00 H new ATOM 1169 N ARG A 76 -6.258 -8.422 9.400 1.00 0.00 N ATOM 1170 CA ARG A 76 -5.541 -9.123 10.455 1.00 0.00 C ATOM 1171 C ARG A 76 -4.427 -9.977 9.878 1.00 0.00 C ATOM 1172 O ARG A 76 -3.342 -10.009 10.447 1.00 0.00 O ATOM 1173 CB ARG A 76 -6.559 -9.982 11.229 1.00 0.00 C ATOM 1174 CG ARG A 76 -7.491 -9.245 12.207 1.00 0.00 C ATOM 1175 CD ARG A 76 -7.465 -7.727 12.103 1.00 0.00 C ATOM 1176 NE ARG A 76 -8.381 -7.091 13.052 1.00 0.00 N ATOM 1177 CZ ARG A 76 -8.138 -6.747 14.316 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -6.920 -6.886 14.835 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -9.134 -6.240 15.026 1.00 0.00 N ATOM 0 H ARG A 76 -7.206 -8.776 9.270 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.071 -8.408 11.130 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -7.178 -10.510 10.504 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.009 -10.738 11.789 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.512 -9.588 12.040 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.222 -9.529 13.225 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.451 -7.370 12.284 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.731 -7.430 11.089 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.318 -6.887 12.703 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -6.162 -7.259 14.264 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -6.745 -6.619 15.804 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.054 -6.123 14.602 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -8.981 -5.967 15.997 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.689 -10.665 8.773 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.667 -11.381 8.025 1.00 0.00 C ATOM 1195 C PHE A 77 -2.537 -10.427 7.607 1.00 0.00 C ATOM 1196 O PHE A 77 -1.366 -10.698 7.869 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.311 -12.076 6.815 1.00 0.00 C ATOM 1198 CG PHE A 77 -3.300 -12.668 5.868 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -2.664 -13.882 6.178 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -2.954 -11.964 4.703 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -1.731 -14.428 5.283 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -1.969 -12.480 3.843 1.00 0.00 C ATOM 1203 CZ PHE A 77 -1.380 -13.726 4.116 1.00 0.00 C ATOM 0 H PHE A 77 -5.623 -10.741 8.370 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.219 -12.147 8.657 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.976 -12.865 7.168 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.928 -11.357 6.276 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.892 -14.393 7.102 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.443 -11.030 4.469 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.282 -15.388 5.491 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.665 -11.918 2.972 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.658 -14.144 3.430 1.00 0.00 H new ATOM 1213 N LEU A 78 -2.866 -9.293 6.978 1.00 0.00 N ATOM 1214 CA LEU A 78 -1.871 -8.292 6.588 1.00 0.00 C ATOM 1215 C LEU A 78 -1.116 -7.736 7.803 1.00 0.00 C ATOM 1216 O LEU A 78 0.059 -7.411 7.682 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.519 -7.138 5.808 1.00 0.00 C ATOM 1218 CG LEU A 78 -3.197 -7.530 4.483 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -3.894 -6.295 3.900 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -2.229 -8.124 3.455 1.00 0.00 C ATOM 0 H LEU A 78 -3.823 -9.046 6.727 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.154 -8.798 5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.261 -6.662 6.448 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.754 -6.391 5.597 1.00 0.00 H new ATOM 0 HG LEU A 78 -3.919 -8.316 4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.378 -6.560 2.960 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.643 -5.933 4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.157 -5.512 3.720 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.774 -8.377 2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.453 -7.395 3.222 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.770 -9.023 3.865 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.765 -7.625 8.967 1.00 0.00 N ATOM 1233 CA ASP A 79 -1.189 -7.173 10.246 1.00 0.00 C ATOM 1234 C ASP A 79 -0.153 -8.155 10.810 1.00 0.00 C ATOM 1235 O ASP A 79 0.493 -7.870 11.818 1.00 0.00 O ATOM 1236 CB ASP A 79 -2.337 -7.013 11.259 1.00 0.00 C ATOM 1237 CG ASP A 79 -2.125 -5.965 12.341 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -1.579 -4.877 12.057 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -2.765 -6.097 13.411 1.00 0.00 O ATOM 0 H ASP A 79 -2.754 -7.858 9.051 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.672 -6.230 10.069 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.247 -6.764 10.712 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.508 -7.976 11.741 1.00 0.00 H new ATOM 1244 N ASP A 80 -0.002 -9.319 10.176 1.00 0.00 N ATOM 1245 CA ASP A 80 1.038 -10.307 10.437 1.00 0.00 C ATOM 1246 C ASP A 80 2.045 -10.304 9.284 1.00 0.00 C ATOM 1247 O ASP A 80 3.256 -10.214 9.518 1.00 0.00 O ATOM 1248 CB ASP A 80 0.380 -11.689 10.610 1.00 0.00 C ATOM 1249 CG ASP A 80 1.395 -12.796 10.884 1.00 0.00 C ATOM 1250 OD1 ASP A 80 2.166 -13.158 9.971 1.00 0.00 O ATOM 1251 OD2 ASP A 80 1.364 -13.388 11.992 1.00 0.00 O ATOM 0 H ASP A 80 -0.635 -9.609 9.430 1.00 0.00 H new ATOM 0 HA ASP A 80 1.577 -10.064 11.353 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.335 -11.646 11.432 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -0.184 -11.934 9.710 1.00 0.00 H new ATOM 1256 N PHE A 81 1.550 -10.383 8.043 1.00 0.00 N ATOM 1257 CA PHE A 81 2.365 -10.503 6.841 1.00 0.00 C ATOM 1258 C PHE A 81 3.266 -9.283 6.633 1.00 0.00 C ATOM 1259 O PHE A 81 4.458 -9.451 6.375 1.00 0.00 O ATOM 1260 CB PHE A 81 1.468 -10.737 5.619 1.00 0.00 C ATOM 1261 CG PHE A 81 2.269 -10.926 4.345 1.00 0.00 C ATOM 1262 CD1 PHE A 81 2.941 -12.143 4.112 1.00 0.00 C ATOM 1263 CD2 PHE A 81 2.408 -9.864 3.430 1.00 0.00 C ATOM 1264 CE1 PHE A 81 3.751 -12.295 2.971 1.00 0.00 C ATOM 1265 CE2 PHE A 81 3.215 -10.021 2.291 1.00 0.00 C ATOM 1266 CZ PHE A 81 3.895 -11.230 2.064 1.00 0.00 C ATOM 0 H PHE A 81 0.549 -10.364 7.849 1.00 0.00 H new ATOM 0 HA PHE A 81 3.022 -11.363 6.968 1.00 0.00 H new ATOM 0 HB2 PHE A 81 0.848 -11.617 5.790 1.00 0.00 H new ATOM 0 HB3 PHE A 81 0.793 -9.890 5.499 1.00 0.00 H new ATOM 0 HD1 PHE A 81 2.834 -12.960 4.810 1.00 0.00 H new ATOM 0 HD2 PHE A 81 1.895 -8.930 3.604 1.00 0.00 H new ATOM 0 HE1 PHE A 81 4.262 -13.230 2.792 1.00 0.00 H new ATOM 0 HE2 PHE A 81 3.313 -9.209 1.586 1.00 0.00 H new ATOM 0 HZ PHE A 81 4.527 -11.341 1.195 1.00 0.00 H new ATOM 1276 N GLU A 82 2.731 -8.065 6.766 1.00 0.00 N ATOM 1277 CA GLU A 82 3.484 -6.819 6.601 1.00 0.00 C ATOM 1278 C GLU A 82 4.446 -6.584 7.784 1.00 0.00 C ATOM 1279 O GLU A 82 5.063 -5.526 7.880 1.00 0.00 O ATOM 1280 CB GLU A 82 2.520 -5.628 6.417 1.00 0.00 C ATOM 1281 CG GLU A 82 1.557 -5.738 5.219 1.00 0.00 C ATOM 1282 CD GLU A 82 2.222 -5.475 3.862 1.00 0.00 C ATOM 1283 OE1 GLU A 82 2.917 -4.443 3.685 1.00 0.00 O ATOM 1284 OE2 GLU A 82 1.996 -6.240 2.905 1.00 0.00 O ATOM 0 H GLU A 82 1.748 -7.916 6.995 1.00 0.00 H new ATOM 0 HA GLU A 82 4.093 -6.906 5.701 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.930 -5.516 7.327 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.110 -4.718 6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.116 -6.735 5.210 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.740 -5.030 5.356 1.00 0.00 H new ATOM 1291 N ASP A 83 4.578 -7.556 8.696 1.00 0.00 N ATOM 1292 CA ASP A 83 5.603 -7.634 9.739 1.00 0.00 C ATOM 1293 C ASP A 83 5.535 -6.479 10.741 1.00 0.00 C ATOM 1294 O ASP A 83 6.503 -6.156 11.433 1.00 0.00 O ATOM 1295 CB ASP A 83 7.001 -7.799 9.115 1.00 0.00 C ATOM 1296 CG ASP A 83 7.758 -8.925 9.796 1.00 0.00 C ATOM 1297 OD1 ASP A 83 7.531 -10.101 9.426 1.00 0.00 O ATOM 1298 OD2 ASP A 83 8.473 -8.672 10.788 1.00 0.00 O ATOM 0 H ASP A 83 3.938 -8.350 8.726 1.00 0.00 H new ATOM 0 HA ASP A 83 5.395 -8.527 10.329 1.00 0.00 H new ATOM 0 HB2 ASP A 83 6.908 -8.008 8.049 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.560 -6.868 9.209 1.00 0.00 H new ATOM 1303 N CYS A 84 4.382 -5.816 10.817 1.00 0.00 N ATOM 1304 CA CYS A 84 4.163 -4.764 11.789 1.00 0.00 C ATOM 1305 C CYS A 84 4.103 -5.381 13.200 1.00 0.00 C ATOM 1306 O CYS A 84 3.823 -6.579 13.329 1.00 0.00 O ATOM 1307 CB CYS A 84 2.910 -3.976 11.389 1.00 0.00 C ATOM 1308 SG CYS A 84 1.442 -5.004 11.301 1.00 0.00 S ATOM 0 H CYS A 84 3.584 -5.996 10.208 1.00 0.00 H new ATOM 0 HA CYS A 84 4.986 -4.049 11.808 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.745 -3.175 12.109 1.00 0.00 H new ATOM 0 HB3 CYS A 84 3.077 -3.504 10.421 1.00 0.00 H new ATOM 0 HG CYS A 84 1.743 -6.221 11.644 1.00 0.00 H new ATOM 1314 N PRO A 85 4.350 -4.618 14.277 1.00 0.00 N ATOM 1315 CA PRO A 85 4.801 -3.225 14.318 1.00 0.00 C ATOM 1316 C PRO A 85 6.276 -3.014 13.909 1.00 0.00 C ATOM 1317 O PRO A 85 6.738 -1.873 13.915 1.00 0.00 O ATOM 1318 CB PRO A 85 4.553 -2.776 15.762 1.00 0.00 C ATOM 1319 CG PRO A 85 4.753 -4.060 16.563 1.00 0.00 C ATOM 1320 CD PRO A 85 4.155 -5.113 15.636 1.00 0.00 C ATOM 0 HA PRO A 85 4.253 -2.635 13.583 1.00 0.00 H new ATOM 0 HB2 PRO A 85 5.252 -1.997 16.068 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.549 -2.372 15.892 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.806 -4.251 16.771 1.00 0.00 H new ATOM 0 HG3 PRO A 85 4.240 -4.025 17.524 1.00 0.00 H new ATOM 0 HD2 PRO A 85 4.646 -6.076 15.773 1.00 0.00 H new ATOM 0 HD3 PRO A 85 3.096 -5.262 15.848 1.00 0.00 H new ATOM 1328 N SER A 86 7.043 -4.074 13.642 1.00 0.00 N ATOM 1329 CA SER A 86 8.476 -3.999 13.369 1.00 0.00 C ATOM 1330 C SER A 86 8.774 -3.217 12.094 1.00 0.00 C ATOM 1331 O SER A 86 9.517 -2.233 12.135 1.00 0.00 O ATOM 1332 CB SER A 86 9.056 -5.414 13.267 1.00 0.00 C ATOM 1333 OG SER A 86 8.550 -6.221 14.325 1.00 0.00 O ATOM 0 H SER A 86 6.676 -5.025 13.609 1.00 0.00 H new ATOM 0 HA SER A 86 8.946 -3.466 14.195 1.00 0.00 H new ATOM 0 HB2 SER A 86 8.796 -5.855 12.305 1.00 0.00 H new ATOM 0 HB3 SER A 86 10.144 -5.375 13.316 1.00 0.00 H new ATOM 0 HG SER A 86 8.922 -7.125 14.254 1.00 0.00 H new ATOM 1339 N MET A 87 8.234 -3.676 10.961 1.00 0.00 N ATOM 1340 CA MET A 87 8.440 -3.013 9.692 1.00 0.00 C ATOM 1341 C MET A 87 7.509 -1.800 9.661 1.00 0.00 C ATOM 1342 O MET A 87 7.937 -0.673 9.914 1.00 0.00 O ATOM 1343 CB MET A 87 8.187 -3.990 8.536 1.00 0.00 C ATOM 1344 CG MET A 87 9.315 -4.994 8.306 1.00 0.00 C ATOM 1345 SD MET A 87 9.058 -6.173 6.941 1.00 0.00 S ATOM 1346 CE MET A 87 8.380 -5.137 5.614 1.00 0.00 C ATOM 0 H MET A 87 7.649 -4.510 10.908 1.00 0.00 H new ATOM 0 HA MET A 87 9.469 -2.674 9.575 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.264 -4.536 8.732 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.031 -3.419 7.620 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.235 -4.441 8.116 1.00 0.00 H new ATOM 0 HG3 MET A 87 9.467 -5.559 9.226 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.319 -5.718 4.694 1.00 0.00 H new ATOM 0 HE2 MET A 87 7.384 -4.794 5.893 1.00 0.00 H new ATOM 0 HE3 MET A 87 9.029 -4.276 5.457 1.00 0.00 H new ATOM 1356 N TYR A 88 6.236 -2.020 9.345 1.00 0.00 N ATOM 1357 CA TYR A 88 5.217 -0.982 9.326 1.00 0.00 C ATOM 1358 C TYR A 88 4.574 -0.862 10.699 1.00 0.00 C ATOM 1359 O TYR A 88 4.855 -1.663 11.581 1.00 0.00 O ATOM 1360 CB TYR A 88 4.196 -1.348 8.252 1.00 0.00 C ATOM 1361 CG TYR A 88 4.822 -1.330 6.879 1.00 0.00 C ATOM 1362 CD1 TYR A 88 5.179 -0.105 6.294 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.107 -2.537 6.220 1.00 0.00 C ATOM 1364 CE1 TYR A 88 5.767 -0.081 5.023 1.00 0.00 C ATOM 1365 CE2 TYR A 88 5.693 -2.523 4.946 1.00 0.00 C ATOM 1366 CZ TYR A 88 6.006 -1.288 4.335 1.00 0.00 C ATOM 1367 OH TYR A 88 6.497 -1.224 3.073 1.00 0.00 O ATOM 0 H TYR A 88 5.880 -2.942 9.091 1.00 0.00 H new ATOM 0 HA TYR A 88 5.652 -0.011 9.090 1.00 0.00 H new ATOM 0 HB2 TYR A 88 3.788 -2.338 8.456 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.362 -0.647 8.284 1.00 0.00 H new ATOM 0 HD1 TYR A 88 5.000 0.819 6.824 1.00 0.00 H new ATOM 0 HD2 TYR A 88 4.874 -3.478 6.696 1.00 0.00 H new ATOM 0 HE1 TYR A 88 6.037 0.862 4.570 1.00 0.00 H new ATOM 0 HE2 TYR A 88 5.904 -3.451 4.435 1.00 0.00 H new ATOM 0 HH TYR A 88 6.614 -2.131 2.721 1.00 0.00 H new ATOM 1377 N GLN A 89 3.688 0.113 10.890 1.00 0.00 N ATOM 1378 CA GLN A 89 2.901 0.266 12.117 1.00 0.00 C ATOM 1379 C GLN A 89 1.409 0.507 11.847 1.00 0.00 C ATOM 1380 O GLN A 89 0.589 0.312 12.743 1.00 0.00 O ATOM 1381 CB GLN A 89 3.545 1.363 12.980 1.00 0.00 C ATOM 1382 CG GLN A 89 4.657 0.815 13.892 1.00 0.00 C ATOM 1383 CD GLN A 89 6.008 1.511 13.726 1.00 0.00 C ATOM 1384 OE1 GLN A 89 6.338 2.434 14.470 1.00 0.00 O ATOM 1385 NE2 GLN A 89 6.853 1.062 12.811 1.00 0.00 N ATOM 0 H GLN A 89 3.492 0.829 10.190 1.00 0.00 H new ATOM 0 HA GLN A 89 2.921 -0.673 12.670 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.958 2.136 12.332 1.00 0.00 H new ATOM 0 HB3 GLN A 89 2.778 1.837 13.592 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.338 0.909 14.930 1.00 0.00 H new ATOM 0 HG3 GLN A 89 4.783 -0.249 13.692 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.578 0.297 12.195 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.779 1.481 12.722 1.00 0.00 H new ATOM 1394 N ARG A 90 1.072 0.801 10.587 1.00 0.00 N ATOM 1395 CA ARG A 90 -0.253 1.054 10.009 1.00 0.00 C ATOM 1396 C ARG A 90 -0.923 2.296 10.598 1.00 0.00 C ATOM 1397 O ARG A 90 -0.985 2.486 11.810 1.00 0.00 O ATOM 1398 CB ARG A 90 -1.106 -0.228 10.079 1.00 0.00 C ATOM 1399 CG ARG A 90 -2.528 -0.129 9.491 1.00 0.00 C ATOM 1400 CD ARG A 90 -3.629 0.242 10.501 1.00 0.00 C ATOM 1401 NE ARG A 90 -3.681 -0.687 11.639 1.00 0.00 N ATOM 1402 CZ ARG A 90 -4.653 -0.826 12.547 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -5.741 -0.057 12.513 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -4.543 -1.751 13.490 1.00 0.00 N ATOM 0 H ARG A 90 1.796 0.875 9.872 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.139 1.300 8.953 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -0.574 -1.023 9.557 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.187 -0.530 11.123 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.523 0.614 8.693 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -2.783 -1.085 9.035 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -3.455 1.253 10.869 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.595 0.248 9.996 1.00 0.00 H new ATOM 0 HE ARG A 90 -2.875 -1.302 11.750 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.842 0.651 11.786 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.472 -0.177 13.214 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -3.720 -2.353 13.521 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.281 -1.861 14.185 1.00 0.00 H new ATOM 1418 N THR A 91 -1.475 3.145 9.734 1.00 0.00 N ATOM 1419 CA THR A 91 -2.155 4.380 10.123 1.00 0.00 C ATOM 1420 C THR A 91 -3.341 4.620 9.192 1.00 0.00 C ATOM 1421 O THR A 91 -3.424 4.041 8.107 1.00 0.00 O ATOM 1422 CB THR A 91 -1.143 5.538 10.067 1.00 0.00 C ATOM 1423 OG1 THR A 91 -0.119 5.313 11.027 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.685 6.934 10.349 1.00 0.00 C ATOM 0 H THR A 91 -1.462 2.992 8.726 1.00 0.00 H new ATOM 0 HA THR A 91 -2.540 4.307 11.140 1.00 0.00 H new ATOM 0 HB THR A 91 -0.805 5.532 9.031 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.528 6.048 10.993 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.875 7.660 10.279 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.456 7.179 9.619 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.112 6.963 11.351 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.275 5.453 9.650 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.391 5.981 8.890 1.00 0.00 C ATOM 1434 C ALA A 92 -5.003 7.288 8.208 1.00 0.00 C ATOM 1435 O ALA A 92 -4.528 8.221 8.865 1.00 0.00 O ATOM 1436 CB ALA A 92 -6.564 6.190 9.835 1.00 0.00 C ATOM 0 H ALA A 92 -4.267 5.791 10.612 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.674 5.275 8.109 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.413 6.587 9.279 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.840 5.238 10.288 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.280 6.895 10.617 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.258 7.344 6.904 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.147 8.508 6.028 1.00 0.00 C ATOM 1444 C LEU A 93 -6.474 8.738 5.289 1.00 0.00 C ATOM 1445 O LEU A 93 -7.425 7.976 5.478 1.00 0.00 O ATOM 1446 CB LEU A 93 -3.918 8.346 5.107 1.00 0.00 C ATOM 1447 CG LEU A 93 -3.991 7.404 3.879 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -4.879 6.158 4.006 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -4.374 8.140 2.613 1.00 0.00 C ATOM 0 H LEU A 93 -5.570 6.518 6.394 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.973 9.416 6.605 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.655 9.338 4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.090 8.006 5.728 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.967 7.035 3.828 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.840 5.587 3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.521 5.538 4.828 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.907 6.462 4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.412 7.437 1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.353 8.602 2.743 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.634 8.912 2.403 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.551 9.783 4.469 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.737 10.187 3.716 1.00 0.00 C ATOM 1463 C GLN A 94 -7.435 10.076 2.212 1.00 0.00 C ATOM 1464 O GLN A 94 -6.415 10.586 1.741 1.00 0.00 O ATOM 1465 CB GLN A 94 -8.095 11.606 4.180 1.00 0.00 C ATOM 1466 CG GLN A 94 -9.330 12.236 3.537 1.00 0.00 C ATOM 1467 CD GLN A 94 -10.624 11.769 4.191 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -10.892 12.009 5.364 1.00 0.00 O ATOM 1469 NE2 GLN A 94 -11.446 11.081 3.432 1.00 0.00 N ATOM 0 H GLN A 94 -5.755 10.398 4.304 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.600 9.546 3.895 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -8.244 11.586 5.260 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -7.240 12.255 3.988 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -9.260 13.321 3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.351 11.987 2.476 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.205 10.892 2.459 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.326 10.736 3.815 1.00 0.00 H new ATOM 1478 N VAL A 95 -8.295 9.389 1.463 1.00 0.00 N ATOM 1479 CA VAL A 95 -8.132 8.995 0.063 1.00 0.00 C ATOM 1480 C VAL A 95 -9.318 9.584 -0.713 1.00 0.00 C ATOM 1481 O VAL A 95 -10.401 9.770 -0.153 1.00 0.00 O ATOM 1482 CB VAL A 95 -8.069 7.444 0.012 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -8.206 6.779 -1.363 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -6.764 6.907 0.636 1.00 0.00 C ATOM 0 H VAL A 95 -9.186 9.070 1.844 1.00 0.00 H new ATOM 0 HA VAL A 95 -7.215 9.371 -0.391 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.958 7.175 0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.144 5.696 -1.251 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.168 7.044 -1.801 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.403 7.123 -2.015 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.756 5.818 0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -5.909 7.304 0.089 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.704 7.219 1.679 1.00 0.00 H new ATOM 1494 N GLN A 96 -9.122 9.871 -1.998 1.00 0.00 N ATOM 1495 CA GLN A 96 -10.151 10.273 -2.944 1.00 0.00 C ATOM 1496 C GLN A 96 -10.720 9.001 -3.561 1.00 0.00 C ATOM 1497 O GLN A 96 -9.961 8.098 -3.914 1.00 0.00 O ATOM 1498 CB GLN A 96 -9.531 11.179 -4.023 1.00 0.00 C ATOM 1499 CG GLN A 96 -10.412 11.328 -5.267 1.00 0.00 C ATOM 1500 CD GLN A 96 -9.761 12.198 -6.324 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -8.706 11.858 -6.849 1.00 0.00 O ATOM 1502 NE2 GLN A 96 -10.367 13.313 -6.675 1.00 0.00 N ATOM 0 H GLN A 96 -8.196 9.826 -2.424 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.945 10.836 -2.453 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.346 12.165 -3.597 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.564 10.772 -4.318 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.618 10.343 -5.685 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -11.371 11.760 -4.982 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -11.244 13.580 -6.227 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -9.960 13.910 -7.395 1.00 0.00 H new ATOM 1511 N VAL A 97 -12.032 8.952 -3.746 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.726 7.922 -4.493 1.00 0.00 C ATOM 1513 C VAL A 97 -12.735 8.369 -5.963 1.00 0.00 C ATOM 1514 O VAL A 97 -13.081 9.506 -6.279 1.00 0.00 O ATOM 1515 CB VAL A 97 -14.125 7.707 -3.875 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -14.789 6.461 -4.464 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -14.045 7.494 -2.348 1.00 0.00 C ATOM 0 H VAL A 97 -12.662 9.657 -3.364 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.238 6.949 -4.447 1.00 0.00 H new ATOM 0 HB VAL A 97 -14.702 8.604 -4.100 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -15.773 6.327 -4.016 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -14.894 6.580 -5.542 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -14.173 5.587 -4.254 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -15.048 7.346 -1.948 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -13.436 6.615 -2.135 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.594 8.370 -1.882 1.00 0.00 H new ATOM 1527 N LEU A 98 -12.263 7.509 -6.865 1.00 0.00 N ATOM 1528 CA LEU A 98 -12.112 7.759 -8.303 1.00 0.00 C ATOM 1529 C LEU A 98 -13.292 7.150 -9.066 1.00 0.00 C ATOM 1530 O LEU A 98 -13.735 7.704 -10.072 1.00 0.00 O ATOM 1531 CB LEU A 98 -10.816 7.076 -8.800 1.00 0.00 C ATOM 1532 CG LEU A 98 -9.742 8.005 -9.373 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -9.248 8.983 -8.308 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -8.550 7.147 -9.819 1.00 0.00 C ATOM 0 H LEU A 98 -11.960 6.571 -6.602 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.074 8.835 -8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.381 6.520 -7.970 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.084 6.348 -9.566 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.167 8.566 -10.206 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.486 9.633 -8.737 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.083 9.587 -7.954 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.822 8.427 -7.473 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.773 7.790 -10.231 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.154 6.602 -8.963 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.876 6.439 -10.581 1.00 0.00 H new ATOM 1546 N GLU A 99 -13.758 5.991 -8.599 1.00 0.00 N ATOM 1547 CA GLU A 99 -14.914 5.198 -9.013 1.00 0.00 C ATOM 1548 C GLU A 99 -15.388 4.517 -7.729 1.00 0.00 C ATOM 1549 O GLU A 99 -14.556 4.268 -6.853 1.00 0.00 O ATOM 1550 CB GLU A 99 -14.497 4.144 -10.065 1.00 0.00 C ATOM 1551 CG GLU A 99 -14.635 4.682 -11.496 1.00 0.00 C ATOM 1552 CD GLU A 99 -13.558 4.168 -12.459 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -13.525 2.959 -12.793 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -12.683 4.966 -12.869 1.00 0.00 O ATOM 0 H GLU A 99 -13.274 5.531 -7.828 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.694 5.805 -9.473 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.465 3.842 -9.888 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -15.114 3.252 -9.951 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.616 4.408 -11.884 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.595 5.771 -11.470 1.00 0.00 H new ATOM 1561 N TRP A 100 -16.670 4.172 -7.619 1.00 0.00 N ATOM 1562 CA TRP A 100 -17.243 3.555 -6.431 1.00 0.00 C ATOM 1563 C TRP A 100 -18.254 2.505 -6.870 1.00 0.00 C ATOM 1564 O TRP A 100 -19.202 2.815 -7.601 1.00 0.00 O ATOM 1565 CB TRP A 100 -17.914 4.622 -5.565 1.00 0.00 C ATOM 1566 CG TRP A 100 -18.440 4.126 -4.257 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -19.748 4.008 -3.946 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -17.726 3.597 -3.082 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -19.873 3.521 -2.702 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -18.703 3.161 -2.146 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -16.395 3.386 -2.685 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -18.454 2.563 -0.914 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -16.109 2.839 -1.416 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -17.117 2.418 -0.527 1.00 0.00 C ATOM 0 H TRP A 100 -17.348 4.317 -8.367 1.00 0.00 H new ATOM 0 HA TRP A 100 -16.462 3.079 -5.838 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -17.196 5.419 -5.373 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.737 5.063 -6.128 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -20.569 4.266 -4.599 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -20.770 3.432 -2.224 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -15.587 3.644 -3.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -19.261 2.224 -0.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -15.077 2.739 -1.115 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -16.864 1.992 0.433 1.00 0.00 H new ATOM 1585 N GLU A 101 -18.053 1.268 -6.425 1.00 0.00 N ATOM 1586 CA GLU A 101 -18.881 0.125 -6.747 1.00 0.00 C ATOM 1587 C GLU A 101 -19.215 -0.577 -5.438 1.00 0.00 C ATOM 1588 O GLU A 101 -18.298 -1.157 -4.849 1.00 0.00 O ATOM 1589 CB GLU A 101 -18.107 -0.859 -7.655 1.00 0.00 C ATOM 1590 CG GLU A 101 -17.447 -0.218 -8.872 1.00 0.00 C ATOM 1591 CD GLU A 101 -16.957 -1.229 -9.919 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -16.865 -2.455 -9.676 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -16.642 -0.778 -11.040 1.00 0.00 O ATOM 0 H GLU A 101 -17.277 1.032 -5.807 1.00 0.00 H new ATOM 0 HA GLU A 101 -19.781 0.450 -7.269 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -17.339 -1.353 -7.060 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -18.794 -1.634 -7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -18.157 0.462 -9.342 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -16.602 0.384 -8.539 1.00 0.00 H new ATOM 1600 N GLY A 102 -20.459 -0.536 -4.934 1.00 0.00 N ATOM 1601 CA GLY A 102 -20.662 -1.372 -3.756 1.00 0.00 C ATOM 1602 C GLY A 102 -21.935 -1.268 -2.924 1.00 0.00 C ATOM 1603 O GLY A 102 -23.032 -1.666 -3.306 1.00 0.00 O ATOM 0 H GLY A 102 -21.254 0.003 -5.279 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -20.579 -2.408 -4.083 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -19.826 -1.182 -3.083 1.00 0.00 H new ATOM 1607 N ASP A 103 -21.668 -0.941 -1.658 1.00 0.00 N ATOM 1608 CA ASP A 103 -22.198 0.138 -0.830 1.00 0.00 C ATOM 1609 C ASP A 103 -21.693 1.343 -1.553 1.00 0.00 C ATOM 1610 O ASP A 103 -21.279 1.309 -2.705 1.00 0.00 O ATOM 1611 CB ASP A 103 -21.609 -0.012 0.587 1.00 0.00 C ATOM 1612 CG ASP A 103 -22.226 0.783 1.736 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -22.750 1.886 1.516 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -22.098 0.296 2.891 1.00 0.00 O ATOM 0 H ASP A 103 -20.994 -1.494 -1.128 1.00 0.00 H new ATOM 0 HA ASP A 103 -23.280 0.167 -0.698 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -21.659 -1.068 0.854 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -20.553 0.253 0.534 1.00 0.00 H new ATOM 1619 N GLY A 104 -21.996 2.470 -0.992 1.00 0.00 N ATOM 1620 CA GLY A 104 -23.186 3.015 -1.536 1.00 0.00 C ATOM 1621 C GLY A 104 -22.779 4.192 -2.343 1.00 0.00 C ATOM 1622 O GLY A 104 -22.788 4.217 -3.569 1.00 0.00 O ATOM 0 H GLY A 104 -21.508 2.975 -0.253 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -23.702 2.280 -2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -23.876 3.307 -0.745 1.00 0.00 H new ATOM 1626 N ASP A 105 -22.479 5.180 -1.532 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.761 6.418 -1.696 1.00 0.00 C ATOM 1628 C ASP A 105 -21.216 7.032 -0.391 1.00 0.00 C ATOM 1629 O ASP A 105 -21.970 7.698 0.309 1.00 0.00 O ATOM 1630 CB ASP A 105 -22.747 7.263 -2.403 1.00 0.00 C ATOM 1631 CG ASP A 105 -22.290 8.715 -2.560 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -21.213 8.933 -3.161 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -22.988 9.625 -2.059 1.00 0.00 O ATOM 0 H ASP A 105 -22.796 5.112 -0.565 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.830 6.291 -2.249 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.938 6.840 -3.389 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.691 7.242 -1.859 1.00 0.00 H new ATOM 1638 N PRO A 106 -20.003 6.689 0.081 1.00 0.00 N ATOM 1639 CA PRO A 106 -19.273 7.493 1.054 1.00 0.00 C ATOM 1640 C PRO A 106 -19.140 8.972 0.670 1.00 0.00 C ATOM 1641 O PRO A 106 -19.065 9.810 1.570 1.00 0.00 O ATOM 1642 CB PRO A 106 -17.867 6.889 1.155 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.945 5.530 0.469 1.00 0.00 C ATOM 1644 CD PRO A 106 -19.243 5.548 -0.334 1.00 0.00 C ATOM 0 HA PRO A 106 -19.827 7.472 1.992 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.131 7.530 0.669 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -17.561 6.784 2.196 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -17.085 5.369 -0.181 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -17.948 4.722 1.200 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -19.030 5.599 -1.402 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -19.808 4.631 -0.166 1.00 0.00 H new ATOM 1652 N GLY A 107 -19.092 9.293 -0.625 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.743 10.608 -1.145 1.00 0.00 C ATOM 1654 C GLY A 107 -17.390 10.561 -1.863 1.00 0.00 C ATOM 1655 O GLY A 107 -16.746 9.510 -1.933 1.00 0.00 O ATOM 0 H GLY A 107 -19.303 8.619 -1.361 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -19.515 10.949 -1.834 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.703 11.329 -0.329 1.00 0.00 H new ATOM 1659 N ASP A 108 -16.947 11.696 -2.403 1.00 0.00 N ATOM 1660 CA ASP A 108 -15.763 11.799 -3.268 1.00 0.00 C ATOM 1661 C ASP A 108 -14.466 11.515 -2.504 1.00 0.00 C ATOM 1662 O ASP A 108 -13.416 11.318 -3.116 1.00 0.00 O ATOM 1663 CB ASP A 108 -15.695 13.196 -3.898 1.00 0.00 C ATOM 1664 CG ASP A 108 -14.611 13.323 -4.981 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -14.775 12.765 -6.081 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -13.604 14.040 -4.748 1.00 0.00 O ATOM 0 H ASP A 108 -17.409 12.592 -2.250 1.00 0.00 H new ATOM 0 HA ASP A 108 -15.862 11.044 -4.048 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -16.664 13.438 -4.334 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -15.505 13.931 -3.116 1.00 0.00 H new ATOM 1671 N SER A 109 -14.501 11.457 -1.170 1.00 0.00 N ATOM 1672 CA SER A 109 -13.369 11.038 -0.361 1.00 0.00 C ATOM 1673 C SER A 109 -13.790 9.985 0.667 1.00 0.00 C ATOM 1674 O SER A 109 -14.970 9.856 1.008 1.00 0.00 O ATOM 1675 CB SER A 109 -12.692 12.255 0.279 1.00 0.00 C ATOM 1676 OG SER A 109 -13.615 13.115 0.914 1.00 0.00 O ATOM 0 H SER A 109 -15.326 11.703 -0.623 1.00 0.00 H new ATOM 0 HA SER A 109 -12.629 10.561 -1.004 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.956 11.916 1.008 1.00 0.00 H new ATOM 0 HB3 SER A 109 -12.150 12.810 -0.487 1.00 0.00 H new ATOM 0 HG SER A 109 -13.137 13.874 1.308 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.819 9.222 1.177 1.00 0.00 N ATOM 1683 CA VAL A 110 -13.028 8.209 2.195 1.00 0.00 C ATOM 1684 C VAL A 110 -11.760 8.047 3.038 1.00 0.00 C ATOM 1685 O VAL A 110 -10.642 8.191 2.535 1.00 0.00 O ATOM 1686 CB VAL A 110 -13.494 6.921 1.488 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -12.378 6.116 0.803 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -14.318 6.069 2.441 1.00 0.00 C ATOM 0 H VAL A 110 -11.846 9.300 0.881 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.806 8.492 2.904 1.00 0.00 H new ATOM 0 HB VAL A 110 -14.125 7.243 0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -12.804 5.229 0.334 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.898 6.733 0.043 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.639 5.814 1.545 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -14.642 5.162 1.931 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -13.712 5.802 3.307 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -15.192 6.632 2.770 1.00 0.00 H new ATOM 1698 N GLN A 111 -11.920 7.750 4.328 1.00 0.00 N ATOM 1699 CA GLN A 111 -10.791 7.434 5.206 1.00 0.00 C ATOM 1700 C GLN A 111 -10.525 5.931 5.102 1.00 0.00 C ATOM 1701 O GLN A 111 -11.439 5.126 4.946 1.00 0.00 O ATOM 1702 CB GLN A 111 -11.023 7.942 6.641 1.00 0.00 C ATOM 1703 CG GLN A 111 -9.904 7.503 7.610 1.00 0.00 C ATOM 1704 CD GLN A 111 -9.271 8.620 8.439 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -9.917 9.303 9.224 1.00 0.00 O ATOM 1706 NE2 GLN A 111 -7.961 8.790 8.325 1.00 0.00 N ATOM 0 H GLN A 111 -12.828 7.721 4.792 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.891 7.960 4.888 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.086 9.030 6.632 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -11.981 7.570 7.005 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.311 6.756 8.291 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -9.119 7.014 7.033 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -7.428 8.219 7.670 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -7.487 9.492 8.893 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.257 5.533 5.125 1.00 0.00 N ATOM 1716 CA CYS A 112 -8.805 4.157 5.014 1.00 0.00 C ATOM 1717 C CYS A 112 -7.473 3.986 5.734 1.00 0.00 C ATOM 1718 O CYS A 112 -6.830 4.965 6.110 1.00 0.00 O ATOM 1719 CB CYS A 112 -8.725 3.735 3.535 1.00 0.00 C ATOM 1720 SG CYS A 112 -8.541 5.120 2.416 1.00 0.00 S ATOM 0 H CYS A 112 -8.485 6.192 5.226 1.00 0.00 H new ATOM 0 HA CYS A 112 -9.527 3.498 5.497 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -7.883 3.055 3.403 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -9.626 3.181 3.272 1.00 0.00 H new ATOM 0 HG CYS A 112 -8.479 4.684 1.193 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.056 2.733 5.910 1.00 0.00 N ATOM 1727 CA PHE A 113 -5.740 2.400 6.430 1.00 0.00 C ATOM 1728 C PHE A 113 -4.752 2.208 5.279 1.00 0.00 C ATOM 1729 O PHE A 113 -5.159 1.817 4.180 1.00 0.00 O ATOM 1730 CB PHE A 113 -5.844 1.140 7.295 1.00 0.00 C ATOM 1731 CG PHE A 113 -6.654 1.328 8.564 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -6.192 2.210 9.557 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -7.858 0.628 8.765 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -6.918 2.390 10.745 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -8.569 0.791 9.966 1.00 0.00 C ATOM 1736 CZ PHE A 113 -8.101 1.666 10.958 1.00 0.00 C ATOM 0 H PHE A 113 -7.629 1.918 5.693 1.00 0.00 H new ATOM 0 HA PHE A 113 -5.369 3.216 7.050 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.294 0.342 6.704 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -4.840 0.811 7.562 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -5.271 2.753 9.404 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.235 -0.033 7.998 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -6.567 3.085 11.494 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -9.483 0.238 10.127 1.00 0.00 H new ATOM 0 HZ PHE A 113 -8.649 1.782 11.881 1.00 0.00 H new ATOM 1746 N VAL A 114 -3.472 2.478 5.558 1.00 0.00 N ATOM 1747 CA VAL A 114 -2.296 2.153 4.753 1.00 0.00 C ATOM 1748 C VAL A 114 -1.223 1.669 5.736 1.00 0.00 C ATOM 1749 O VAL A 114 -1.128 2.168 6.866 1.00 0.00 O ATOM 1750 CB VAL A 114 -1.834 3.389 3.941 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -0.457 3.253 3.268 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -2.805 3.682 2.790 1.00 0.00 C ATOM 0 H VAL A 114 -3.215 2.965 6.416 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.509 1.377 4.018 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.793 4.177 4.693 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.225 4.169 2.725 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.304 3.079 4.029 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -0.473 2.414 2.573 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.459 4.554 2.235 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -2.849 2.821 2.123 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.798 3.879 3.193 1.00 0.00 H new ATOM 1762 N TYR A 115 -0.393 0.717 5.307 1.00 0.00 N ATOM 1763 CA TYR A 115 0.766 0.256 6.059 1.00 0.00 C ATOM 1764 C TYR A 115 1.902 1.264 5.913 1.00 0.00 C ATOM 1765 O TYR A 115 2.679 1.226 4.959 1.00 0.00 O ATOM 1766 CB TYR A 115 1.151 -1.161 5.625 1.00 0.00 C ATOM 1767 CG TYR A 115 0.248 -2.190 6.272 1.00 0.00 C ATOM 1768 CD1 TYR A 115 0.538 -2.635 7.575 1.00 0.00 C ATOM 1769 CD2 TYR A 115 -0.923 -2.627 5.623 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -0.327 -3.523 8.232 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -1.807 -3.499 6.283 1.00 0.00 C ATOM 1772 CZ TYR A 115 -1.505 -3.953 7.588 1.00 0.00 C ATOM 1773 OH TYR A 115 -2.376 -4.758 8.247 1.00 0.00 O ATOM 0 H TYR A 115 -0.512 0.240 4.413 1.00 0.00 H new ATOM 0 HA TYR A 115 0.529 0.195 7.121 1.00 0.00 H new ATOM 0 HB2 TYR A 115 1.084 -1.244 4.540 1.00 0.00 H new ATOM 0 HB3 TYR A 115 2.188 -1.359 5.897 1.00 0.00 H new ATOM 0 HD1 TYR A 115 1.432 -2.291 8.073 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.142 -2.293 4.620 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -0.092 -3.875 9.225 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -2.715 -3.821 5.794 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.929 -4.218 8.850 1.00 0.00 H new ATOM 1783 N THR A 116 1.972 2.195 6.857 1.00 0.00 N ATOM 1784 CA THR A 116 2.980 3.241 6.935 1.00 0.00 C ATOM 1785 C THR A 116 4.015 2.938 8.018 1.00 0.00 C ATOM 1786 O THR A 116 3.884 1.968 8.768 1.00 0.00 O ATOM 1787 CB THR A 116 2.278 4.589 7.167 1.00 0.00 C ATOM 1788 OG1 THR A 116 1.198 4.475 8.071 1.00 0.00 O ATOM 1789 CG2 THR A 116 1.679 5.088 5.862 1.00 0.00 C ATOM 0 H THR A 116 1.298 2.242 7.621 1.00 0.00 H new ATOM 0 HA THR A 116 3.531 3.288 5.995 1.00 0.00 H new ATOM 0 HB THR A 116 3.034 5.266 7.565 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.388 5.001 8.876 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.183 6.043 6.031 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.471 5.216 5.124 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.954 4.363 5.494 1.00 0.00 H new ATOM 1797 N THR A 117 5.056 3.762 8.083 1.00 0.00 N ATOM 1798 CA THR A 117 6.118 3.729 9.077 1.00 0.00 C ATOM 1799 C THR A 117 6.316 5.167 9.573 1.00 0.00 C ATOM 1800 O THR A 117 6.138 6.124 8.808 1.00 0.00 O ATOM 1801 CB THR A 117 7.396 3.094 8.464 1.00 0.00 C ATOM 1802 OG1 THR A 117 8.536 3.387 9.247 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.690 3.557 7.030 1.00 0.00 C ATOM 0 H THR A 117 5.186 4.512 7.404 1.00 0.00 H new ATOM 0 HA THR A 117 5.866 3.103 9.933 1.00 0.00 H new ATOM 0 HB THR A 117 7.192 2.023 8.447 1.00 0.00 H new ATOM 0 HG1 THR A 117 9.327 2.975 8.841 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.597 3.071 6.670 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.854 3.291 6.383 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.828 4.638 7.018 1.00 0.00 H new ATOM 1811 N ALA A 118 6.709 5.317 10.841 1.00 0.00 N ATOM 1812 CA ALA A 118 7.190 6.571 11.414 1.00 0.00 C ATOM 1813 C ALA A 118 8.684 6.483 11.778 1.00 0.00 C ATOM 1814 O ALA A 118 9.249 7.473 12.242 1.00 0.00 O ATOM 1815 CB ALA A 118 6.357 6.916 12.654 1.00 0.00 C ATOM 0 H ALA A 118 6.700 4.549 11.512 1.00 0.00 H new ATOM 0 HA ALA A 118 7.079 7.359 10.669 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.714 7.852 13.084 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.310 7.023 12.371 1.00 0.00 H new ATOM 0 HB3 ALA A 118 6.454 6.118 13.391 1.00 0.00 H new ATOM 1821 N THR A 119 9.317 5.321 11.584 1.00 0.00 N ATOM 1822 CA THR A 119 10.554 4.902 12.244 1.00 0.00 C ATOM 1823 C THR A 119 11.735 4.826 11.268 1.00 0.00 C ATOM 1824 O THR A 119 12.738 4.158 11.522 1.00 0.00 O ATOM 1825 CB THR A 119 10.267 3.571 12.972 1.00 0.00 C ATOM 1826 OG1 THR A 119 9.548 2.646 12.165 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.381 3.848 14.183 1.00 0.00 C ATOM 0 H THR A 119 8.964 4.618 10.934 1.00 0.00 H new ATOM 0 HA THR A 119 10.865 5.646 12.977 1.00 0.00 H new ATOM 0 HB THR A 119 11.236 3.148 13.236 1.00 0.00 H new ATOM 0 HG1 THR A 119 9.791 1.731 12.420 1.00 0.00 H new ATOM 0 HG21 THR A 119 9.173 2.913 14.703 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.892 4.533 14.859 1.00 0.00 H new ATOM 0 HG23 THR A 119 8.444 4.296 13.853 1.00 0.00 H new ATOM 1835 N TYR A 120 11.590 5.482 10.121 1.00 0.00 N ATOM 1836 CA TYR A 120 12.473 5.388 8.974 1.00 0.00 C ATOM 1837 C TYR A 120 13.852 6.016 9.245 1.00 0.00 C ATOM 1838 O TYR A 120 13.998 6.876 10.123 1.00 0.00 O ATOM 1839 CB TYR A 120 11.748 6.042 7.783 1.00 0.00 C ATOM 1840 CG TYR A 120 11.181 7.418 8.108 1.00 0.00 C ATOM 1841 CD1 TYR A 120 12.031 8.532 8.065 1.00 0.00 C ATOM 1842 CD2 TYR A 120 9.856 7.570 8.570 1.00 0.00 C ATOM 1843 CE1 TYR A 120 11.609 9.769 8.577 1.00 0.00 C ATOM 1844 CE2 TYR A 120 9.412 8.821 9.043 1.00 0.00 C ATOM 1845 CZ TYR A 120 10.299 9.923 9.077 1.00 0.00 C ATOM 1846 OH TYR A 120 9.890 11.119 9.586 1.00 0.00 O ATOM 0 H TYR A 120 10.813 6.124 9.963 1.00 0.00 H new ATOM 0 HA TYR A 120 12.687 4.343 8.749 1.00 0.00 H new ATOM 0 HB2 TYR A 120 12.442 6.130 6.947 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.938 5.390 7.457 1.00 0.00 H new ATOM 0 HD1 TYR A 120 13.017 8.438 7.635 1.00 0.00 H new ATOM 0 HD2 TYR A 120 9.182 6.727 8.561 1.00 0.00 H new ATOM 0 HE1 TYR A 120 12.290 10.607 8.588 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.393 8.939 9.380 1.00 0.00 H new ATOM 0 HH TYR A 120 8.959 11.047 9.884 1.00 0.00 H new ATOM 1856 N ALA A 121 14.848 5.606 8.450 1.00 0.00 N ATOM 1857 CA ALA A 121 16.239 6.067 8.492 1.00 0.00 C ATOM 1858 C ALA A 121 16.375 7.491 7.924 1.00 0.00 C ATOM 1859 O ALA A 121 15.535 7.870 7.101 1.00 0.00 O ATOM 1860 CB ALA A 121 17.074 5.108 7.633 1.00 0.00 C ATOM 0 H ALA A 121 14.696 4.907 7.723 1.00 0.00 H new ATOM 0 HA ALA A 121 16.581 6.082 9.527 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.117 5.424 7.644 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.997 4.098 8.036 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.702 5.119 6.609 1.00 0.00 H new ATOM 1866 N PRO A 122 17.431 8.264 8.267 1.00 0.00 N ATOM 1867 CA PRO A 122 17.649 9.612 7.744 1.00 0.00 C ATOM 1868 C PRO A 122 17.617 9.675 6.222 1.00 0.00 C ATOM 1869 O PRO A 122 16.811 10.427 5.665 1.00 0.00 O ATOM 1870 CB PRO A 122 18.931 10.162 8.349 1.00 0.00 C ATOM 1871 CG PRO A 122 19.462 9.074 9.282 1.00 0.00 C ATOM 1872 CD PRO A 122 18.437 7.939 9.268 1.00 0.00 C ATOM 0 HA PRO A 122 16.819 10.252 8.044 1.00 0.00 H new ATOM 0 HB2 PRO A 122 19.658 10.398 7.572 1.00 0.00 H new ATOM 0 HB3 PRO A 122 18.739 11.085 8.896 1.00 0.00 H new ATOM 0 HG2 PRO A 122 20.436 8.719 8.946 1.00 0.00 H new ATOM 0 HG3 PRO A 122 19.595 9.462 10.292 1.00 0.00 H new ATOM 0 HD2 PRO A 122 18.920 6.991 9.031 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.977 7.827 10.250 1.00 0.00 H new ATOM 1880 N GLU A 123 18.431 8.842 5.576 1.00 0.00 N ATOM 1881 CA GLU A 123 18.589 8.732 4.131 1.00 0.00 C ATOM 1882 C GLU A 123 17.274 8.702 3.359 1.00 0.00 C ATOM 1883 O GLU A 123 17.200 9.246 2.260 1.00 0.00 O ATOM 1884 CB GLU A 123 19.527 7.573 3.717 1.00 0.00 C ATOM 1885 CG GLU A 123 19.683 6.403 4.708 1.00 0.00 C ATOM 1886 CD GLU A 123 20.857 6.684 5.649 1.00 0.00 C ATOM 1887 OE1 GLU A 123 20.725 7.572 6.507 1.00 0.00 O ATOM 1888 OE2 GLU A 123 21.961 6.107 5.442 1.00 0.00 O ATOM 0 H GLU A 123 19.032 8.189 6.079 1.00 0.00 H new ATOM 0 HA GLU A 123 19.078 9.662 3.839 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.167 7.168 2.771 1.00 0.00 H new ATOM 0 HB3 GLU A 123 20.516 7.990 3.529 1.00 0.00 H new ATOM 0 HG2 GLU A 123 18.766 6.274 5.282 1.00 0.00 H new ATOM 0 HG3 GLU A 123 19.853 5.473 4.165 1.00 0.00 H new ATOM 1895 N TRP A 124 16.215 8.122 3.924 1.00 0.00 N ATOM 1896 CA TRP A 124 15.004 7.826 3.173 1.00 0.00 C ATOM 1897 C TRP A 124 14.180 9.086 2.880 1.00 0.00 C ATOM 1898 O TRP A 124 13.180 9.016 2.170 1.00 0.00 O ATOM 1899 CB TRP A 124 14.224 6.726 3.899 1.00 0.00 C ATOM 1900 CG TRP A 124 14.909 5.387 4.012 1.00 0.00 C ATOM 1901 CD1 TRP A 124 16.171 5.068 3.633 1.00 0.00 C ATOM 1902 CD2 TRP A 124 14.342 4.142 4.511 1.00 0.00 C ATOM 1903 NE1 TRP A 124 16.425 3.740 3.904 1.00 0.00 N ATOM 1904 CE2 TRP A 124 15.331 3.116 4.460 1.00 0.00 C ATOM 1905 CE3 TRP A 124 13.066 3.778 4.972 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 15.072 1.797 4.871 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 12.792 2.468 5.391 1.00 0.00 C ATOM 1908 CH2 TRP A 124 13.791 1.478 5.354 1.00 0.00 C ATOM 0 H TRP A 124 16.176 7.848 4.906 1.00 0.00 H new ATOM 0 HA TRP A 124 15.269 7.447 2.186 1.00 0.00 H new ATOM 0 HB2 TRP A 124 13.991 7.078 4.904 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.274 6.582 3.384 1.00 0.00 H new ATOM 0 HD1 TRP A 124 16.875 5.754 3.184 1.00 0.00 H new ATOM 0 HE1 TRP A 124 17.314 3.277 3.716 1.00 0.00 H new ATOM 0 HE3 TRP A 124 12.282 4.520 5.004 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 15.843 1.043 4.817 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.803 2.216 5.746 1.00 0.00 H new ATOM 0 HH2 TRP A 124 13.574 0.477 5.695 1.00 0.00 H new ATOM 1919 N LEU A 125 14.595 10.254 3.380 1.00 0.00 N ATOM 1920 CA LEU A 125 14.016 11.543 3.016 1.00 0.00 C ATOM 1921 C LEU A 125 14.806 12.274 1.932 1.00 0.00 C ATOM 1922 O LEU A 125 14.296 13.275 1.417 1.00 0.00 O ATOM 1923 CB LEU A 125 13.950 12.432 4.258 1.00 0.00 C ATOM 1924 CG LEU A 125 12.955 11.925 5.311 1.00 0.00 C ATOM 1925 CD1 LEU A 125 13.195 12.735 6.580 1.00 0.00 C ATOM 1926 CD2 LEU A 125 11.495 12.060 4.865 1.00 0.00 C ATOM 0 H LEU A 125 15.353 10.328 4.058 1.00 0.00 H new ATOM 0 HA LEU A 125 13.023 11.342 2.614 1.00 0.00 H new ATOM 0 HB2 LEU A 125 14.942 12.495 4.705 1.00 0.00 H new ATOM 0 HB3 LEU A 125 13.670 13.442 3.960 1.00 0.00 H new ATOM 0 HG LEU A 125 13.120 10.860 5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.506 12.406 7.358 1.00 0.00 H new ATOM 0 HD12 LEU A 125 14.221 12.587 6.918 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.030 13.792 6.373 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.839 11.685 5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 125 11.269 13.109 4.673 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.338 11.482 3.954 1.00 0.00 H new ATOM 1938 N PHE A 126 16.032 11.849 1.611 1.00 0.00 N ATOM 1939 CA PHE A 126 16.819 12.468 0.547 1.00 0.00 C ATOM 1940 C PHE A 126 16.435 11.873 -0.809 1.00 0.00 C ATOM 1941 O PHE A 126 16.518 12.563 -1.825 1.00 0.00 O ATOM 1942 CB PHE A 126 18.329 12.315 0.818 1.00 0.00 C ATOM 1943 CG PHE A 126 18.794 12.681 2.224 1.00 0.00 C ATOM 1944 CD1 PHE A 126 18.340 13.848 2.868 1.00 0.00 C ATOM 1945 CD2 PHE A 126 19.665 11.819 2.914 1.00 0.00 C ATOM 1946 CE1 PHE A 126 18.708 14.119 4.198 1.00 0.00 C ATOM 1947 CE2 PHE A 126 19.996 12.063 4.260 1.00 0.00 C ATOM 1948 CZ PHE A 126 19.522 13.217 4.903 1.00 0.00 C ATOM 0 H PHE A 126 16.501 11.073 2.078 1.00 0.00 H new ATOM 0 HA PHE A 126 16.597 13.535 0.526 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.611 11.281 0.621 1.00 0.00 H new ATOM 0 HB3 PHE A 126 18.871 12.935 0.104 1.00 0.00 H new ATOM 0 HD1 PHE A 126 17.704 14.540 2.336 1.00 0.00 H new ATOM 0 HD2 PHE A 126 20.084 10.962 2.407 1.00 0.00 H new ATOM 0 HE1 PHE A 126 18.364 15.023 4.679 1.00 0.00 H new ATOM 0 HE2 PHE A 126 20.616 11.361 4.799 1.00 0.00 H new ATOM 0 HZ PHE A 126 19.781 13.410 5.933 1.00 0.00 H new ATOM 1958 N LEU A 127 16.016 10.601 -0.828 1.00 0.00 N ATOM 1959 CA LEU A 127 15.711 9.813 -2.026 1.00 0.00 C ATOM 1960 C LEU A 127 14.615 10.480 -2.873 1.00 0.00 C ATOM 1961 O LEU A 127 13.809 11.242 -2.328 1.00 0.00 O ATOM 1962 CB LEU A 127 15.287 8.382 -1.620 1.00 0.00 C ATOM 1963 CG LEU A 127 16.232 7.666 -0.639 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.767 6.232 -0.365 1.00 0.00 C ATOM 1965 CD2 LEU A 127 17.690 7.651 -1.111 1.00 0.00 C ATOM 0 H LEU A 127 15.874 10.070 0.032 1.00 0.00 H new ATOM 0 HA LEU A 127 16.612 9.760 -2.637 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.294 8.429 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 127 15.202 7.777 -2.523 1.00 0.00 H new ATOM 0 HG LEU A 127 16.191 8.244 0.284 1.00 0.00 H new ATOM 0 HD11 LEU A 127 16.455 5.753 0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 127 14.767 6.250 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.748 5.671 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 127 18.305 7.132 -0.376 1.00 0.00 H new ATOM 0 HD22 LEU A 127 17.757 7.136 -2.069 1.00 0.00 H new ATOM 0 HD23 LEU A 127 18.046 8.675 -1.224 1.00 0.00 H new ATOM 1977 N PRO A 128 14.550 10.207 -4.191 1.00 0.00 N ATOM 1978 CA PRO A 128 13.500 10.761 -5.037 1.00 0.00 C ATOM 1979 C PRO A 128 12.160 10.105 -4.695 1.00 0.00 C ATOM 1980 O PRO A 128 12.130 8.974 -4.198 1.00 0.00 O ATOM 1981 CB PRO A 128 13.927 10.456 -6.475 1.00 0.00 C ATOM 1982 CG PRO A 128 14.746 9.176 -6.334 1.00 0.00 C ATOM 1983 CD PRO A 128 15.421 9.335 -4.972 1.00 0.00 C ATOM 0 HA PRO A 128 13.368 11.833 -4.893 1.00 0.00 H new ATOM 0 HB2 PRO A 128 13.066 10.313 -7.128 1.00 0.00 H new ATOM 0 HB3 PRO A 128 14.518 11.267 -6.900 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.114 8.289 -6.368 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.478 9.077 -7.136 1.00 0.00 H new ATOM 0 HD2 PRO A 128 15.546 8.369 -4.483 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.415 9.769 -5.077 1.00 0.00 H new ATOM 1991 N TYR A 129 11.064 10.802 -4.992 1.00 0.00 N ATOM 1992 CA TYR A 129 9.707 10.325 -4.776 1.00 0.00 C ATOM 1993 C TYR A 129 9.036 9.903 -6.081 1.00 0.00 C ATOM 1994 O TYR A 129 9.455 10.307 -7.169 1.00 0.00 O ATOM 1995 CB TYR A 129 8.912 11.436 -4.086 1.00 0.00 C ATOM 1996 CG TYR A 129 9.431 11.799 -2.711 1.00 0.00 C ATOM 1997 CD1 TYR A 129 9.627 10.791 -1.750 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.728 13.136 -2.391 1.00 0.00 C ATOM 1999 CE1 TYR A 129 10.118 11.121 -0.477 1.00 0.00 C ATOM 2000 CE2 TYR A 129 10.175 13.472 -1.103 1.00 0.00 C ATOM 2001 CZ TYR A 129 10.382 12.462 -0.140 1.00 0.00 C ATOM 2002 OH TYR A 129 10.818 12.763 1.117 1.00 0.00 O ATOM 0 H TYR A 129 11.101 11.736 -5.399 1.00 0.00 H new ATOM 0 HA TYR A 129 9.737 9.437 -4.145 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.928 12.325 -4.716 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.871 11.125 -4.000 1.00 0.00 H new ATOM 0 HD1 TYR A 129 9.400 9.763 -1.991 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.612 13.907 -3.138 1.00 0.00 H new ATOM 0 HE1 TYR A 129 10.294 10.341 0.249 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.361 14.505 -0.849 1.00 0.00 H new ATOM 0 HH TYR A 129 10.956 13.730 1.192 1.00 0.00 H new ATOM 2012 N HIS A 130 7.967 9.109 -5.974 1.00 0.00 N ATOM 2013 CA HIS A 130 7.306 8.473 -7.112 1.00 0.00 C ATOM 2014 C HIS A 130 5.783 8.529 -6.950 1.00 0.00 C ATOM 2015 O HIS A 130 5.293 8.700 -5.832 1.00 0.00 O ATOM 2016 CB HIS A 130 7.798 7.021 -7.221 1.00 0.00 C ATOM 2017 CG HIS A 130 9.301 6.886 -7.134 1.00 0.00 C ATOM 2018 ND1 HIS A 130 10.218 7.316 -8.070 1.00 0.00 N ATOM 2019 CD2 HIS A 130 10.000 6.417 -6.054 1.00 0.00 C ATOM 2020 CE1 HIS A 130 11.442 7.088 -7.576 1.00 0.00 C ATOM 2021 NE2 HIS A 130 11.363 6.522 -6.361 1.00 0.00 N ATOM 0 H HIS A 130 7.531 8.888 -5.079 1.00 0.00 H new ATOM 0 HA HIS A 130 7.556 9.006 -8.029 1.00 0.00 H new ATOM 0 HB2 HIS A 130 7.341 6.430 -6.427 1.00 0.00 H new ATOM 0 HB3 HIS A 130 7.457 6.600 -8.167 1.00 0.00 H new ATOM 0 HD2 HIS A 130 9.579 6.036 -5.135 1.00 0.00 H new ATOM 0 HE1 HIS A 130 12.365 7.326 -8.084 1.00 0.00 H new ATOM 0 HE2 HIS A 130 12.144 6.226 -5.775 1.00 0.00 H new ATOM 2029 N GLU A 131 5.039 8.376 -8.053 1.00 0.00 N ATOM 2030 CA GLU A 131 3.610 8.729 -8.103 1.00 0.00 C ATOM 2031 C GLU A 131 2.666 7.525 -8.227 1.00 0.00 C ATOM 2032 O GLU A 131 1.442 7.640 -8.185 1.00 0.00 O ATOM 2033 CB GLU A 131 3.360 9.697 -9.262 1.00 0.00 C ATOM 2034 CG GLU A 131 2.349 10.794 -8.891 1.00 0.00 C ATOM 2035 CD GLU A 131 2.011 11.635 -10.120 1.00 0.00 C ATOM 2036 OE1 GLU A 131 2.785 12.570 -10.425 1.00 0.00 O ATOM 2037 OE2 GLU A 131 1.032 11.346 -10.846 1.00 0.00 O ATOM 0 H GLU A 131 5.405 8.007 -8.931 1.00 0.00 H new ATOM 0 HA GLU A 131 3.381 9.196 -7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 131 4.302 10.158 -9.558 1.00 0.00 H new ATOM 0 HB3 GLU A 131 2.992 9.142 -10.125 1.00 0.00 H new ATOM 0 HG2 GLU A 131 1.442 10.342 -8.489 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.762 11.430 -8.108 1.00 0.00 H new ATOM 2044 N SER A 132 3.237 6.348 -8.431 1.00 0.00 N ATOM 2045 CA SER A 132 2.556 5.064 -8.407 1.00 0.00 C ATOM 2046 C SER A 132 3.645 4.002 -8.302 1.00 0.00 C ATOM 2047 O SER A 132 4.807 4.275 -8.632 1.00 0.00 O ATOM 2048 CB SER A 132 1.688 4.933 -9.671 1.00 0.00 C ATOM 2049 OG SER A 132 1.069 3.670 -9.782 1.00 0.00 O ATOM 0 H SER A 132 4.234 6.259 -8.627 1.00 0.00 H new ATOM 0 HA SER A 132 1.876 4.952 -7.562 1.00 0.00 H new ATOM 0 HB2 SER A 132 0.922 5.708 -9.662 1.00 0.00 H new ATOM 0 HB3 SER A 132 2.307 5.107 -10.551 1.00 0.00 H new ATOM 0 HG SER A 132 0.529 3.641 -10.600 1.00 0.00 H new ATOM 2055 N TYR A 133 3.287 2.809 -7.834 1.00 0.00 N ATOM 2056 CA TYR A 133 4.185 1.668 -7.821 1.00 0.00 C ATOM 2057 C TYR A 133 3.817 0.714 -8.946 1.00 0.00 C ATOM 2058 O TYR A 133 2.648 0.567 -9.302 1.00 0.00 O ATOM 2059 CB TYR A 133 4.149 0.959 -6.466 1.00 0.00 C ATOM 2060 CG TYR A 133 5.224 -0.106 -6.384 1.00 0.00 C ATOM 2061 CD1 TYR A 133 6.560 0.301 -6.229 1.00 0.00 C ATOM 2062 CD2 TYR A 133 4.925 -1.464 -6.621 1.00 0.00 C ATOM 2063 CE1 TYR A 133 7.600 -0.633 -6.316 1.00 0.00 C ATOM 2064 CE2 TYR A 133 5.966 -2.406 -6.720 1.00 0.00 C ATOM 2065 CZ TYR A 133 7.311 -1.989 -6.577 1.00 0.00 C ATOM 2066 OH TYR A 133 8.325 -2.895 -6.637 1.00 0.00 O ATOM 0 H TYR A 133 2.362 2.611 -7.453 1.00 0.00 H new ATOM 0 HA TYR A 133 5.204 2.020 -7.979 1.00 0.00 H new ATOM 0 HB2 TYR A 133 4.290 1.686 -5.667 1.00 0.00 H new ATOM 0 HB3 TYR A 133 3.170 0.505 -6.314 1.00 0.00 H new ATOM 0 HD1 TYR A 133 6.786 1.340 -6.042 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.898 -1.781 -6.726 1.00 0.00 H new ATOM 0 HE1 TYR A 133 8.624 -0.315 -6.183 1.00 0.00 H new ATOM 0 HE2 TYR A 133 5.739 -3.446 -6.905 1.00 0.00 H new ATOM 0 HH TYR A 133 7.958 -3.784 -6.824 1.00 0.00 H new ATOM 2076 N ASP A 134 4.808 0.005 -9.462 1.00 0.00 N ATOM 2077 CA ASP A 134 4.675 -0.994 -10.499 1.00 0.00 C ATOM 2078 C ASP A 134 5.882 -1.932 -10.417 1.00 0.00 C ATOM 2079 O ASP A 134 6.871 -1.667 -9.727 1.00 0.00 O ATOM 2080 CB ASP A 134 4.601 -0.317 -11.887 1.00 0.00 C ATOM 2081 CG ASP A 134 5.754 0.633 -12.165 1.00 0.00 C ATOM 2082 OD1 ASP A 134 6.909 0.239 -11.928 1.00 0.00 O ATOM 2083 OD2 ASP A 134 5.488 1.723 -12.724 1.00 0.00 O ATOM 0 H ASP A 134 5.773 0.120 -9.151 1.00 0.00 H new ATOM 0 HA ASP A 134 3.756 -1.563 -10.359 1.00 0.00 H new ATOM 0 HB2 ASP A 134 4.583 -1.088 -12.657 1.00 0.00 H new ATOM 0 HB3 ASP A 134 3.663 0.232 -11.964 1.00 0.00 H new ATOM 2088 N SER A 135 5.804 -3.023 -11.170 1.00 0.00 N ATOM 2089 CA SER A 135 6.894 -3.940 -11.479 1.00 0.00 C ATOM 2090 C SER A 135 7.414 -3.709 -12.917 1.00 0.00 C ATOM 2091 O SER A 135 8.189 -4.517 -13.426 1.00 0.00 O ATOM 2092 CB SER A 135 6.341 -5.355 -11.277 1.00 0.00 C ATOM 2093 OG SER A 135 7.276 -6.290 -10.790 1.00 0.00 O ATOM 0 H SER A 135 4.927 -3.307 -11.606 1.00 0.00 H new ATOM 0 HA SER A 135 7.753 -3.779 -10.827 1.00 0.00 H new ATOM 0 HB2 SER A 135 5.502 -5.306 -10.583 1.00 0.00 H new ATOM 0 HB3 SER A 135 5.949 -5.716 -12.228 1.00 0.00 H new ATOM 0 HG SER A 135 6.843 -7.163 -10.689 1.00 0.00 H new ATOM 2099 N GLU A 136 6.980 -2.637 -13.601 1.00 0.00 N ATOM 2100 CA GLU A 136 7.174 -2.434 -15.047 1.00 0.00 C ATOM 2101 C GLU A 136 7.567 -0.986 -15.425 1.00 0.00 C ATOM 2102 O GLU A 136 7.643 -0.624 -16.599 1.00 0.00 O ATOM 2103 CB GLU A 136 5.879 -2.808 -15.778 1.00 0.00 C ATOM 2104 CG GLU A 136 5.359 -4.245 -15.595 1.00 0.00 C ATOM 2105 CD GLU A 136 4.054 -4.417 -16.378 1.00 0.00 C ATOM 2106 OE1 GLU A 136 3.997 -4.007 -17.559 1.00 0.00 O ATOM 2107 OE2 GLU A 136 3.011 -4.830 -15.815 1.00 0.00 O ATOM 0 H GLU A 136 6.474 -1.872 -13.155 1.00 0.00 H new ATOM 0 HA GLU A 136 8.005 -3.072 -15.347 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.097 -2.122 -15.453 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.031 -2.637 -16.844 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.103 -4.960 -15.945 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.192 -4.451 -14.538 1.00 0.00 H new ATOM 2114 N GLY A 137 7.768 -0.124 -14.436 1.00 0.00 N ATOM 2115 CA GLY A 137 8.062 1.298 -14.555 1.00 0.00 C ATOM 2116 C GLY A 137 9.568 1.565 -14.649 1.00 0.00 C ATOM 2117 O GLY A 137 10.351 0.619 -14.684 1.00 0.00 O ATOM 0 H GLY A 137 7.727 -0.422 -13.461 1.00 0.00 H new ATOM 0 HA2 GLY A 137 7.567 1.698 -15.440 1.00 0.00 H new ATOM 0 HA3 GLY A 137 7.653 1.826 -13.694 1.00 0.00 H new ATOM 2121 N PRO A 138 10.007 2.834 -14.582 1.00 0.00 N ATOM 2122 CA PRO A 138 11.413 3.237 -14.693 1.00 0.00 C ATOM 2123 C PRO A 138 12.294 2.871 -13.480 1.00 0.00 C ATOM 2124 O PRO A 138 13.452 3.284 -13.397 1.00 0.00 O ATOM 2125 CB PRO A 138 11.356 4.750 -14.923 1.00 0.00 C ATOM 2126 CG PRO A 138 10.093 5.179 -14.182 1.00 0.00 C ATOM 2127 CD PRO A 138 9.155 3.992 -14.361 1.00 0.00 C ATOM 0 HA PRO A 138 11.898 2.694 -15.504 1.00 0.00 H new ATOM 0 HB2 PRO A 138 12.241 5.249 -14.528 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.300 4.992 -15.984 1.00 0.00 H new ATOM 0 HG2 PRO A 138 10.293 5.377 -13.129 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.671 6.091 -14.603 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.530 3.853 -13.479 1.00 0.00 H new ATOM 0 HD3 PRO A 138 8.484 4.149 -15.206 1.00 0.00 H new ATOM 2135 N HIS A 139 11.748 2.131 -12.515 1.00 0.00 N ATOM 2136 CA HIS A 139 12.397 1.668 -11.308 1.00 0.00 C ATOM 2137 C HIS A 139 13.066 0.352 -11.683 1.00 0.00 C ATOM 2138 O HIS A 139 12.436 -0.694 -11.665 1.00 0.00 O ATOM 2139 CB HIS A 139 11.383 1.541 -10.153 1.00 0.00 C ATOM 2140 CG HIS A 139 10.343 2.633 -10.123 1.00 0.00 C ATOM 2141 ND1 HIS A 139 10.517 3.892 -9.599 1.00 0.00 N ATOM 2142 CD2 HIS A 139 9.075 2.564 -10.636 1.00 0.00 C ATOM 2143 CE1 HIS A 139 9.370 4.563 -9.783 1.00 0.00 C ATOM 2144 NE2 HIS A 139 8.463 3.801 -10.417 1.00 0.00 N ATOM 0 H HIS A 139 10.777 1.824 -12.568 1.00 0.00 H new ATOM 0 HA HIS A 139 13.144 2.369 -10.936 1.00 0.00 H new ATOM 0 HB2 HIS A 139 10.880 0.577 -10.230 1.00 0.00 H new ATOM 0 HB3 HIS A 139 11.924 1.543 -9.207 1.00 0.00 H new ATOM 0 HD2 HIS A 139 8.629 1.709 -11.122 1.00 0.00 H new ATOM 0 HE1 HIS A 139 9.198 5.580 -9.464 1.00 0.00 H new ATOM 0 HE2 HIS A 139 7.517 4.071 -10.685 1.00 0.00 H new ATOM 2152 N GLY A 140 14.320 0.404 -12.107 1.00 0.00 N ATOM 2153 CA GLY A 140 15.075 -0.777 -12.537 1.00 0.00 C ATOM 2154 C GLY A 140 15.079 -1.901 -11.500 1.00 0.00 C ATOM 2155 O GLY A 140 14.995 -3.078 -11.857 1.00 0.00 O ATOM 0 H GLY A 140 14.852 1.272 -12.165 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.650 -1.152 -13.468 1.00 0.00 H new ATOM 0 HA3 GLY A 140 16.103 -0.485 -12.750 1.00 0.00 H new ATOM 2159 N LEU A 141 15.136 -1.535 -10.228 1.00 0.00 N ATOM 2160 CA LEU A 141 14.927 -2.371 -9.062 1.00 0.00 C ATOM 2161 C LEU A 141 13.457 -2.785 -8.983 1.00 0.00 C ATOM 2162 O LEU A 141 12.593 -1.911 -8.872 1.00 0.00 O ATOM 2163 CB LEU A 141 15.393 -1.594 -7.807 1.00 0.00 C ATOM 2164 CG LEU A 141 14.657 -0.316 -7.354 1.00 0.00 C ATOM 2165 CD1 LEU A 141 15.419 0.310 -6.178 1.00 0.00 C ATOM 2166 CD2 LEU A 141 14.494 0.729 -8.443 1.00 0.00 C ATOM 0 H LEU A 141 15.346 -0.571 -9.968 1.00 0.00 H new ATOM 0 HA LEU A 141 15.513 -3.288 -9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 141 15.369 -2.292 -6.970 1.00 0.00 H new ATOM 0 HB3 LEU A 141 16.437 -1.324 -7.966 1.00 0.00 H new ATOM 0 HG LEU A 141 13.652 -0.627 -7.070 1.00 0.00 H new ATOM 0 HD11 LEU A 141 14.905 1.214 -5.852 1.00 0.00 H new ATOM 0 HD12 LEU A 141 15.462 -0.401 -5.353 1.00 0.00 H new ATOM 0 HD13 LEU A 141 16.432 0.562 -6.493 1.00 0.00 H new ATOM 0 HD21 LEU A 141 13.967 1.594 -8.041 1.00 0.00 H new ATOM 0 HD22 LEU A 141 15.476 1.037 -8.802 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.922 0.307 -9.269 1.00 0.00 H new ATOM 2178 N ARG A 142 13.131 -4.084 -9.025 1.00 0.00 N ATOM 2179 CA ARG A 142 11.774 -4.560 -8.689 1.00 0.00 C ATOM 2180 C ARG A 142 11.783 -5.340 -7.373 1.00 0.00 C ATOM 2181 O ARG A 142 12.854 -5.768 -6.958 1.00 0.00 O ATOM 2182 CB ARG A 142 11.143 -5.423 -9.799 1.00 0.00 C ATOM 2183 CG ARG A 142 11.586 -5.186 -11.249 1.00 0.00 C ATOM 2184 CD ARG A 142 11.637 -3.755 -11.794 1.00 0.00 C ATOM 2185 NE ARG A 142 10.604 -2.856 -11.262 1.00 0.00 N ATOM 2186 CZ ARG A 142 9.932 -1.935 -11.956 1.00 0.00 C ATOM 2187 NH1 ARG A 142 10.095 -1.808 -13.273 1.00 0.00 N ATOM 2188 NH2 ARG A 142 9.097 -1.153 -11.288 1.00 0.00 N ATOM 0 H ARG A 142 13.782 -4.824 -9.287 1.00 0.00 H new ATOM 0 HA ARG A 142 11.158 -3.667 -8.584 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.339 -6.468 -9.559 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.063 -5.283 -9.755 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.582 -5.615 -11.361 1.00 0.00 H new ATOM 0 HG3 ARG A 142 10.918 -5.758 -11.893 1.00 0.00 H new ATOM 0 HD2 ARG A 142 12.617 -3.331 -11.572 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.544 -3.791 -12.879 1.00 0.00 H new ATOM 0 HE ARG A 142 10.380 -2.944 -10.271 1.00 0.00 H new ATOM 0 HH11 ARG A 142 10.743 -2.421 -13.768 1.00 0.00 H new ATOM 0 HH12 ARG A 142 9.572 -1.098 -13.785 1.00 0.00 H new ATOM 0 HH21 ARG A 142 8.987 -1.267 -10.280 1.00 0.00 H new ATOM 0 HH22 ARG A 142 8.564 -0.436 -11.781 1.00 0.00 H new ATOM 2202 N TYR A 143 10.622 -5.562 -6.736 1.00 0.00 N ATOM 2203 CA TYR A 143 10.557 -6.296 -5.457 1.00 0.00 C ATOM 2204 C TYR A 143 11.234 -7.660 -5.600 1.00 0.00 C ATOM 2205 O TYR A 143 11.016 -8.339 -6.607 1.00 0.00 O ATOM 2206 CB TYR A 143 9.100 -6.506 -5.014 1.00 0.00 C ATOM 2207 CG TYR A 143 8.884 -7.307 -3.734 1.00 0.00 C ATOM 2208 CD1 TYR A 143 9.563 -6.982 -2.541 1.00 0.00 C ATOM 2209 CD2 TYR A 143 7.981 -8.389 -3.738 1.00 0.00 C ATOM 2210 CE1 TYR A 143 9.368 -7.757 -1.380 1.00 0.00 C ATOM 2211 CE2 TYR A 143 7.750 -9.132 -2.568 1.00 0.00 C ATOM 2212 CZ TYR A 143 8.475 -8.851 -1.391 1.00 0.00 C ATOM 2213 OH TYR A 143 8.257 -9.590 -0.268 1.00 0.00 O ATOM 0 H TYR A 143 9.716 -5.246 -7.083 1.00 0.00 H new ATOM 0 HA TYR A 143 11.074 -5.701 -4.704 1.00 0.00 H new ATOM 0 HB2 TYR A 143 8.639 -5.527 -4.885 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.567 -7.006 -5.823 1.00 0.00 H new ATOM 0 HD1 TYR A 143 10.235 -6.136 -2.517 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.462 -8.649 -4.649 1.00 0.00 H new ATOM 0 HE1 TYR A 143 9.905 -7.512 -0.476 1.00 0.00 H new ATOM 0 HE2 TYR A 143 7.014 -9.922 -2.570 1.00 0.00 H new ATOM 0 HH TYR A 143 7.611 -10.300 -0.464 1.00 0.00 H new ATOM 2223 N ASN A 144 11.984 -8.095 -4.584 1.00 0.00 N ATOM 2224 CA ASN A 144 12.793 -9.310 -4.647 1.00 0.00 C ATOM 2225 C ASN A 144 12.351 -10.293 -3.561 1.00 0.00 C ATOM 2226 O ASN A 144 13.015 -10.412 -2.526 1.00 0.00 O ATOM 2227 CB ASN A 144 14.298 -8.951 -4.648 1.00 0.00 C ATOM 2228 CG ASN A 144 14.840 -8.992 -6.072 1.00 0.00 C ATOM 2229 OD1 ASN A 144 14.131 -8.698 -7.023 1.00 0.00 O ATOM 2230 ND2 ASN A 144 16.074 -9.413 -6.271 1.00 0.00 N ATOM 0 H ASN A 144 12.046 -7.609 -3.689 1.00 0.00 H new ATOM 0 HA ASN A 144 12.630 -9.837 -5.587 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.444 -7.958 -4.222 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.848 -9.651 -4.020 1.00 0.00 H new ATOM 0 HD21 ASN A 144 16.438 -9.494 -7.220 1.00 0.00 H new ATOM 0 HD22 ASN A 144 16.664 -9.658 -5.476 1.00 0.00 H new ATOM 2237 N PRO A 145 11.229 -11.010 -3.778 1.00 0.00 N ATOM 2238 CA PRO A 145 10.661 -11.926 -2.795 1.00 0.00 C ATOM 2239 C PRO A 145 11.482 -13.203 -2.614 1.00 0.00 C ATOM 2240 O PRO A 145 11.561 -13.719 -1.500 1.00 0.00 O ATOM 2241 CB PRO A 145 9.255 -12.252 -3.304 1.00 0.00 C ATOM 2242 CG PRO A 145 9.312 -12.000 -4.807 1.00 0.00 C ATOM 2243 CD PRO A 145 10.343 -10.890 -4.932 1.00 0.00 C ATOM 0 HA PRO A 145 10.653 -11.460 -1.810 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.986 -13.286 -3.087 1.00 0.00 H new ATOM 0 HB3 PRO A 145 8.506 -11.621 -2.826 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.613 -12.893 -5.354 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.343 -11.696 -5.202 1.00 0.00 H new ATOM 0 HD2 PRO A 145 10.903 -10.985 -5.862 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.860 -9.913 -4.949 1.00 0.00 H new ATOM 2251 N ARG A 146 12.040 -13.766 -3.694 1.00 0.00 N ATOM 2252 CA ARG A 146 12.697 -15.070 -3.642 1.00 0.00 C ATOM 2253 C ARG A 146 13.778 -15.228 -4.706 1.00 0.00 C ATOM 2254 O ARG A 146 14.109 -16.358 -5.062 1.00 0.00 O ATOM 2255 CB ARG A 146 11.630 -16.166 -3.796 1.00 0.00 C ATOM 2256 CG ARG A 146 12.054 -17.481 -3.122 1.00 0.00 C ATOM 2257 CD ARG A 146 11.416 -18.664 -3.864 1.00 0.00 C ATOM 2258 NE ARG A 146 11.178 -19.837 -3.000 1.00 0.00 N ATOM 2259 CZ ARG A 146 11.258 -21.132 -3.342 1.00 0.00 C ATOM 2260 NH1 ARG A 146 11.703 -21.530 -4.526 1.00 0.00 N ATOM 2261 NH2 ARG A 146 10.848 -22.076 -2.509 1.00 0.00 N ATOM 0 H ARG A 146 12.047 -13.332 -4.617 1.00 0.00 H new ATOM 0 HA ARG A 146 13.200 -15.158 -2.679 1.00 0.00 H new ATOM 0 HB2 ARG A 146 10.691 -15.822 -3.361 1.00 0.00 H new ATOM 0 HB3 ARG A 146 11.444 -16.345 -4.855 1.00 0.00 H new ATOM 0 HG2 ARG A 146 13.140 -17.574 -3.133 1.00 0.00 H new ATOM 0 HG3 ARG A 146 11.744 -17.483 -2.077 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.469 -18.343 -4.298 1.00 0.00 H new ATOM 0 HD3 ARG A 146 12.063 -18.956 -4.691 1.00 0.00 H new ATOM 0 HE ARG A 146 10.924 -19.641 -2.032 1.00 0.00 H new ATOM 0 HH11 ARG A 146 12.001 -20.841 -5.217 1.00 0.00 H new ATOM 0 HH12 ARG A 146 11.748 -22.525 -4.746 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.467 -21.822 -1.598 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.913 -23.058 -2.779 1.00 0.00 H new ATOM 2275 N GLU A 147 14.305 -14.141 -5.263 1.00 0.00 N ATOM 2276 CA GLU A 147 15.344 -14.220 -6.281 1.00 0.00 C ATOM 2277 C GLU A 147 16.559 -14.943 -5.711 1.00 0.00 C ATOM 2278 O GLU A 147 16.962 -15.998 -6.194 1.00 0.00 O ATOM 2279 CB GLU A 147 15.717 -12.826 -6.792 1.00 0.00 C ATOM 2280 CG GLU A 147 14.679 -12.249 -7.765 1.00 0.00 C ATOM 2281 CD GLU A 147 15.334 -11.619 -9.004 1.00 0.00 C ATOM 2282 OE1 GLU A 147 15.833 -10.475 -8.934 1.00 0.00 O ATOM 2283 OE2 GLU A 147 15.331 -12.280 -10.072 1.00 0.00 O ATOM 0 H GLU A 147 14.026 -13.190 -5.023 1.00 0.00 H new ATOM 0 HA GLU A 147 14.966 -14.786 -7.133 1.00 0.00 H new ATOM 0 HB2 GLU A 147 15.827 -12.151 -5.943 1.00 0.00 H new ATOM 0 HB3 GLU A 147 16.686 -12.874 -7.289 1.00 0.00 H new ATOM 0 HG2 GLU A 147 13.998 -13.040 -8.079 1.00 0.00 H new ATOM 0 HG3 GLU A 147 14.080 -11.498 -7.251 1.00 0.00 H new ATOM 2290 N ASN A 148 17.084 -14.412 -4.614 1.00 0.00 N ATOM 2291 CA ASN A 148 18.335 -14.854 -4.000 1.00 0.00 C ATOM 2292 C ASN A 148 18.097 -15.389 -2.581 1.00 0.00 C ATOM 2293 O ASN A 148 19.050 -15.633 -1.844 1.00 0.00 O ATOM 2294 CB ASN A 148 19.348 -13.694 -4.063 1.00 0.00 C ATOM 2295 CG ASN A 148 19.551 -13.244 -5.508 1.00 0.00 C ATOM 2296 OD1 ASN A 148 19.846 -14.056 -6.381 1.00 0.00 O ATOM 2297 ND2 ASN A 148 19.314 -11.989 -5.849 1.00 0.00 N ATOM 0 H ASN A 148 16.642 -13.642 -4.112 1.00 0.00 H new ATOM 0 HA ASN A 148 18.756 -15.695 -4.552 1.00 0.00 H new ATOM 0 HB2 ASN A 148 18.991 -12.858 -3.462 1.00 0.00 H new ATOM 0 HB3 ASN A 148 20.300 -14.010 -3.636 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.377 -11.706 -6.827 1.00 0.00 H new ATOM 0 HD22 ASN A 148 19.068 -11.304 -5.134 1.00 0.00 H new ATOM 2304 N ARG A 149 16.820 -15.558 -2.205 1.00 0.00 N ATOM 2305 CA ARG A 149 16.342 -15.425 -0.832 1.00 0.00 C ATOM 2306 C ARG A 149 16.929 -14.165 -0.189 1.00 0.00 C ATOM 2307 O ARG A 149 17.431 -13.289 -0.914 1.00 0.00 O ATOM 2308 CB ARG A 149 16.591 -16.723 -0.032 1.00 0.00 C ATOM 2309 CG ARG A 149 15.534 -16.978 1.058 1.00 0.00 C ATOM 2310 CD ARG A 149 14.223 -17.473 0.432 1.00 0.00 C ATOM 2311 NE ARG A 149 13.021 -16.984 1.131 1.00 0.00 N ATOM 2312 CZ ARG A 149 12.555 -17.350 2.329 1.00 0.00 C ATOM 2313 NH1 ARG A 149 13.250 -18.161 3.122 1.00 0.00 N ATOM 2314 NH2 ARG A 149 11.376 -16.884 2.716 1.00 0.00 N ATOM 0 H ARG A 149 16.080 -15.796 -2.866 1.00 0.00 H new ATOM 0 HA ARG A 149 15.260 -15.290 -0.829 1.00 0.00 H new ATOM 0 HB2 ARG A 149 16.605 -17.569 -0.720 1.00 0.00 H new ATOM 0 HB3 ARG A 149 17.576 -16.673 0.432 1.00 0.00 H new ATOM 0 HG2 ARG A 149 15.906 -17.717 1.768 1.00 0.00 H new ATOM 0 HG3 ARG A 149 15.353 -16.061 1.618 1.00 0.00 H new ATOM 0 HD2 ARG A 149 14.183 -17.155 -0.610 1.00 0.00 H new ATOM 0 HD3 ARG A 149 14.217 -18.563 0.433 1.00 0.00 H new ATOM 0 HE ARG A 149 12.476 -16.277 0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 149 14.157 -18.516 2.819 1.00 0.00 H new ATOM 0 HH12 ARG A 149 12.876 -18.428 4.033 1.00 0.00 H new ATOM 0 HH21 ARG A 149 10.848 -16.262 2.104 1.00 0.00 H new ATOM 0 HH22 ARG A 149 10.997 -17.148 3.626 1.00 0.00 H new TER 2328 ARG A 149