USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 740 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 74 LYS NZ :NH3+ 168:sc= -0.768 (180deg=-0.807) USER MOD Set 1.2: A 99 THR OG1 : rot 180:sc= -0.247 USER MOD Set 2.1: A 68 SER OG : rot -71:sc= -0.284 USER MOD Set 2.2: A 71 GLN : amide:sc= 0.457 K(o=0.17,f=-3.2!) USER MOD Set 3.1: A 26 HIS : no HD1:sc= -0.562 X(o=-0.57,f=-0.68) USER MOD Set 3.2: A 40 SER OG : rot 180:sc=-0.00774 USER MOD Single : A 4 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.28) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.00454 USER MOD Single : A 15 THR OG1 : rot 94:sc= 0.0862 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.908 K(o=-0.91,f=-2!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.766 USER MOD Single : A 30 THR OG1 : rot 73:sc= 0.789 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.75 X(o=-0.75,f=-1) USER MOD Single : A 67 MET CE :methyl -156:sc= -1.89 (180deg=-3.88!) USER MOD Single : A 77 CYS SG : rot 140:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0.105 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 12:sc= 1.67 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -0.684 X(o=-0.68,f=-0.22) USER MOD Single : A 95 ASN : amide:sc= -2.12 X(o=-2.1,f=-2.6!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0123 USER MOD ----------------------------------------------------------------- ATOM 18 N GLY A 2 1.156 -0.610 -3.250 1.00 0.00 N ATOM 19 CA GLY A 2 0.598 -1.348 -4.369 1.00 0.00 C ATOM 20 C GLY A 2 -0.914 -1.258 -4.427 1.00 0.00 C ATOM 21 O GLY A 2 -1.520 -1.535 -5.462 1.00 0.00 O ATOM 0 HA2 GLY A 2 1.018 -0.964 -5.299 1.00 0.00 H new ATOM 0 HA3 GLY A 2 0.894 -2.394 -4.294 1.00 0.00 H new ATOM 25 N VAL A 3 -1.525 -0.872 -3.311 1.00 0.00 N ATOM 26 CA VAL A 3 -2.976 -0.746 -3.239 1.00 0.00 C ATOM 27 C VAL A 3 -3.385 0.355 -2.268 1.00 0.00 C ATOM 28 O VAL A 3 -2.987 0.348 -1.104 1.00 0.00 O ATOM 29 CB VAL A 3 -3.633 -2.070 -2.803 1.00 0.00 C ATOM 30 CG1 VAL A 3 -3.038 -2.554 -1.490 1.00 0.00 C ATOM 31 CG2 VAL A 3 -5.140 -1.903 -2.685 1.00 0.00 C ATOM 0 H VAL A 3 -1.038 -0.641 -2.445 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.321 -0.489 -4.240 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.432 -2.823 -3.565 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.514 -3.490 -1.198 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -1.967 -2.715 -1.613 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.206 -1.805 -0.716 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.588 -2.848 -2.376 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.364 -1.136 -1.944 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.550 -1.606 -3.650 1.00 0.00 H new ATOM 41 N GLN A 4 -4.182 1.301 -2.756 1.00 0.00 N ATOM 42 CA GLN A 4 -4.645 2.410 -1.930 1.00 0.00 C ATOM 43 C GLN A 4 -6.163 2.384 -1.785 1.00 0.00 C ATOM 44 O GLN A 4 -6.883 2.089 -2.739 1.00 0.00 O ATOM 45 CB GLN A 4 -4.201 3.743 -2.535 1.00 0.00 C ATOM 46 CG GLN A 4 -3.488 4.652 -1.546 1.00 0.00 C ATOM 47 CD GLN A 4 -2.330 3.964 -0.851 1.00 0.00 C ATOM 48 OE1 GLN A 4 -2.218 3.997 0.374 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.459 3.336 -1.633 1.00 0.00 N ATOM 0 H GLN A 4 -4.520 1.321 -3.718 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.202 2.303 -0.940 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -3.539 3.547 -3.378 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.074 4.263 -2.929 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -3.120 5.534 -2.070 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -4.201 4.999 -0.798 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.591 3.334 -2.644 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.658 2.856 -1.222 1.00 0.00 H new ATOM 58 N VAL A 5 -6.643 2.694 -0.585 1.00 0.00 N ATOM 59 CA VAL A 5 -8.075 2.708 -0.314 1.00 0.00 C ATOM 60 C VAL A 5 -8.540 4.093 0.119 1.00 0.00 C ATOM 61 O VAL A 5 -8.052 4.643 1.107 1.00 0.00 O ATOM 62 CB VAL A 5 -8.450 1.688 0.777 1.00 0.00 C ATOM 63 CG1 VAL A 5 -7.639 1.934 2.040 1.00 0.00 C ATOM 64 CG2 VAL A 5 -9.942 1.747 1.071 1.00 0.00 C ATOM 0 H VAL A 5 -6.060 2.939 0.215 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.575 2.435 -1.243 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.214 0.688 0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -7.918 1.204 2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.577 1.836 1.815 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -7.840 2.939 2.412 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.190 1.020 1.844 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.206 2.747 1.416 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -10.501 1.517 0.164 1.00 0.00 H new ATOM 74 N VAL A 6 -9.487 4.654 -0.626 1.00 0.00 N ATOM 75 CA VAL A 6 -10.020 5.976 -0.318 1.00 0.00 C ATOM 76 C VAL A 6 -11.493 5.899 0.068 1.00 0.00 C ATOM 77 O VAL A 6 -12.352 5.615 -0.768 1.00 0.00 O ATOM 78 CB VAL A 6 -9.863 6.937 -1.511 1.00 0.00 C ATOM 79 CG1 VAL A 6 -10.092 8.375 -1.073 1.00 0.00 C ATOM 80 CG2 VAL A 6 -8.490 6.776 -2.147 1.00 0.00 C ATOM 0 H VAL A 6 -9.901 4.213 -1.447 1.00 0.00 H new ATOM 0 HA VAL A 6 -9.446 6.359 0.526 1.00 0.00 H new ATOM 0 HB VAL A 6 -10.616 6.687 -2.258 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -9.977 9.039 -1.930 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.099 8.476 -0.668 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -9.365 8.642 -0.306 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -8.396 7.462 -2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -7.719 6.998 -1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.370 5.752 -2.499 1.00 0.00 H new ATOM 90 N THR A 7 -11.780 6.153 1.341 1.00 0.00 N ATOM 91 CA THR A 7 -13.149 6.112 1.838 1.00 0.00 C ATOM 92 C THR A 7 -14.044 7.074 1.066 1.00 0.00 C ATOM 93 O THR A 7 -13.642 8.195 0.750 1.00 0.00 O ATOM 94 CB THR A 7 -13.213 6.461 3.337 1.00 0.00 C ATOM 95 OG1 THR A 7 -12.175 5.774 4.045 1.00 0.00 O ATOM 96 CG2 THR A 7 -14.566 6.088 3.923 1.00 0.00 C ATOM 0 H THR A 7 -11.082 6.389 2.046 1.00 0.00 H new ATOM 0 HA THR A 7 -13.507 5.092 1.694 1.00 0.00 H new ATOM 0 HB THR A 7 -13.074 7.537 3.443 1.00 0.00 H new ATOM 0 HG1 THR A 7 -12.222 6.003 4.997 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.587 6.344 4.982 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.352 6.635 3.402 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.731 5.017 3.805 1.00 0.00 H new ATOM 104 N LEU A 8 -15.260 6.631 0.765 1.00 0.00 N ATOM 105 CA LEU A 8 -16.214 7.454 0.029 1.00 0.00 C ATOM 106 C LEU A 8 -17.525 7.586 0.797 1.00 0.00 C ATOM 107 O LEU A 8 -18.134 8.655 0.826 1.00 0.00 O ATOM 108 CB LEU A 8 -16.477 6.853 -1.353 1.00 0.00 C ATOM 109 CG LEU A 8 -15.239 6.524 -2.188 1.00 0.00 C ATOM 110 CD1 LEU A 8 -15.500 5.317 -3.076 1.00 0.00 C ATOM 111 CD2 LEU A 8 -14.826 7.725 -3.025 1.00 0.00 C ATOM 0 H LEU A 8 -15.609 5.707 1.019 1.00 0.00 H new ATOM 0 HA LEU A 8 -15.783 8.448 -0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -17.058 5.940 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -17.097 7.549 -1.918 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.421 6.281 -1.510 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.608 5.097 -3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -15.747 4.456 -2.456 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -16.332 5.532 -3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.943 7.473 -3.613 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -15.641 8.000 -3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -14.597 8.565 -2.369 1.00 0.00 H new ATOM 123 N ALA A 9 -17.953 6.493 1.419 1.00 0.00 N ATOM 124 CA ALA A 9 -19.190 6.487 2.190 1.00 0.00 C ATOM 125 C ALA A 9 -19.038 5.665 3.466 1.00 0.00 C ATOM 126 O ALA A 9 -19.143 4.439 3.441 1.00 0.00 O ATOM 127 CB ALA A 9 -20.336 5.950 1.347 1.00 0.00 C ATOM 0 H ALA A 9 -17.461 5.600 1.404 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.415 7.515 2.476 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.253 5.952 1.936 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -20.468 6.581 0.468 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -20.109 4.932 1.031 1.00 0.00 H new ATOM 133 N ALA A 10 -18.789 6.348 4.578 1.00 0.00 N ATOM 134 CA ALA A 10 -18.624 5.680 5.863 1.00 0.00 C ATOM 135 C ALA A 10 -19.791 4.741 6.148 1.00 0.00 C ATOM 136 O ALA A 10 -20.945 5.068 5.875 1.00 0.00 O ATOM 137 CB ALA A 10 -18.487 6.707 6.978 1.00 0.00 C ATOM 0 H ALA A 10 -18.697 7.363 4.615 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.713 5.083 5.819 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.364 6.194 7.932 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.616 7.335 6.789 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.382 7.328 7.012 1.00 0.00 H new ATOM 143 N GLY A 11 -19.482 3.570 6.698 1.00 0.00 N ATOM 144 CA GLY A 11 -20.516 2.601 7.009 1.00 0.00 C ATOM 145 C GLY A 11 -20.585 2.281 8.489 1.00 0.00 C ATOM 146 O GLY A 11 -20.793 3.170 9.315 1.00 0.00 O ATOM 0 H GLY A 11 -18.534 3.276 6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.481 2.985 6.678 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -20.330 1.684 6.450 1.00 0.00 H new ATOM 150 N ASP A 12 -20.411 1.008 8.826 1.00 0.00 N ATOM 151 CA ASP A 12 -20.454 0.572 10.217 1.00 0.00 C ATOM 152 C ASP A 12 -19.147 0.901 10.931 1.00 0.00 C ATOM 153 O ASP A 12 -19.148 1.294 12.097 1.00 0.00 O ATOM 154 CB ASP A 12 -20.728 -0.931 10.295 1.00 0.00 C ATOM 155 CG ASP A 12 -21.398 -1.331 11.595 1.00 0.00 C ATOM 156 OD1 ASP A 12 -21.606 -0.446 12.451 1.00 0.00 O ATOM 157 OD2 ASP A 12 -21.712 -2.529 11.757 1.00 0.00 O ATOM 0 H ASP A 12 -20.239 0.260 8.155 1.00 0.00 H new ATOM 0 HA ASP A 12 -21.263 1.107 10.714 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.361 -1.226 9.458 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -19.789 -1.474 10.192 1.00 0.00 H new ATOM 162 N GLU A 13 -18.034 0.735 10.223 1.00 0.00 N ATOM 163 CA GLU A 13 -16.720 1.013 10.790 1.00 0.00 C ATOM 164 C GLU A 13 -16.537 0.286 12.119 1.00 0.00 C ATOM 165 O GLU A 13 -15.823 0.758 13.004 1.00 0.00 O ATOM 166 CB GLU A 13 -16.534 2.519 10.990 1.00 0.00 C ATOM 167 CG GLU A 13 -16.883 3.343 9.762 1.00 0.00 C ATOM 168 CD GLU A 13 -16.305 4.744 9.816 1.00 0.00 C ATOM 169 OE1 GLU A 13 -16.770 5.545 10.653 1.00 0.00 O ATOM 170 OE2 GLU A 13 -15.388 5.039 9.021 1.00 0.00 O ATOM 0 H GLU A 13 -18.016 0.410 9.256 1.00 0.00 H new ATOM 0 HA GLU A 13 -15.967 0.651 10.090 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -17.154 2.846 11.825 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -15.498 2.715 11.267 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -16.513 2.835 8.871 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -17.967 3.405 9.666 1.00 0.00 H new ATOM 177 N ALA A 14 -17.188 -0.865 12.252 1.00 0.00 N ATOM 178 CA ALA A 14 -17.097 -1.658 13.472 1.00 0.00 C ATOM 179 C ALA A 14 -16.901 -3.136 13.152 1.00 0.00 C ATOM 180 O ALA A 14 -16.121 -3.826 13.809 1.00 0.00 O ATOM 181 CB ALA A 14 -18.341 -1.460 14.325 1.00 0.00 C ATOM 0 H ALA A 14 -17.784 -1.269 11.530 1.00 0.00 H new ATOM 0 HA ALA A 14 -16.228 -1.317 14.034 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -18.259 -2.058 15.232 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -18.436 -0.407 14.592 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -19.221 -1.772 13.763 1.00 0.00 H new ATOM 187 N THR A 15 -17.615 -3.617 12.139 1.00 0.00 N ATOM 188 CA THR A 15 -17.521 -5.014 11.734 1.00 0.00 C ATOM 189 C THR A 15 -16.624 -5.172 10.511 1.00 0.00 C ATOM 190 O THR A 15 -16.982 -4.759 9.408 1.00 0.00 O ATOM 191 CB THR A 15 -18.909 -5.601 11.417 1.00 0.00 C ATOM 192 OG1 THR A 15 -19.888 -5.049 12.304 1.00 0.00 O ATOM 193 CG2 THR A 15 -18.898 -7.117 11.547 1.00 0.00 C ATOM 0 H THR A 15 -18.265 -3.060 11.584 1.00 0.00 H new ATOM 0 HA THR A 15 -17.087 -5.558 12.573 1.00 0.00 H new ATOM 0 HB THR A 15 -19.163 -5.342 10.389 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.306 -4.268 11.884 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.889 -7.509 11.318 1.00 0.00 H new ATOM 0 HG22 THR A 15 -18.172 -7.537 10.850 1.00 0.00 H new ATOM 0 HG23 THR A 15 -18.625 -7.393 12.566 1.00 0.00 H new ATOM 201 N TYR A 16 -15.457 -5.774 10.714 1.00 0.00 N ATOM 202 CA TYR A 16 -14.508 -5.986 9.627 1.00 0.00 C ATOM 203 C TYR A 16 -14.330 -7.474 9.341 1.00 0.00 C ATOM 204 O TYR A 16 -14.522 -8.326 10.209 1.00 0.00 O ATOM 205 CB TYR A 16 -13.157 -5.356 9.973 1.00 0.00 C ATOM 206 CG TYR A 16 -13.221 -3.860 10.180 1.00 0.00 C ATOM 207 CD1 TYR A 16 -13.767 -3.323 11.340 1.00 0.00 C ATOM 208 CD2 TYR A 16 -12.738 -2.983 9.217 1.00 0.00 C ATOM 209 CE1 TYR A 16 -13.828 -1.957 11.534 1.00 0.00 C ATOM 210 CE2 TYR A 16 -12.794 -1.616 9.403 1.00 0.00 C ATOM 211 CZ TYR A 16 -13.341 -1.107 10.563 1.00 0.00 C ATOM 212 OH TYR A 16 -13.400 0.255 10.752 1.00 0.00 O ATOM 0 H TYR A 16 -15.146 -6.123 11.620 1.00 0.00 H new ATOM 0 HA TYR A 16 -14.906 -5.508 8.732 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -12.769 -5.823 10.878 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.449 -5.574 9.173 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -14.150 -3.985 12.102 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -12.311 -3.377 8.307 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -14.255 -1.556 12.442 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.412 -0.949 8.645 1.00 0.00 H new ATOM 0 HH TYR A 16 -13.014 0.710 9.975 1.00 0.00 H new ATOM 222 N PRO A 17 -13.954 -7.794 8.095 1.00 0.00 N ATOM 223 CA PRO A 17 -13.740 -9.179 7.664 1.00 0.00 C ATOM 224 C PRO A 17 -12.503 -9.801 8.302 1.00 0.00 C ATOM 225 O PRO A 17 -11.401 -9.261 8.200 1.00 0.00 O ATOM 226 CB PRO A 17 -13.555 -9.055 6.149 1.00 0.00 C ATOM 227 CG PRO A 17 -13.059 -7.666 5.941 1.00 0.00 C ATOM 228 CD PRO A 17 -13.707 -6.830 7.009 1.00 0.00 C ATOM 0 HA PRO A 17 -14.566 -9.828 7.955 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -12.842 -9.790 5.776 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.493 -9.224 5.620 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.973 -7.624 6.018 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.322 -7.302 4.948 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -13.057 -6.018 7.333 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.633 -6.376 6.657 1.00 0.00 H new ATOM 236 N LYS A 18 -12.691 -10.939 8.962 1.00 0.00 N ATOM 237 CA LYS A 18 -11.590 -11.636 9.616 1.00 0.00 C ATOM 238 C LYS A 18 -10.745 -12.395 8.598 1.00 0.00 C ATOM 239 O LYS A 18 -11.271 -12.970 7.646 1.00 0.00 O ATOM 240 CB LYS A 18 -12.128 -12.604 10.671 1.00 0.00 C ATOM 241 CG LYS A 18 -11.145 -12.886 11.795 1.00 0.00 C ATOM 242 CD LYS A 18 -11.781 -13.718 12.896 1.00 0.00 C ATOM 243 CE LYS A 18 -12.747 -12.893 13.731 1.00 0.00 C ATOM 244 NZ LYS A 18 -12.887 -13.432 15.112 1.00 0.00 N ATOM 0 H LYS A 18 -13.597 -11.398 9.058 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.959 -10.892 10.102 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -13.044 -12.193 11.095 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.394 -13.544 10.188 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.276 -13.411 11.397 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.786 -11.944 12.210 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.310 -14.563 12.455 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.002 -14.129 13.539 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -12.397 -11.862 13.777 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -13.723 -12.877 13.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -13.554 -12.842 15.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -13.245 -14.408 15.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.960 -13.424 15.584 1.00 0.00 H new ATOM 258 N ALA A 19 -9.432 -12.393 8.806 1.00 0.00 N ATOM 259 CA ALA A 19 -8.515 -13.085 7.908 1.00 0.00 C ATOM 260 C ALA A 19 -8.873 -14.562 7.790 1.00 0.00 C ATOM 261 O ALA A 19 -8.745 -15.321 8.750 1.00 0.00 O ATOM 262 CB ALA A 19 -7.082 -12.924 8.392 1.00 0.00 C ATOM 0 H ALA A 19 -8.980 -11.920 9.588 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.605 -12.636 6.919 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.408 -13.445 7.713 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.824 -11.865 8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -6.986 -13.346 9.393 1.00 0.00 H new ATOM 268 N GLY A 20 -9.324 -14.965 6.605 1.00 0.00 N ATOM 269 CA GLY A 20 -9.694 -16.350 6.384 1.00 0.00 C ATOM 270 C GLY A 20 -11.195 -16.561 6.414 1.00 0.00 C ATOM 271 O GLY A 20 -11.674 -17.679 6.227 1.00 0.00 O ATOM 0 H GLY A 20 -9.439 -14.356 5.795 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.303 -16.678 5.421 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.227 -16.974 7.146 1.00 0.00 H new ATOM 275 N GLN A 21 -11.937 -15.485 6.650 1.00 0.00 N ATOM 276 CA GLN A 21 -13.392 -15.559 6.707 1.00 0.00 C ATOM 277 C GLN A 21 -14.013 -15.077 5.399 1.00 0.00 C ATOM 278 O GLN A 21 -13.359 -14.408 4.599 1.00 0.00 O ATOM 279 CB GLN A 21 -13.922 -14.724 7.874 1.00 0.00 C ATOM 280 CG GLN A 21 -14.590 -15.551 8.960 1.00 0.00 C ATOM 281 CD GLN A 21 -15.717 -14.808 9.650 1.00 0.00 C ATOM 282 OE1 GLN A 21 -16.804 -15.351 9.848 1.00 0.00 O ATOM 283 NE2 GLN A 21 -15.463 -13.558 10.020 1.00 0.00 N ATOM 0 H GLN A 21 -11.555 -14.552 6.805 1.00 0.00 H new ATOM 0 HA GLN A 21 -13.671 -16.602 6.859 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -13.097 -14.163 8.312 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.637 -13.995 7.493 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -14.980 -16.470 8.523 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.845 -15.841 9.700 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -14.548 -13.148 9.836 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -16.183 -13.008 10.488 1.00 0.00 H new ATOM 292 N VAL A 22 -15.279 -15.422 5.188 1.00 0.00 N ATOM 293 CA VAL A 22 -15.989 -15.025 3.978 1.00 0.00 C ATOM 294 C VAL A 22 -16.529 -13.604 4.099 1.00 0.00 C ATOM 295 O VAL A 22 -17.000 -13.197 5.161 1.00 0.00 O ATOM 296 CB VAL A 22 -17.157 -15.982 3.673 1.00 0.00 C ATOM 297 CG1 VAL A 22 -17.761 -15.669 2.312 1.00 0.00 C ATOM 298 CG2 VAL A 22 -16.691 -17.428 3.739 1.00 0.00 C ATOM 0 H VAL A 22 -15.834 -15.976 5.840 1.00 0.00 H new ATOM 0 HA VAL A 22 -15.270 -15.069 3.160 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.929 -15.839 4.429 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.585 -16.355 2.113 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -18.132 -14.644 2.306 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -16.999 -15.784 1.541 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -17.529 -18.091 3.521 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -15.900 -17.589 3.006 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -16.309 -17.642 4.737 1.00 0.00 H new ATOM 308 N ALA A 23 -16.457 -12.855 3.004 1.00 0.00 N ATOM 309 CA ALA A 23 -16.940 -11.480 2.987 1.00 0.00 C ATOM 310 C ALA A 23 -17.662 -11.168 1.680 1.00 0.00 C ATOM 311 O ALA A 23 -17.196 -11.531 0.600 1.00 0.00 O ATOM 312 CB ALA A 23 -15.786 -10.511 3.198 1.00 0.00 C ATOM 0 H ALA A 23 -16.069 -13.177 2.117 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.652 -11.362 3.803 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.162 -9.488 3.183 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.315 -10.710 4.161 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.053 -10.640 2.402 1.00 0.00 H new ATOM 318 N VAL A 24 -18.803 -10.494 1.786 1.00 0.00 N ATOM 319 CA VAL A 24 -19.589 -10.133 0.612 1.00 0.00 C ATOM 320 C VAL A 24 -19.575 -8.626 0.383 1.00 0.00 C ATOM 321 O VAL A 24 -19.958 -7.851 1.260 1.00 0.00 O ATOM 322 CB VAL A 24 -21.048 -10.608 0.746 1.00 0.00 C ATOM 323 CG1 VAL A 24 -21.791 -10.428 -0.569 1.00 0.00 C ATOM 324 CG2 VAL A 24 -21.096 -12.059 1.201 1.00 0.00 C ATOM 0 H VAL A 24 -19.203 -10.187 2.672 1.00 0.00 H new ATOM 0 HA VAL A 24 -19.130 -10.631 -0.242 1.00 0.00 H new ATOM 0 HB VAL A 24 -21.543 -9.998 1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -22.820 -10.769 -0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -21.787 -9.374 -0.848 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -21.300 -11.012 -1.347 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -22.134 -12.378 1.290 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.585 -12.686 0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.603 -12.153 2.168 1.00 0.00 H new ATOM 334 N VAL A 25 -19.132 -8.216 -0.801 1.00 0.00 N ATOM 335 CA VAL A 25 -19.070 -6.801 -1.146 1.00 0.00 C ATOM 336 C VAL A 25 -19.357 -6.584 -2.628 1.00 0.00 C ATOM 337 O VAL A 25 -19.343 -7.527 -3.419 1.00 0.00 O ATOM 338 CB VAL A 25 -17.693 -6.200 -0.808 1.00 0.00 C ATOM 339 CG1 VAL A 25 -17.178 -6.755 0.512 1.00 0.00 C ATOM 340 CG2 VAL A 25 -16.703 -6.471 -1.931 1.00 0.00 C ATOM 0 H VAL A 25 -18.811 -8.844 -1.538 1.00 0.00 H new ATOM 0 HA VAL A 25 -19.833 -6.297 -0.553 1.00 0.00 H new ATOM 0 HB VAL A 25 -17.803 -5.121 -0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.204 -6.319 0.735 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -17.878 -6.506 1.309 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -17.083 -7.838 0.439 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.735 -6.039 -1.675 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -16.595 -7.547 -2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -17.068 -6.021 -2.854 1.00 0.00 H new ATOM 350 N HIS A 26 -19.616 -5.333 -2.998 1.00 0.00 N ATOM 351 CA HIS A 26 -19.905 -4.991 -4.386 1.00 0.00 C ATOM 352 C HIS A 26 -18.721 -4.273 -5.026 1.00 0.00 C ATOM 353 O HIS A 26 -18.233 -3.271 -4.503 1.00 0.00 O ATOM 354 CB HIS A 26 -21.154 -4.113 -4.467 1.00 0.00 C ATOM 355 CG HIS A 26 -22.399 -4.872 -4.808 1.00 0.00 C ATOM 356 ND1 HIS A 26 -23.107 -4.673 -5.974 1.00 0.00 N ATOM 357 CD2 HIS A 26 -23.062 -5.837 -4.127 1.00 0.00 C ATOM 358 CE1 HIS A 26 -24.152 -5.481 -5.996 1.00 0.00 C ATOM 359 NE2 HIS A 26 -24.147 -6.198 -4.887 1.00 0.00 N ATOM 0 H HIS A 26 -19.632 -4.540 -2.356 1.00 0.00 H new ATOM 0 HA HIS A 26 -20.085 -5.916 -4.933 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -21.296 -3.609 -3.511 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -20.995 -3.337 -5.216 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -22.788 -6.246 -3.166 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -24.885 -5.544 -6.786 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -24.837 -6.905 -4.636 1.00 0.00 H new ATOM 367 N TYR A 27 -18.263 -4.793 -6.160 1.00 0.00 N ATOM 368 CA TYR A 27 -17.134 -4.203 -6.869 1.00 0.00 C ATOM 369 C TYR A 27 -17.609 -3.395 -8.073 1.00 0.00 C ATOM 370 O TYR A 27 -18.553 -3.781 -8.763 1.00 0.00 O ATOM 371 CB TYR A 27 -16.165 -5.295 -7.325 1.00 0.00 C ATOM 372 CG TYR A 27 -16.761 -6.253 -8.332 1.00 0.00 C ATOM 373 CD1 TYR A 27 -16.842 -5.916 -9.678 1.00 0.00 C ATOM 374 CD2 TYR A 27 -17.243 -7.495 -7.938 1.00 0.00 C ATOM 375 CE1 TYR A 27 -17.387 -6.787 -10.601 1.00 0.00 C ATOM 376 CE2 TYR A 27 -17.788 -8.373 -8.854 1.00 0.00 C ATOM 377 CZ TYR A 27 -17.859 -8.015 -10.184 1.00 0.00 C ATOM 378 OH TYR A 27 -18.401 -8.886 -11.101 1.00 0.00 O ATOM 0 H TYR A 27 -18.656 -5.621 -6.607 1.00 0.00 H new ATOM 0 HA TYR A 27 -16.618 -3.531 -6.183 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -15.282 -4.827 -7.760 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -15.830 -5.859 -6.454 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -16.472 -4.956 -10.008 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -17.191 -7.779 -6.897 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -17.443 -6.509 -11.643 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -18.157 -9.335 -8.531 1.00 0.00 H new ATOM 0 HH TYR A 27 -18.685 -9.706 -10.645 1.00 0.00 H new ATOM 388 N THR A 28 -16.947 -2.268 -8.319 1.00 0.00 N ATOM 389 CA THR A 28 -17.301 -1.404 -9.438 1.00 0.00 C ATOM 390 C THR A 28 -16.058 -0.945 -10.192 1.00 0.00 C ATOM 391 O THR A 28 -15.136 -0.381 -9.604 1.00 0.00 O ATOM 392 CB THR A 28 -18.087 -0.166 -8.965 1.00 0.00 C ATOM 393 OG1 THR A 28 -19.360 -0.564 -8.446 1.00 0.00 O ATOM 394 CG2 THR A 28 -18.284 0.818 -10.108 1.00 0.00 C ATOM 0 H THR A 28 -16.163 -1.933 -7.758 1.00 0.00 H new ATOM 0 HA THR A 28 -17.931 -1.992 -10.105 1.00 0.00 H new ATOM 0 HB THR A 28 -17.512 0.325 -8.179 1.00 0.00 H new ATOM 0 HG1 THR A 28 -19.853 0.228 -8.146 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.841 1.684 -9.751 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.312 1.141 -10.482 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.840 0.335 -10.912 1.00 0.00 H new ATOM 402 N GLY A 29 -16.039 -1.189 -11.499 1.00 0.00 N ATOM 403 CA GLY A 29 -14.904 -0.793 -12.312 1.00 0.00 C ATOM 404 C GLY A 29 -14.734 0.712 -12.376 1.00 0.00 C ATOM 405 O GLY A 29 -15.715 1.455 -12.416 1.00 0.00 O ATOM 0 H GLY A 29 -16.790 -1.654 -12.009 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -13.997 -1.241 -11.907 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -15.030 -1.185 -13.321 1.00 0.00 H new ATOM 409 N THR A 30 -13.483 1.164 -12.383 1.00 0.00 N ATOM 410 CA THR A 30 -13.187 2.590 -12.440 1.00 0.00 C ATOM 411 C THR A 30 -11.706 2.833 -12.705 1.00 0.00 C ATOM 412 O THR A 30 -10.847 2.105 -12.206 1.00 0.00 O ATOM 413 CB THR A 30 -13.586 3.299 -11.131 1.00 0.00 C ATOM 414 OG1 THR A 30 -14.141 2.352 -10.211 1.00 0.00 O ATOM 415 CG2 THR A 30 -14.596 4.404 -11.401 1.00 0.00 C ATOM 0 H THR A 30 -12.660 0.563 -12.350 1.00 0.00 H new ATOM 0 HA THR A 30 -13.773 3.003 -13.261 1.00 0.00 H new ATOM 0 HB THR A 30 -12.691 3.745 -10.697 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.426 1.784 -9.856 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.863 4.890 -10.463 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.160 5.138 -12.079 1.00 0.00 H new ATOM 0 HG23 THR A 30 -15.490 3.977 -11.855 1.00 0.00 H new ATOM 423 N LEU A 31 -11.412 3.862 -13.492 1.00 0.00 N ATOM 424 CA LEU A 31 -10.033 4.203 -13.823 1.00 0.00 C ATOM 425 C LEU A 31 -9.525 5.337 -12.939 1.00 0.00 C ATOM 426 O LEU A 31 -10.311 6.082 -12.355 1.00 0.00 O ATOM 427 CB LEU A 31 -9.925 4.602 -15.296 1.00 0.00 C ATOM 428 CG LEU A 31 -9.890 3.451 -16.303 1.00 0.00 C ATOM 429 CD1 LEU A 31 -9.802 3.987 -17.723 1.00 0.00 C ATOM 430 CD2 LEU A 31 -8.722 2.521 -16.009 1.00 0.00 C ATOM 0 H LEU A 31 -12.110 4.475 -13.913 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.415 3.323 -13.645 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.770 5.246 -15.540 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -9.022 5.198 -15.425 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.815 2.882 -16.208 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.778 3.154 -18.426 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.671 4.612 -17.931 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.894 4.580 -17.832 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.713 1.708 -16.735 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.788 3.078 -16.076 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.828 2.110 -15.005 1.00 0.00 H new ATOM 442 N ALA A 32 -8.205 5.462 -12.846 1.00 0.00 N ATOM 443 CA ALA A 32 -7.591 6.507 -12.037 1.00 0.00 C ATOM 444 C ALA A 32 -8.031 7.891 -12.503 1.00 0.00 C ATOM 445 O ALA A 32 -7.953 8.863 -11.751 1.00 0.00 O ATOM 446 CB ALA A 32 -6.075 6.389 -12.083 1.00 0.00 C ATOM 0 H ALA A 32 -7.540 4.852 -13.321 1.00 0.00 H new ATOM 0 HA ALA A 32 -7.922 6.377 -11.007 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.630 7.176 -11.474 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.774 5.416 -11.695 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.733 6.490 -13.113 1.00 0.00 H new ATOM 452 N ASP A 33 -8.492 7.973 -13.746 1.00 0.00 N ATOM 453 CA ASP A 33 -8.944 9.238 -14.312 1.00 0.00 C ATOM 454 C ASP A 33 -10.399 9.509 -13.944 1.00 0.00 C ATOM 455 O ASP A 33 -10.890 10.628 -14.092 1.00 0.00 O ATOM 456 CB ASP A 33 -8.783 9.228 -15.833 1.00 0.00 C ATOM 457 CG ASP A 33 -9.196 10.541 -16.468 1.00 0.00 C ATOM 458 OD1 ASP A 33 -8.609 11.583 -16.110 1.00 0.00 O ATOM 459 OD2 ASP A 33 -10.106 10.526 -17.323 1.00 0.00 O ATOM 0 H ASP A 33 -8.562 7.178 -14.381 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.328 10.035 -13.895 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.743 9.018 -16.084 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.382 8.420 -16.253 1.00 0.00 H new ATOM 464 N GLY A 34 -11.086 8.476 -13.466 1.00 0.00 N ATOM 465 CA GLY A 34 -12.479 8.622 -13.086 1.00 0.00 C ATOM 466 C GLY A 34 -13.415 7.878 -14.017 1.00 0.00 C ATOM 467 O GLY A 34 -14.580 7.652 -13.688 1.00 0.00 O ATOM 0 H GLY A 34 -10.702 7.540 -13.335 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.615 8.254 -12.069 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.742 9.680 -13.081 1.00 0.00 H new ATOM 471 N LYS A 35 -12.907 7.496 -15.183 1.00 0.00 N ATOM 472 CA LYS A 35 -13.705 6.773 -16.166 1.00 0.00 C ATOM 473 C LYS A 35 -14.378 5.559 -15.534 1.00 0.00 C ATOM 474 O LYS A 35 -13.709 4.620 -15.103 1.00 0.00 O ATOM 475 CB LYS A 35 -12.828 6.330 -17.340 1.00 0.00 C ATOM 476 CG LYS A 35 -13.571 6.259 -18.662 1.00 0.00 C ATOM 477 CD LYS A 35 -13.458 7.562 -19.436 1.00 0.00 C ATOM 478 CE LYS A 35 -14.581 8.523 -19.078 1.00 0.00 C ATOM 479 NZ LYS A 35 -14.884 9.462 -20.193 1.00 0.00 N ATOM 0 H LYS A 35 -11.945 7.675 -15.471 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.480 7.446 -16.533 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -11.992 7.022 -17.440 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.405 5.350 -17.117 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.170 5.442 -19.262 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -14.622 6.034 -18.478 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -12.496 8.030 -19.224 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -13.483 7.354 -20.506 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.478 7.956 -18.827 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -14.304 9.091 -18.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.655 10.100 -19.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -14.036 10.021 -20.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.173 8.922 -21.033 1.00 0.00 H new ATOM 493 N VAL A 36 -15.706 5.584 -15.483 1.00 0.00 N ATOM 494 CA VAL A 36 -16.470 4.484 -14.906 1.00 0.00 C ATOM 495 C VAL A 36 -16.430 3.255 -15.807 1.00 0.00 C ATOM 496 O VAL A 36 -16.420 3.370 -17.033 1.00 0.00 O ATOM 497 CB VAL A 36 -17.938 4.884 -14.668 1.00 0.00 C ATOM 498 CG1 VAL A 36 -18.683 4.993 -15.989 1.00 0.00 C ATOM 499 CG2 VAL A 36 -18.618 3.887 -13.743 1.00 0.00 C ATOM 0 H VAL A 36 -16.275 6.354 -15.834 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.006 4.245 -13.949 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.957 5.862 -14.187 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.718 5.276 -15.800 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.208 5.749 -16.613 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.658 4.031 -16.501 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -19.655 4.185 -13.586 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.590 2.895 -14.194 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -18.097 3.865 -12.786 1.00 0.00 H new ATOM 509 N PHE A 37 -16.407 2.077 -15.191 1.00 0.00 N ATOM 510 CA PHE A 37 -16.368 0.825 -15.938 1.00 0.00 C ATOM 511 C PHE A 37 -17.456 -0.130 -15.456 1.00 0.00 C ATOM 512 O PHE A 37 -18.283 0.227 -14.616 1.00 0.00 O ATOM 513 CB PHE A 37 -14.995 0.165 -15.795 1.00 0.00 C ATOM 514 CG PHE A 37 -14.026 0.558 -16.873 1.00 0.00 C ATOM 515 CD1 PHE A 37 -13.536 1.852 -16.945 1.00 0.00 C ATOM 516 CD2 PHE A 37 -13.604 -0.367 -17.815 1.00 0.00 C ATOM 517 CE1 PHE A 37 -12.644 2.217 -17.936 1.00 0.00 C ATOM 518 CE2 PHE A 37 -12.712 -0.008 -18.808 1.00 0.00 C ATOM 519 CZ PHE A 37 -12.232 1.286 -18.869 1.00 0.00 C ATOM 0 H PHE A 37 -16.415 1.964 -14.177 1.00 0.00 H new ATOM 0 HA PHE A 37 -16.548 1.052 -16.989 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -14.573 0.428 -14.825 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -15.118 -0.918 -15.806 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -13.855 2.584 -16.218 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -13.976 -1.380 -17.773 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.270 3.229 -17.981 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.391 -0.739 -19.536 1.00 0.00 H new ATOM 0 HZ PHE A 37 -11.536 1.569 -19.645 1.00 0.00 H new ATOM 529 N ASP A 38 -17.450 -1.344 -15.994 1.00 0.00 N ATOM 530 CA ASP A 38 -18.436 -2.351 -15.620 1.00 0.00 C ATOM 531 C ASP A 38 -18.431 -2.582 -14.112 1.00 0.00 C ATOM 532 O ASP A 38 -17.377 -2.779 -13.507 1.00 0.00 O ATOM 533 CB ASP A 38 -18.156 -3.666 -16.350 1.00 0.00 C ATOM 534 CG ASP A 38 -19.418 -4.468 -16.601 1.00 0.00 C ATOM 535 OD1 ASP A 38 -20.124 -4.171 -17.588 1.00 0.00 O ATOM 536 OD2 ASP A 38 -19.699 -5.394 -15.812 1.00 0.00 O ATOM 0 H ASP A 38 -16.773 -1.655 -16.691 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.421 -1.985 -15.911 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -17.669 -3.453 -17.302 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -17.460 -4.264 -15.762 1.00 0.00 H new ATOM 541 N SER A 39 -19.616 -2.556 -13.510 1.00 0.00 N ATOM 542 CA SER A 39 -19.748 -2.758 -12.072 1.00 0.00 C ATOM 543 C SER A 39 -20.685 -3.924 -11.771 1.00 0.00 C ATOM 544 O SER A 39 -21.516 -4.297 -12.599 1.00 0.00 O ATOM 545 CB SER A 39 -20.269 -1.484 -11.403 1.00 0.00 C ATOM 546 OG SER A 39 -21.625 -1.249 -11.740 1.00 0.00 O ATOM 0 H SER A 39 -20.499 -2.397 -13.996 1.00 0.00 H new ATOM 0 HA SER A 39 -18.762 -2.994 -11.671 1.00 0.00 H new ATOM 0 HB2 SER A 39 -20.170 -1.571 -10.321 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.662 -0.633 -11.711 1.00 0.00 H new ATOM 0 HG SER A 39 -21.935 -0.431 -11.299 1.00 0.00 H new ATOM 552 N SER A 40 -20.544 -4.495 -10.579 1.00 0.00 N ATOM 553 CA SER A 40 -21.374 -5.621 -10.168 1.00 0.00 C ATOM 554 C SER A 40 -22.759 -5.147 -9.737 1.00 0.00 C ATOM 555 O SER A 40 -23.740 -5.883 -9.844 1.00 0.00 O ATOM 556 CB SER A 40 -20.705 -6.385 -9.024 1.00 0.00 C ATOM 557 OG SER A 40 -21.395 -6.181 -7.803 1.00 0.00 O ATOM 0 H SER A 40 -19.863 -4.196 -9.881 1.00 0.00 H new ATOM 0 HA SER A 40 -21.487 -6.288 -11.023 1.00 0.00 H new ATOM 0 HB2 SER A 40 -20.681 -7.449 -9.258 1.00 0.00 H new ATOM 0 HB3 SER A 40 -19.670 -6.058 -8.920 1.00 0.00 H new ATOM 0 HG SER A 40 -20.949 -6.681 -7.088 1.00 0.00 H new ATOM 668 N PHE A 47 -20.237 -9.813 -4.972 1.00 0.00 N ATOM 669 CA PHE A 47 -19.118 -10.748 -5.001 1.00 0.00 C ATOM 670 C PHE A 47 -18.714 -11.156 -3.587 1.00 0.00 C ATOM 671 O PHE A 47 -18.326 -10.317 -2.775 1.00 0.00 O ATOM 672 CB PHE A 47 -17.923 -10.125 -5.725 1.00 0.00 C ATOM 673 CG PHE A 47 -16.983 -11.138 -6.313 1.00 0.00 C ATOM 674 CD1 PHE A 47 -17.396 -11.971 -7.341 1.00 0.00 C ATOM 675 CD2 PHE A 47 -15.688 -11.258 -5.837 1.00 0.00 C ATOM 676 CE1 PHE A 47 -16.533 -12.904 -7.884 1.00 0.00 C ATOM 677 CE2 PHE A 47 -14.821 -12.189 -6.377 1.00 0.00 C ATOM 678 CZ PHE A 47 -15.244 -13.014 -7.401 1.00 0.00 C ATOM 0 HA PHE A 47 -19.436 -11.640 -5.541 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -18.289 -9.476 -6.521 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -17.374 -9.494 -5.026 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -18.403 -11.890 -7.722 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -15.352 -10.617 -5.035 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -16.866 -13.547 -8.685 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -13.813 -12.271 -5.998 1.00 0.00 H new ATOM 0 HZ PHE A 47 -14.568 -13.743 -7.823 1.00 0.00 H new ATOM 688 N ARG A 48 -18.809 -12.451 -3.302 1.00 0.00 N ATOM 689 CA ARG A 48 -18.456 -12.971 -1.986 1.00 0.00 C ATOM 690 C ARG A 48 -17.286 -13.946 -2.084 1.00 0.00 C ATOM 691 O ARG A 48 -17.225 -14.769 -2.998 1.00 0.00 O ATOM 692 CB ARG A 48 -19.661 -13.665 -1.348 1.00 0.00 C ATOM 693 CG ARG A 48 -20.247 -14.776 -2.204 1.00 0.00 C ATOM 694 CD ARG A 48 -20.612 -15.991 -1.366 1.00 0.00 C ATOM 695 NE ARG A 48 -20.585 -17.224 -2.149 1.00 0.00 N ATOM 696 CZ ARG A 48 -21.476 -17.515 -3.090 1.00 0.00 C ATOM 697 NH1 ARG A 48 -22.458 -16.667 -3.364 1.00 0.00 N ATOM 698 NH2 ARG A 48 -21.386 -18.657 -3.760 1.00 0.00 N ATOM 0 H ARG A 48 -19.127 -13.159 -3.964 1.00 0.00 H new ATOM 0 HA ARG A 48 -18.156 -12.131 -1.359 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.363 -14.079 -0.384 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.435 -12.923 -1.151 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -21.134 -14.409 -2.721 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -19.528 -15.064 -2.971 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -19.917 -16.077 -0.530 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -21.606 -15.853 -0.941 1.00 0.00 H new ATOM 0 HE ARG A 48 -19.842 -17.898 -1.963 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -22.531 -15.788 -2.851 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -23.141 -16.894 -4.087 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -20.632 -19.312 -3.552 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -22.071 -18.880 -4.482 1.00 0.00 H new ATOM 712 N PHE A 49 -16.360 -13.848 -1.135 1.00 0.00 N ATOM 713 CA PHE A 49 -15.192 -14.720 -1.115 1.00 0.00 C ATOM 714 C PHE A 49 -14.477 -14.640 0.231 1.00 0.00 C ATOM 715 O PHE A 49 -14.780 -13.779 1.058 1.00 0.00 O ATOM 716 CB PHE A 49 -14.227 -14.342 -2.241 1.00 0.00 C ATOM 717 CG PHE A 49 -13.677 -12.950 -2.116 1.00 0.00 C ATOM 718 CD1 PHE A 49 -12.542 -12.705 -1.359 1.00 0.00 C ATOM 719 CD2 PHE A 49 -14.293 -11.887 -2.757 1.00 0.00 C ATOM 720 CE1 PHE A 49 -12.034 -11.425 -1.242 1.00 0.00 C ATOM 721 CE2 PHE A 49 -13.789 -10.605 -2.644 1.00 0.00 C ATOM 722 CZ PHE A 49 -12.658 -10.374 -1.887 1.00 0.00 C ATOM 0 H PHE A 49 -16.396 -13.174 -0.371 1.00 0.00 H new ATOM 0 HA PHE A 49 -15.532 -15.745 -1.266 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -13.400 -15.051 -2.253 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -14.742 -14.436 -3.197 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -12.049 -13.523 -0.855 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -15.177 -12.062 -3.352 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -11.150 -11.246 -0.647 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -14.279 -9.785 -3.147 1.00 0.00 H new ATOM 0 HZ PHE A 49 -12.261 -9.373 -1.799 1.00 0.00 H new ATOM 732 N THR A 50 -13.526 -15.544 0.444 1.00 0.00 N ATOM 733 CA THR A 50 -12.769 -15.578 1.689 1.00 0.00 C ATOM 734 C THR A 50 -11.595 -14.606 1.645 1.00 0.00 C ATOM 735 O THR A 50 -10.641 -14.803 0.893 1.00 0.00 O ATOM 736 CB THR A 50 -12.238 -16.994 1.985 1.00 0.00 C ATOM 737 OG1 THR A 50 -13.325 -17.924 2.036 1.00 0.00 O ATOM 738 CG2 THR A 50 -11.477 -17.022 3.302 1.00 0.00 C ATOM 0 H THR A 50 -13.262 -16.263 -0.230 1.00 0.00 H new ATOM 0 HA THR A 50 -13.453 -15.281 2.484 1.00 0.00 H new ATOM 0 HB THR A 50 -11.556 -17.277 1.184 1.00 0.00 H new ATOM 0 HG1 THR A 50 -12.979 -18.822 2.223 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.112 -18.032 3.490 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.633 -16.335 3.249 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.141 -16.720 4.112 1.00 0.00 H new ATOM 746 N VAL A 51 -11.672 -13.556 2.457 1.00 0.00 N ATOM 747 CA VAL A 51 -10.614 -12.554 2.512 1.00 0.00 C ATOM 748 C VAL A 51 -9.299 -13.168 2.979 1.00 0.00 C ATOM 749 O VAL A 51 -9.121 -13.455 4.162 1.00 0.00 O ATOM 750 CB VAL A 51 -10.989 -11.394 3.453 1.00 0.00 C ATOM 751 CG1 VAL A 51 -9.975 -10.266 3.341 1.00 0.00 C ATOM 752 CG2 VAL A 51 -12.392 -10.893 3.147 1.00 0.00 C ATOM 0 H VAL A 51 -12.455 -13.377 3.085 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.492 -12.167 1.500 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.975 -11.762 4.479 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.257 -9.455 4.013 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.987 -10.637 3.614 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.954 -9.896 2.316 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.641 -10.073 3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.436 -10.541 2.116 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.106 -11.705 3.284 1.00 0.00 H new ATOM 762 N GLY A 52 -8.379 -13.367 2.040 1.00 0.00 N ATOM 763 CA GLY A 52 -7.091 -13.946 2.375 1.00 0.00 C ATOM 764 C GLY A 52 -6.778 -15.180 1.552 1.00 0.00 C ATOM 765 O GLY A 52 -5.624 -15.598 1.462 1.00 0.00 O ATOM 0 H GLY A 52 -8.503 -13.138 1.054 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.310 -13.202 2.219 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.077 -14.206 3.433 1.00 0.00 H new ATOM 769 N ARG A 53 -7.809 -15.765 0.951 1.00 0.00 N ATOM 770 CA ARG A 53 -7.639 -16.961 0.134 1.00 0.00 C ATOM 771 C ARG A 53 -7.029 -16.611 -1.221 1.00 0.00 C ATOM 772 O ARG A 53 -6.897 -15.439 -1.570 1.00 0.00 O ATOM 773 CB ARG A 53 -8.983 -17.663 -0.066 1.00 0.00 C ATOM 774 CG ARG A 53 -9.344 -18.619 1.058 1.00 0.00 C ATOM 775 CD ARG A 53 -8.385 -19.798 1.116 1.00 0.00 C ATOM 776 NE ARG A 53 -8.976 -20.952 1.790 1.00 0.00 N ATOM 777 CZ ARG A 53 -9.968 -21.673 1.280 1.00 0.00 C ATOM 778 NH1 ARG A 53 -10.477 -21.361 0.096 1.00 0.00 N ATOM 779 NH2 ARG A 53 -10.452 -22.708 1.953 1.00 0.00 N ATOM 0 H ARG A 53 -8.770 -15.430 1.014 1.00 0.00 H new ATOM 0 HA ARG A 53 -6.960 -17.634 0.657 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.766 -16.910 -0.157 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.959 -18.214 -1.006 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.326 -18.087 2.009 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.361 -18.983 0.915 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.094 -20.079 0.104 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.475 -19.500 1.638 1.00 0.00 H new ATOM 0 HE ARG A 53 -8.606 -21.219 2.703 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -10.107 -20.566 -0.425 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -11.239 -21.916 -0.294 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.062 -22.951 2.864 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.214 -23.261 1.560 1.00 0.00 H new ATOM 793 N GLY A 54 -6.658 -17.638 -1.980 1.00 0.00 N ATOM 794 CA GLY A 54 -6.066 -17.419 -3.287 1.00 0.00 C ATOM 795 C GLY A 54 -7.100 -17.393 -4.395 1.00 0.00 C ATOM 796 O GLY A 54 -6.765 -17.548 -5.568 1.00 0.00 O ATOM 0 H GLY A 54 -6.757 -18.617 -1.713 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.520 -16.476 -3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.340 -18.206 -3.490 1.00 0.00 H new ATOM 800 N GLU A 55 -8.361 -17.197 -4.021 1.00 0.00 N ATOM 801 CA GLU A 55 -9.447 -17.154 -4.993 1.00 0.00 C ATOM 802 C GLU A 55 -9.592 -15.755 -5.585 1.00 0.00 C ATOM 803 O GLU A 55 -10.137 -15.583 -6.676 1.00 0.00 O ATOM 804 CB GLU A 55 -10.763 -17.582 -4.340 1.00 0.00 C ATOM 805 CG GLU A 55 -10.741 -19.003 -3.802 1.00 0.00 C ATOM 806 CD GLU A 55 -12.128 -19.608 -3.695 1.00 0.00 C ATOM 807 OE1 GLU A 55 -12.787 -19.402 -2.654 1.00 0.00 O ATOM 808 OE2 GLU A 55 -12.553 -20.286 -4.653 1.00 0.00 O ATOM 0 H GLU A 55 -8.655 -17.066 -3.053 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.207 -17.848 -5.799 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.994 -16.897 -3.524 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.568 -17.491 -5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -10.127 -19.625 -4.453 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.270 -19.008 -2.819 1.00 0.00 H new ATOM 815 N VAL A 56 -9.101 -14.757 -4.857 1.00 0.00 N ATOM 816 CA VAL A 56 -9.175 -13.372 -5.309 1.00 0.00 C ATOM 817 C VAL A 56 -7.783 -12.792 -5.531 1.00 0.00 C ATOM 818 O VAL A 56 -6.778 -13.482 -5.360 1.00 0.00 O ATOM 819 CB VAL A 56 -9.932 -12.491 -4.297 1.00 0.00 C ATOM 820 CG1 VAL A 56 -11.427 -12.762 -4.366 1.00 0.00 C ATOM 821 CG2 VAL A 56 -9.404 -12.724 -2.890 1.00 0.00 C ATOM 0 H VAL A 56 -8.648 -14.881 -3.952 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.719 -13.375 -6.254 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.765 -11.445 -4.555 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.945 -12.131 -3.644 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.791 -12.540 -5.369 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.618 -13.810 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.950 -12.094 -2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.540 -13.771 -2.619 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.344 -12.474 -2.853 1.00 0.00 H new ATOM 831 N ILE A 57 -7.733 -11.520 -5.912 1.00 0.00 N ATOM 832 CA ILE A 57 -6.463 -10.846 -6.156 1.00 0.00 C ATOM 833 C ILE A 57 -5.970 -10.133 -4.902 1.00 0.00 C ATOM 834 O ILE A 57 -6.752 -9.824 -4.003 1.00 0.00 O ATOM 835 CB ILE A 57 -6.580 -9.824 -7.302 1.00 0.00 C ATOM 836 CG1 ILE A 57 -7.721 -8.843 -7.026 1.00 0.00 C ATOM 837 CG2 ILE A 57 -6.796 -10.537 -8.628 1.00 0.00 C ATOM 838 CD1 ILE A 57 -7.459 -7.448 -7.546 1.00 0.00 C ATOM 0 H ILE A 57 -8.556 -10.936 -6.058 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.745 -11.616 -6.439 1.00 0.00 H new ATOM 0 HB ILE A 57 -5.649 -9.261 -7.363 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.635 -9.225 -7.480 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.895 -8.794 -5.951 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.877 -9.801 -9.428 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.953 -11.198 -8.827 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.714 -11.123 -8.581 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.310 -6.808 -7.314 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.563 -7.046 -7.073 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.315 -7.483 -8.626 1.00 0.00 H new ATOM 850 N ARG A 58 -4.667 -9.874 -4.849 1.00 0.00 N ATOM 851 CA ARG A 58 -4.069 -9.196 -3.705 1.00 0.00 C ATOM 852 C ARG A 58 -4.814 -7.903 -3.388 1.00 0.00 C ATOM 853 O ARG A 58 -5.122 -7.619 -2.232 1.00 0.00 O ATOM 854 CB ARG A 58 -2.594 -8.894 -3.978 1.00 0.00 C ATOM 855 CG ARG A 58 -1.768 -10.129 -4.297 1.00 0.00 C ATOM 856 CD ARG A 58 -1.306 -10.832 -3.031 1.00 0.00 C ATOM 857 NE ARG A 58 -0.056 -11.560 -3.234 1.00 0.00 N ATOM 858 CZ ARG A 58 0.557 -12.249 -2.278 1.00 0.00 C ATOM 859 NH1 ARG A 58 0.039 -12.303 -1.059 1.00 0.00 N ATOM 860 NH2 ARG A 58 1.692 -12.885 -2.541 1.00 0.00 N ATOM 0 H ARG A 58 -4.006 -10.123 -5.585 1.00 0.00 H new ATOM 0 HA ARG A 58 -4.144 -9.858 -2.843 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.523 -8.195 -4.811 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -2.167 -8.396 -3.107 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.359 -10.817 -4.902 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -0.901 -9.844 -4.893 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -1.173 -10.098 -2.237 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -2.079 -11.525 -2.698 1.00 0.00 H new ATOM 0 HE ARG A 58 0.370 -11.538 -4.161 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -0.833 -11.815 -0.853 1.00 0.00 H new ATOM 0 HH12 ARG A 58 0.512 -12.833 -0.327 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.094 -12.845 -3.478 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.162 -13.414 -1.806 1.00 0.00 H new ATOM 874 N GLY A 59 -5.100 -7.121 -4.426 1.00 0.00 N ATOM 875 CA GLY A 59 -5.806 -5.868 -4.237 1.00 0.00 C ATOM 876 C GLY A 59 -7.057 -6.027 -3.395 1.00 0.00 C ATOM 877 O GLY A 59 -7.162 -5.450 -2.313 1.00 0.00 O ATOM 0 H GLY A 59 -4.855 -7.334 -5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.140 -5.148 -3.761 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.076 -5.457 -5.210 1.00 0.00 H new ATOM 881 N TRP A 60 -8.007 -6.809 -3.893 1.00 0.00 N ATOM 882 CA TRP A 60 -9.258 -7.041 -3.180 1.00 0.00 C ATOM 883 C TRP A 60 -8.993 -7.561 -1.771 1.00 0.00 C ATOM 884 O TRP A 60 -9.631 -7.131 -0.811 1.00 0.00 O ATOM 885 CB TRP A 60 -10.130 -8.035 -3.948 1.00 0.00 C ATOM 886 CG TRP A 60 -10.815 -7.430 -5.136 1.00 0.00 C ATOM 887 CD1 TRP A 60 -10.976 -6.100 -5.400 1.00 0.00 C ATOM 888 CD2 TRP A 60 -11.433 -8.133 -6.219 1.00 0.00 C ATOM 889 NE1 TRP A 60 -11.657 -5.934 -6.582 1.00 0.00 N ATOM 890 CE2 TRP A 60 -11.947 -7.166 -7.105 1.00 0.00 C ATOM 891 CE3 TRP A 60 -11.600 -9.486 -6.529 1.00 0.00 C ATOM 892 CZ2 TRP A 60 -12.617 -7.511 -8.276 1.00 0.00 C ATOM 893 CZ3 TRP A 60 -12.265 -9.826 -7.691 1.00 0.00 C ATOM 894 CH2 TRP A 60 -12.766 -8.842 -8.554 1.00 0.00 C ATOM 0 H TRP A 60 -7.935 -7.293 -4.788 1.00 0.00 H new ATOM 0 HA TRP A 60 -9.785 -6.090 -3.103 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -9.512 -8.869 -4.280 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -10.882 -8.444 -3.273 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -10.620 -5.296 -4.772 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -11.906 -5.038 -7.002 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -11.216 -10.252 -5.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -13.005 -6.754 -8.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -12.401 -10.868 -7.939 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -13.280 -9.140 -9.456 1.00 0.00 H new ATOM 905 N ASP A 61 -8.048 -8.487 -1.656 1.00 0.00 N ATOM 906 CA ASP A 61 -7.698 -9.065 -0.363 1.00 0.00 C ATOM 907 C ASP A 61 -7.467 -7.972 0.676 1.00 0.00 C ATOM 908 O ASP A 61 -8.192 -7.880 1.665 1.00 0.00 O ATOM 909 CB ASP A 61 -6.447 -9.936 -0.492 1.00 0.00 C ATOM 910 CG ASP A 61 -6.257 -10.855 0.699 1.00 0.00 C ATOM 911 OD1 ASP A 61 -7.042 -10.746 1.664 1.00 0.00 O ATOM 912 OD2 ASP A 61 -5.322 -11.683 0.667 1.00 0.00 O ATOM 0 H ASP A 61 -7.511 -8.854 -2.442 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.531 -9.685 -0.032 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.516 -10.533 -1.401 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.571 -9.296 -0.597 1.00 0.00 H new ATOM 917 N GLU A 62 -6.451 -7.147 0.443 1.00 0.00 N ATOM 918 CA GLU A 62 -6.124 -6.061 1.360 1.00 0.00 C ATOM 919 C GLU A 62 -7.247 -5.030 1.406 1.00 0.00 C ATOM 920 O GLU A 62 -7.653 -4.585 2.479 1.00 0.00 O ATOM 921 CB GLU A 62 -4.815 -5.388 0.942 1.00 0.00 C ATOM 922 CG GLU A 62 -3.584 -6.244 1.188 1.00 0.00 C ATOM 923 CD GLU A 62 -3.452 -6.675 2.635 1.00 0.00 C ATOM 924 OE1 GLU A 62 -3.425 -5.791 3.517 1.00 0.00 O ATOM 925 OE2 GLU A 62 -3.377 -7.896 2.887 1.00 0.00 O ATOM 0 H GLU A 62 -5.841 -7.210 -0.372 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.004 -6.485 2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.867 -5.138 -0.118 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.709 -4.449 1.486 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.628 -7.128 0.552 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.694 -5.686 0.897 1.00 0.00 H new ATOM 932 N GLY A 63 -7.746 -4.654 0.232 1.00 0.00 N ATOM 933 CA GLY A 63 -8.817 -3.678 0.159 1.00 0.00 C ATOM 934 C GLY A 63 -9.978 -4.023 1.071 1.00 0.00 C ATOM 935 O GLY A 63 -10.298 -3.271 1.992 1.00 0.00 O ATOM 0 H GLY A 63 -7.427 -5.008 -0.670 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.428 -2.696 0.427 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.174 -3.611 -0.869 1.00 0.00 H new ATOM 939 N VAL A 64 -10.613 -5.162 0.813 1.00 0.00 N ATOM 940 CA VAL A 64 -11.746 -5.604 1.617 1.00 0.00 C ATOM 941 C VAL A 64 -11.325 -5.878 3.057 1.00 0.00 C ATOM 942 O VAL A 64 -12.099 -5.671 3.991 1.00 0.00 O ATOM 943 CB VAL A 64 -12.387 -6.876 1.031 1.00 0.00 C ATOM 944 CG1 VAL A 64 -11.461 -8.070 1.206 1.00 0.00 C ATOM 945 CG2 VAL A 64 -13.738 -7.139 1.680 1.00 0.00 C ATOM 0 H VAL A 64 -10.362 -5.795 0.054 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.478 -4.797 1.603 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.546 -6.723 -0.037 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.931 -8.959 0.786 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.520 -7.879 0.691 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.268 -8.228 2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -14.177 -8.041 1.254 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.606 -7.272 2.754 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.400 -6.293 1.498 1.00 0.00 H new ATOM 955 N ALA A 65 -10.092 -6.344 3.229 1.00 0.00 N ATOM 956 CA ALA A 65 -9.567 -6.643 4.555 1.00 0.00 C ATOM 957 C ALA A 65 -9.629 -5.417 5.460 1.00 0.00 C ATOM 958 O ALA A 65 -9.932 -5.527 6.648 1.00 0.00 O ATOM 959 CB ALA A 65 -8.137 -7.154 4.453 1.00 0.00 C ATOM 0 H ALA A 65 -9.439 -6.522 2.466 1.00 0.00 H new ATOM 0 HA ALA A 65 -10.189 -7.421 4.998 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.757 -7.373 5.451 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.117 -8.061 3.849 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.511 -6.394 3.986 1.00 0.00 H new ATOM 965 N GLN A 66 -9.341 -4.252 4.890 1.00 0.00 N ATOM 966 CA GLN A 66 -9.363 -3.006 5.647 1.00 0.00 C ATOM 967 C GLN A 66 -10.673 -2.257 5.425 1.00 0.00 C ATOM 968 O GLN A 66 -10.724 -1.032 5.530 1.00 0.00 O ATOM 969 CB GLN A 66 -8.181 -2.120 5.247 1.00 0.00 C ATOM 970 CG GLN A 66 -8.205 -1.697 3.787 1.00 0.00 C ATOM 971 CD GLN A 66 -6.867 -1.167 3.311 1.00 0.00 C ATOM 972 OE1 GLN A 66 -6.305 -0.246 3.904 1.00 0.00 O ATOM 973 NE2 GLN A 66 -6.349 -1.747 2.235 1.00 0.00 N ATOM 0 H GLN A 66 -9.090 -4.145 3.907 1.00 0.00 H new ATOM 0 HA GLN A 66 -9.281 -3.252 6.706 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -8.177 -1.229 5.875 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -7.253 -2.655 5.447 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -8.494 -2.548 3.171 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -8.966 -0.929 3.648 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.849 -2.507 1.775 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -5.451 -1.432 1.869 1.00 0.00 H new ATOM 982 N MET A 67 -11.729 -3.002 5.118 1.00 0.00 N ATOM 983 CA MET A 67 -13.040 -2.408 4.882 1.00 0.00 C ATOM 984 C MET A 67 -14.023 -2.806 5.978 1.00 0.00 C ATOM 985 O MET A 67 -13.842 -3.823 6.647 1.00 0.00 O ATOM 986 CB MET A 67 -13.580 -2.838 3.516 1.00 0.00 C ATOM 987 CG MET A 67 -12.958 -2.084 2.352 1.00 0.00 C ATOM 988 SD MET A 67 -13.874 -0.592 1.921 1.00 0.00 S ATOM 989 CE MET A 67 -15.453 -1.290 1.445 1.00 0.00 C ATOM 0 H MET A 67 -11.703 -4.018 5.027 1.00 0.00 H new ATOM 0 HA MET A 67 -12.927 -1.324 4.896 1.00 0.00 H new ATOM 0 HB2 MET A 67 -13.402 -3.905 3.384 1.00 0.00 H new ATOM 0 HB3 MET A 67 -14.660 -2.690 3.498 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.932 -1.815 2.605 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.911 -2.740 1.483 1.00 0.00 H new ATOM 0 HE1 MET A 67 -15.967 -0.603 0.773 1.00 0.00 H new ATOM 0 HE2 MET A 67 -15.292 -2.241 0.938 1.00 0.00 H new ATOM 0 HE3 MET A 67 -16.062 -1.451 2.334 1.00 0.00 H new ATOM 999 N SER A 68 -15.063 -1.997 6.157 1.00 0.00 N ATOM 1000 CA SER A 68 -16.071 -2.263 7.176 1.00 0.00 C ATOM 1001 C SER A 68 -17.442 -2.477 6.540 1.00 0.00 C ATOM 1002 O SER A 68 -17.744 -1.917 5.486 1.00 0.00 O ATOM 1003 CB SER A 68 -16.135 -1.107 8.175 1.00 0.00 C ATOM 1004 OG SER A 68 -16.096 0.144 7.511 1.00 0.00 O ATOM 0 H SER A 68 -15.229 -1.152 5.610 1.00 0.00 H new ATOM 0 HA SER A 68 -15.787 -3.174 7.704 1.00 0.00 H new ATOM 0 HB2 SER A 68 -17.049 -1.181 8.764 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.300 -1.178 8.872 1.00 0.00 H new ATOM 0 HG SER A 68 -15.199 0.292 7.145 1.00 0.00 H new ATOM 1010 N VAL A 69 -18.268 -3.291 7.190 1.00 0.00 N ATOM 1011 CA VAL A 69 -19.607 -3.580 6.690 1.00 0.00 C ATOM 1012 C VAL A 69 -20.396 -2.296 6.460 1.00 0.00 C ATOM 1013 O VAL A 69 -20.447 -1.423 7.325 1.00 0.00 O ATOM 1014 CB VAL A 69 -20.388 -4.481 7.665 1.00 0.00 C ATOM 1015 CG1 VAL A 69 -21.802 -4.716 7.158 1.00 0.00 C ATOM 1016 CG2 VAL A 69 -19.659 -5.801 7.869 1.00 0.00 C ATOM 0 H VAL A 69 -18.033 -3.762 8.064 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.485 -4.103 5.742 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.453 -3.975 8.628 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.339 -5.355 7.860 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.320 -3.761 7.068 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -21.763 -5.201 6.183 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.224 -6.426 8.561 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.562 -6.315 6.913 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.668 -5.610 8.280 1.00 0.00 H new ATOM 1026 N GLY A 70 -21.010 -2.187 5.286 1.00 0.00 N ATOM 1027 CA GLY A 70 -21.789 -1.006 4.962 1.00 0.00 C ATOM 1028 C GLY A 70 -20.919 0.175 4.581 1.00 0.00 C ATOM 1029 O GLY A 70 -21.414 1.291 4.421 1.00 0.00 O ATOM 0 H GLY A 70 -20.982 -2.896 4.553 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.466 -1.235 4.139 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.408 -0.736 5.818 1.00 0.00 H new ATOM 1033 N GLN A 71 -19.621 -0.069 4.438 1.00 0.00 N ATOM 1034 CA GLN A 71 -18.681 0.985 4.076 1.00 0.00 C ATOM 1035 C GLN A 71 -18.295 0.888 2.603 1.00 0.00 C ATOM 1036 O GLN A 71 -18.056 -0.203 2.085 1.00 0.00 O ATOM 1037 CB GLN A 71 -17.428 0.903 4.950 1.00 0.00 C ATOM 1038 CG GLN A 71 -16.673 2.218 5.056 1.00 0.00 C ATOM 1039 CD GLN A 71 -15.170 2.036 4.971 1.00 0.00 C ATOM 1040 OE1 GLN A 71 -14.506 1.780 5.976 1.00 0.00 O ATOM 1041 NE2 GLN A 71 -14.625 2.168 3.767 1.00 0.00 N ATOM 0 H GLN A 71 -19.196 -0.987 4.567 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.169 1.945 4.243 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.713 0.576 5.950 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -16.761 0.142 4.544 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -17.000 2.886 4.259 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.924 2.702 6.000 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -15.213 2.381 2.961 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.618 2.057 3.648 1.00 0.00 H new ATOM 1050 N ARG A 72 -18.237 2.035 1.935 1.00 0.00 N ATOM 1051 CA ARG A 72 -17.882 2.080 0.522 1.00 0.00 C ATOM 1052 C ARG A 72 -16.625 2.915 0.303 1.00 0.00 C ATOM 1053 O ARG A 72 -16.481 3.999 0.868 1.00 0.00 O ATOM 1054 CB ARG A 72 -19.039 2.654 -0.299 1.00 0.00 C ATOM 1055 CG ARG A 72 -18.672 2.949 -1.744 1.00 0.00 C ATOM 1056 CD ARG A 72 -19.909 3.045 -2.624 1.00 0.00 C ATOM 1057 NE ARG A 72 -20.861 4.033 -2.123 1.00 0.00 N ATOM 1058 CZ ARG A 72 -22.146 4.053 -2.460 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -22.630 3.142 -3.293 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -22.950 4.984 -1.962 1.00 0.00 N ATOM 0 H ARG A 72 -18.431 2.946 2.350 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.682 1.061 0.191 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -19.871 1.950 -0.281 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -19.388 3.572 0.173 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -18.114 3.884 -1.795 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -18.016 2.165 -2.121 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -19.612 3.309 -3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -20.393 2.070 -2.677 1.00 0.00 H new ATOM 0 HE ARG A 72 -20.521 4.747 -1.479 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -22.015 2.424 -3.676 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -23.617 3.159 -3.550 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -22.582 5.685 -1.320 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -23.936 4.998 -2.222 1.00 0.00 H new ATOM 1074 N ALA A 73 -15.716 2.403 -0.521 1.00 0.00 N ATOM 1075 CA ALA A 73 -14.471 3.102 -0.815 1.00 0.00 C ATOM 1076 C ALA A 73 -13.868 2.619 -2.130 1.00 0.00 C ATOM 1077 O ALA A 73 -14.235 1.561 -2.641 1.00 0.00 O ATOM 1078 CB ALA A 73 -13.479 2.917 0.323 1.00 0.00 C ATOM 0 H ALA A 73 -15.819 1.507 -0.997 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.695 4.164 -0.916 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.554 3.445 0.089 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.903 3.318 1.244 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.268 1.856 0.453 1.00 0.00 H new ATOM 1084 N LYS A 74 -12.940 3.400 -2.672 1.00 0.00 N ATOM 1085 CA LYS A 74 -12.285 3.053 -3.927 1.00 0.00 C ATOM 1086 C LYS A 74 -10.978 2.309 -3.670 1.00 0.00 C ATOM 1087 O LYS A 74 -10.191 2.696 -2.806 1.00 0.00 O ATOM 1088 CB LYS A 74 -12.013 4.313 -4.751 1.00 0.00 C ATOM 1089 CG LYS A 74 -10.731 5.029 -4.362 1.00 0.00 C ATOM 1090 CD LYS A 74 -10.739 6.477 -4.822 1.00 0.00 C ATOM 1091 CE LYS A 74 -10.648 6.582 -6.337 1.00 0.00 C ATOM 1092 NZ LYS A 74 -9.239 6.525 -6.813 1.00 0.00 N ATOM 0 H LYS A 74 -12.624 4.279 -2.261 1.00 0.00 H new ATOM 0 HA LYS A 74 -12.952 2.398 -4.487 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.963 4.043 -5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.852 5.000 -4.637 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.606 4.991 -3.280 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.877 4.512 -4.800 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -11.651 6.964 -4.477 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.902 7.008 -4.369 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.218 5.772 -6.792 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -11.104 7.516 -6.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -9.226 6.395 -7.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -8.754 7.412 -6.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -8.751 5.728 -6.357 1.00 0.00 H new ATOM 1106 N LEU A 75 -10.753 1.240 -4.426 1.00 0.00 N ATOM 1107 CA LEU A 75 -9.540 0.442 -4.282 1.00 0.00 C ATOM 1108 C LEU A 75 -8.634 0.604 -5.498 1.00 0.00 C ATOM 1109 O LEU A 75 -8.808 -0.075 -6.510 1.00 0.00 O ATOM 1110 CB LEU A 75 -9.896 -1.033 -4.089 1.00 0.00 C ATOM 1111 CG LEU A 75 -8.764 -1.939 -3.603 1.00 0.00 C ATOM 1112 CD1 LEU A 75 -8.346 -1.559 -2.191 1.00 0.00 C ATOM 1113 CD2 LEU A 75 -9.187 -3.399 -3.661 1.00 0.00 C ATOM 0 H LEU A 75 -11.395 0.906 -5.145 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.003 0.797 -3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -10.718 -1.097 -3.376 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.266 -1.424 -5.037 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.907 -1.804 -4.263 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.540 -2.214 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.001 -0.525 -2.179 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -9.197 -1.665 -1.519 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.369 -4.029 -3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -10.059 -3.551 -3.025 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.436 -3.665 -4.688 1.00 0.00 H new ATOM 1125 N VAL A 76 -7.664 1.507 -5.391 1.00 0.00 N ATOM 1126 CA VAL A 76 -6.728 1.756 -6.481 1.00 0.00 C ATOM 1127 C VAL A 76 -5.418 1.007 -6.261 1.00 0.00 C ATOM 1128 O VAL A 76 -4.575 1.429 -5.468 1.00 0.00 O ATOM 1129 CB VAL A 76 -6.428 3.259 -6.631 1.00 0.00 C ATOM 1130 CG1 VAL A 76 -6.034 3.862 -5.291 1.00 0.00 C ATOM 1131 CG2 VAL A 76 -5.338 3.483 -7.668 1.00 0.00 C ATOM 0 H VAL A 76 -7.506 2.078 -4.561 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.201 1.395 -7.394 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.333 3.760 -6.975 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.826 4.924 -5.417 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.850 3.734 -4.580 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.143 3.360 -4.914 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.139 4.551 -7.761 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.428 2.970 -7.356 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.665 3.089 -8.630 1.00 0.00 H new ATOM 1141 N CYS A 77 -5.253 -0.105 -6.968 1.00 0.00 N ATOM 1142 CA CYS A 77 -4.044 -0.914 -6.851 1.00 0.00 C ATOM 1143 C CYS A 77 -3.414 -1.151 -8.220 1.00 0.00 C ATOM 1144 O CYS A 77 -4.057 -0.960 -9.252 1.00 0.00 O ATOM 1145 CB CYS A 77 -4.364 -2.252 -6.184 1.00 0.00 C ATOM 1146 SG CYS A 77 -5.363 -3.364 -7.201 1.00 0.00 S ATOM 0 H CYS A 77 -5.941 -0.468 -7.628 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.330 -0.370 -6.233 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.429 -2.751 -5.929 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -4.890 -2.063 -5.248 1.00 0.00 H new ATOM 0 HG CYS A 77 -4.928 -4.582 -7.068 1.00 0.00 H new ATOM 1152 N SER A 78 -2.152 -1.568 -8.220 1.00 0.00 N ATOM 1153 CA SER A 78 -1.433 -1.827 -9.461 1.00 0.00 C ATOM 1154 C SER A 78 -1.794 -3.200 -10.022 1.00 0.00 C ATOM 1155 O SER A 78 -2.410 -4.029 -9.354 1.00 0.00 O ATOM 1156 CB SER A 78 0.077 -1.740 -9.229 1.00 0.00 C ATOM 1157 OG SER A 78 0.374 -1.624 -7.848 1.00 0.00 O ATOM 0 H SER A 78 -1.607 -1.734 -7.374 1.00 0.00 H new ATOM 0 HA SER A 78 -1.726 -1.068 -10.186 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.562 -2.627 -9.636 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.482 -0.881 -9.765 1.00 0.00 H new ATOM 0 HG SER A 78 1.345 -1.572 -7.725 1.00 0.00 H new ATOM 1163 N PRO A 79 -1.400 -3.445 -11.281 1.00 0.00 N ATOM 1164 CA PRO A 79 -1.670 -4.716 -11.961 1.00 0.00 C ATOM 1165 C PRO A 79 -0.860 -5.869 -11.378 1.00 0.00 C ATOM 1166 O PRO A 79 -1.251 -7.031 -11.485 1.00 0.00 O ATOM 1167 CB PRO A 79 -1.247 -4.441 -13.406 1.00 0.00 C ATOM 1168 CG PRO A 79 -0.238 -3.350 -13.305 1.00 0.00 C ATOM 1169 CD PRO A 79 -0.661 -2.502 -12.137 1.00 0.00 C ATOM 0 HA PRO A 79 -2.711 -5.021 -11.858 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -0.822 -5.331 -13.870 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -2.098 -4.138 -14.017 1.00 0.00 H new ATOM 0 HG2 PRO A 79 0.762 -3.756 -13.151 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -0.205 -2.762 -14.222 1.00 0.00 H new ATOM 0 HD2 PRO A 79 0.198 -2.076 -11.618 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.289 -1.668 -12.452 1.00 0.00 H new ATOM 1177 N ASP A 80 0.270 -5.539 -10.762 1.00 0.00 N ATOM 1178 CA ASP A 80 1.135 -6.548 -10.161 1.00 0.00 C ATOM 1179 C ASP A 80 0.411 -7.286 -9.039 1.00 0.00 C ATOM 1180 O ASP A 80 0.765 -8.414 -8.695 1.00 0.00 O ATOM 1181 CB ASP A 80 2.411 -5.900 -9.621 1.00 0.00 C ATOM 1182 CG ASP A 80 3.448 -5.674 -10.704 1.00 0.00 C ATOM 1183 OD1 ASP A 80 3.694 -6.609 -11.495 1.00 0.00 O ATOM 1184 OD2 ASP A 80 4.013 -4.562 -10.761 1.00 0.00 O ATOM 0 H ASP A 80 0.608 -4.582 -10.666 1.00 0.00 H new ATOM 0 HA ASP A 80 1.402 -7.269 -10.933 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.162 -4.946 -9.156 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.835 -6.534 -8.842 1.00 0.00 H new ATOM 1189 N TYR A 81 -0.603 -6.641 -8.472 1.00 0.00 N ATOM 1190 CA TYR A 81 -1.374 -7.235 -7.386 1.00 0.00 C ATOM 1191 C TYR A 81 -2.805 -7.525 -7.830 1.00 0.00 C ATOM 1192 O TYR A 81 -3.690 -7.749 -7.005 1.00 0.00 O ATOM 1193 CB TYR A 81 -1.385 -6.305 -6.172 1.00 0.00 C ATOM 1194 CG TYR A 81 -0.282 -6.594 -5.179 1.00 0.00 C ATOM 1195 CD1 TYR A 81 0.984 -6.974 -5.607 1.00 0.00 C ATOM 1196 CD2 TYR A 81 -0.506 -6.486 -3.811 1.00 0.00 C ATOM 1197 CE1 TYR A 81 1.994 -7.240 -4.702 1.00 0.00 C ATOM 1198 CE2 TYR A 81 0.498 -6.749 -2.900 1.00 0.00 C ATOM 1199 CZ TYR A 81 1.746 -7.125 -3.350 1.00 0.00 C ATOM 1200 OH TYR A 81 2.750 -7.388 -2.446 1.00 0.00 O ATOM 0 H TYR A 81 -0.910 -5.708 -8.746 1.00 0.00 H new ATOM 0 HA TYR A 81 -0.899 -8.177 -7.110 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.294 -5.274 -6.514 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.348 -6.390 -5.668 1.00 0.00 H new ATOM 0 HD1 TYR A 81 1.182 -7.063 -6.665 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -1.482 -6.191 -3.455 1.00 0.00 H new ATOM 0 HE1 TYR A 81 2.972 -7.536 -5.051 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.307 -6.661 -1.841 1.00 0.00 H new ATOM 0 HH TYR A 81 2.412 -7.260 -1.535 1.00 0.00 H new ATOM 1210 N ALA A 82 -3.023 -7.522 -9.141 1.00 0.00 N ATOM 1211 CA ALA A 82 -4.344 -7.787 -9.697 1.00 0.00 C ATOM 1212 C ALA A 82 -4.242 -8.367 -11.104 1.00 0.00 C ATOM 1213 O ALA A 82 -3.172 -8.805 -11.529 1.00 0.00 O ATOM 1214 CB ALA A 82 -5.177 -6.514 -9.708 1.00 0.00 C ATOM 0 H ALA A 82 -2.301 -7.339 -9.838 1.00 0.00 H new ATOM 0 HA ALA A 82 -4.836 -8.525 -9.063 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.161 -6.727 -10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.288 -6.143 -8.689 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.680 -5.759 -10.317 1.00 0.00 H new ATOM 1220 N TYR A 83 -5.359 -8.367 -11.821 1.00 0.00 N ATOM 1221 CA TYR A 83 -5.396 -8.896 -13.179 1.00 0.00 C ATOM 1222 C TYR A 83 -5.134 -7.794 -14.201 1.00 0.00 C ATOM 1223 O TYR A 83 -5.417 -7.951 -15.387 1.00 0.00 O ATOM 1224 CB TYR A 83 -6.749 -9.553 -13.457 1.00 0.00 C ATOM 1225 CG TYR A 83 -7.926 -8.759 -12.935 1.00 0.00 C ATOM 1226 CD1 TYR A 83 -8.158 -7.459 -13.366 1.00 0.00 C ATOM 1227 CD2 TYR A 83 -8.805 -9.310 -12.011 1.00 0.00 C ATOM 1228 CE1 TYR A 83 -9.232 -6.730 -12.891 1.00 0.00 C ATOM 1229 CE2 TYR A 83 -9.882 -8.589 -11.532 1.00 0.00 C ATOM 1230 CZ TYR A 83 -10.091 -7.300 -11.975 1.00 0.00 C ATOM 1231 OH TYR A 83 -11.162 -6.578 -11.500 1.00 0.00 O ATOM 0 H TYR A 83 -6.252 -8.006 -11.485 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.610 -9.646 -13.270 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.863 -9.691 -14.532 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.762 -10.545 -13.005 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.488 -7.010 -14.084 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.644 -10.319 -11.661 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.398 -5.720 -13.235 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.556 -9.033 -10.815 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.274 -5.767 -12.039 1.00 0.00 H new ATOM 1241 N GLY A 84 -4.589 -6.676 -13.729 1.00 0.00 N ATOM 1242 CA GLY A 84 -4.296 -5.563 -14.613 1.00 0.00 C ATOM 1243 C GLY A 84 -3.132 -5.850 -15.540 1.00 0.00 C ATOM 1244 O GLY A 84 -3.006 -5.233 -16.598 1.00 0.00 O ATOM 0 H GLY A 84 -4.345 -6.522 -12.751 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.181 -5.332 -15.206 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -4.072 -4.679 -14.017 1.00 0.00 H new ATOM 1248 N SER A 85 -2.277 -6.787 -15.142 1.00 0.00 N ATOM 1249 CA SER A 85 -1.114 -7.150 -15.943 1.00 0.00 C ATOM 1250 C SER A 85 -1.511 -7.405 -17.394 1.00 0.00 C ATOM 1251 O SER A 85 -1.197 -6.613 -18.283 1.00 0.00 O ATOM 1252 CB SER A 85 -0.436 -8.392 -15.362 1.00 0.00 C ATOM 1253 OG SER A 85 0.309 -9.078 -16.354 1.00 0.00 O ATOM 0 H SER A 85 -2.368 -7.308 -14.270 1.00 0.00 H new ATOM 0 HA SER A 85 -0.412 -6.316 -15.918 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.223 -8.101 -14.544 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.189 -9.059 -14.943 1.00 0.00 H new ATOM 0 HG SER A 85 0.734 -9.867 -15.957 1.00 0.00 H new ATOM 1259 N ARG A 86 -2.203 -8.515 -17.625 1.00 0.00 N ATOM 1260 CA ARG A 86 -2.643 -8.877 -18.967 1.00 0.00 C ATOM 1261 C ARG A 86 -3.855 -8.049 -19.383 1.00 0.00 C ATOM 1262 O ARG A 86 -3.986 -7.660 -20.543 1.00 0.00 O ATOM 1263 CB ARG A 86 -2.982 -10.367 -19.032 1.00 0.00 C ATOM 1264 CG ARG A 86 -3.940 -10.821 -17.942 1.00 0.00 C ATOM 1265 CD ARG A 86 -5.242 -11.345 -18.528 1.00 0.00 C ATOM 1266 NE ARG A 86 -5.941 -12.231 -17.601 1.00 0.00 N ATOM 1267 CZ ARG A 86 -6.853 -13.119 -17.980 1.00 0.00 C ATOM 1268 NH1 ARG A 86 -7.173 -13.240 -19.261 1.00 0.00 N ATOM 1269 NH2 ARG A 86 -7.446 -13.889 -17.077 1.00 0.00 N ATOM 0 H ARG A 86 -2.471 -9.180 -16.900 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.827 -8.668 -19.659 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.420 -10.589 -20.005 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.060 -10.944 -18.958 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.469 -11.601 -17.344 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.151 -9.988 -17.271 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -5.888 -10.505 -18.784 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.033 -11.881 -19.454 1.00 0.00 H new ATOM 0 HE ARG A 86 -5.717 -12.164 -16.608 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.718 -12.650 -19.958 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -7.874 -13.923 -19.549 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -7.202 -13.799 -16.091 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -8.146 -14.571 -17.369 1.00 0.00 H new ATOM 1283 N GLY A 87 -4.741 -7.784 -18.427 1.00 0.00 N ATOM 1284 CA GLY A 87 -5.931 -7.005 -18.714 1.00 0.00 C ATOM 1285 C GLY A 87 -6.733 -7.575 -19.868 1.00 0.00 C ATOM 1286 O GLY A 87 -6.664 -8.772 -20.150 1.00 0.00 O ATOM 0 H GLY A 87 -4.655 -8.095 -17.459 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.559 -6.965 -17.824 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.643 -5.980 -18.947 1.00 0.00 H new ATOM 1290 N HIS A 88 -7.496 -6.717 -20.537 1.00 0.00 N ATOM 1291 CA HIS A 88 -8.315 -7.142 -21.667 1.00 0.00 C ATOM 1292 C HIS A 88 -8.598 -5.971 -22.604 1.00 0.00 C ATOM 1293 O HIS A 88 -8.575 -4.806 -22.206 1.00 0.00 O ATOM 1294 CB HIS A 88 -9.631 -7.743 -21.172 1.00 0.00 C ATOM 1295 CG HIS A 88 -9.591 -9.233 -21.026 1.00 0.00 C ATOM 1296 ND1 HIS A 88 -9.406 -9.867 -19.816 1.00 0.00 N ATOM 1297 CD2 HIS A 88 -9.715 -10.217 -21.948 1.00 0.00 C ATOM 1298 CE1 HIS A 88 -9.416 -11.175 -19.999 1.00 0.00 C ATOM 1299 NE2 HIS A 88 -9.603 -11.414 -21.285 1.00 0.00 N ATOM 0 H HIS A 88 -7.564 -5.723 -20.317 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.762 -7.901 -22.220 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.885 -7.298 -20.210 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.427 -7.475 -21.867 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -9.873 -10.085 -23.008 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -9.292 -11.922 -19.229 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -9.656 -12.337 -21.715 1.00 0.00 H new ATOM 1307 N PRO A 89 -8.870 -6.286 -23.879 1.00 0.00 N ATOM 1308 CA PRO A 89 -9.162 -5.274 -24.899 1.00 0.00 C ATOM 1309 C PRO A 89 -10.510 -4.597 -24.675 1.00 0.00 C ATOM 1310 O PRO A 89 -11.557 -5.240 -24.740 1.00 0.00 O ATOM 1311 CB PRO A 89 -9.177 -6.078 -26.202 1.00 0.00 C ATOM 1312 CG PRO A 89 -9.522 -7.466 -25.786 1.00 0.00 C ATOM 1313 CD PRO A 89 -8.915 -7.653 -24.423 1.00 0.00 C ATOM 0 HA PRO A 89 -8.433 -4.464 -24.890 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -9.911 -5.681 -26.904 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.208 -6.043 -26.700 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.602 -7.607 -25.755 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -9.126 -8.195 -26.493 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.520 -8.313 -23.801 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.920 -8.094 -24.483 1.00 0.00 H new ATOM 1321 N GLY A 90 -10.477 -3.294 -24.411 1.00 0.00 N ATOM 1322 CA GLY A 90 -11.703 -2.552 -24.182 1.00 0.00 C ATOM 1323 C GLY A 90 -12.260 -2.769 -22.789 1.00 0.00 C ATOM 1324 O GLY A 90 -13.373 -2.340 -22.484 1.00 0.00 O ATOM 0 H GLY A 90 -9.623 -2.739 -24.352 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.514 -1.489 -24.333 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -12.448 -2.851 -24.919 1.00 0.00 H new ATOM 1328 N VAL A 91 -11.486 -3.439 -21.941 1.00 0.00 N ATOM 1329 CA VAL A 91 -11.908 -3.713 -20.573 1.00 0.00 C ATOM 1330 C VAL A 91 -10.851 -3.264 -19.571 1.00 0.00 C ATOM 1331 O VAL A 91 -11.126 -2.457 -18.683 1.00 0.00 O ATOM 1332 CB VAL A 91 -12.196 -5.211 -20.364 1.00 0.00 C ATOM 1333 CG1 VAL A 91 -12.836 -5.448 -19.005 1.00 0.00 C ATOM 1334 CG2 VAL A 91 -13.081 -5.744 -21.480 1.00 0.00 C ATOM 0 H VAL A 91 -10.563 -3.802 -22.178 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.825 -3.148 -20.406 1.00 0.00 H new ATOM 0 HB VAL A 91 -11.250 -5.752 -20.392 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -13.032 -6.512 -18.876 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -12.161 -5.105 -18.220 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.774 -4.896 -18.943 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.274 -6.804 -21.316 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -14.025 -5.200 -21.487 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.578 -5.611 -22.438 1.00 0.00 H new ATOM 1344 N ILE A 92 -9.641 -3.793 -19.720 1.00 0.00 N ATOM 1345 CA ILE A 92 -8.541 -3.446 -18.828 1.00 0.00 C ATOM 1346 C ILE A 92 -7.276 -3.123 -19.616 1.00 0.00 C ATOM 1347 O ILE A 92 -6.887 -3.844 -20.535 1.00 0.00 O ATOM 1348 CB ILE A 92 -8.239 -4.585 -17.837 1.00 0.00 C ATOM 1349 CG1 ILE A 92 -9.476 -4.896 -16.991 1.00 0.00 C ATOM 1350 CG2 ILE A 92 -7.062 -4.214 -16.947 1.00 0.00 C ATOM 1351 CD1 ILE A 92 -9.262 -6.015 -15.997 1.00 0.00 C ATOM 0 H ILE A 92 -9.398 -4.463 -20.449 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.853 -2.564 -18.269 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.975 -5.479 -18.403 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.774 -3.996 -16.454 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.301 -5.161 -17.652 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.860 -5.029 -16.252 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.181 -4.037 -17.564 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.300 -3.310 -16.387 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -10.180 -6.181 -15.433 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.993 -6.928 -16.529 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.459 -5.744 -15.312 1.00 0.00 H new ATOM 1363 N PRO A 93 -6.616 -2.015 -19.248 1.00 0.00 N ATOM 1364 CA PRO A 93 -5.383 -1.573 -19.906 1.00 0.00 C ATOM 1365 C PRO A 93 -4.204 -2.493 -19.606 1.00 0.00 C ATOM 1366 O PRO A 93 -4.204 -3.244 -18.631 1.00 0.00 O ATOM 1367 CB PRO A 93 -5.141 -0.184 -19.310 1.00 0.00 C ATOM 1368 CG PRO A 93 -5.826 -0.215 -17.987 1.00 0.00 C ATOM 1369 CD PRO A 93 -7.022 -1.109 -18.161 1.00 0.00 C ATOM 0 HA PRO A 93 -5.477 -1.576 -20.992 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -4.076 0.019 -19.200 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.550 0.598 -19.950 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.162 -0.598 -17.212 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.129 0.786 -17.681 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.251 -1.656 -17.246 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.914 -0.540 -18.424 1.00 0.00 H new ATOM 1377 N PRO A 94 -3.174 -2.434 -20.463 1.00 0.00 N ATOM 1378 CA PRO A 94 -1.969 -3.255 -20.310 1.00 0.00 C ATOM 1379 C PRO A 94 -1.125 -2.829 -19.113 1.00 0.00 C ATOM 1380 O PRO A 94 -0.394 -1.842 -19.178 1.00 0.00 O ATOM 1381 CB PRO A 94 -1.207 -3.014 -21.615 1.00 0.00 C ATOM 1382 CG PRO A 94 -1.671 -1.678 -22.083 1.00 0.00 C ATOM 1383 CD PRO A 94 -3.105 -1.562 -21.647 1.00 0.00 C ATOM 0 HA PRO A 94 -2.210 -4.302 -20.129 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -0.129 -3.024 -21.452 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -1.425 -3.789 -22.350 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -1.066 -0.881 -21.651 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -1.584 -1.592 -23.166 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.369 -0.533 -21.404 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.790 -1.891 -22.428 1.00 0.00 H new ATOM 1391 N ASN A 95 -1.232 -3.579 -18.022 1.00 0.00 N ATOM 1392 CA ASN A 95 -0.478 -3.278 -16.810 1.00 0.00 C ATOM 1393 C ASN A 95 -0.627 -1.809 -16.428 1.00 0.00 C ATOM 1394 O ASN A 95 0.343 -1.052 -16.441 1.00 0.00 O ATOM 1395 CB ASN A 95 1.001 -3.618 -17.007 1.00 0.00 C ATOM 1396 CG ASN A 95 1.201 -4.855 -17.861 1.00 0.00 C ATOM 1397 OD1 ASN A 95 1.338 -5.964 -17.345 1.00 0.00 O ATOM 1398 ND2 ASN A 95 1.219 -4.669 -19.176 1.00 0.00 N ATOM 0 H ASN A 95 -1.833 -4.400 -17.952 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.880 -3.888 -16.001 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.506 -2.772 -17.473 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.468 -3.772 -16.034 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.350 -5.464 -19.802 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.101 -3.731 -19.560 1.00 0.00 H new ATOM 1405 N ALA A 96 -1.849 -1.413 -16.087 1.00 0.00 N ATOM 1406 CA ALA A 96 -2.125 -0.035 -15.699 1.00 0.00 C ATOM 1407 C ALA A 96 -2.892 0.020 -14.382 1.00 0.00 C ATOM 1408 O ALA A 96 -3.645 -0.896 -14.050 1.00 0.00 O ATOM 1409 CB ALA A 96 -2.904 0.677 -16.795 1.00 0.00 C ATOM 0 H ALA A 96 -2.663 -2.027 -16.072 1.00 0.00 H new ATOM 0 HA ALA A 96 -1.172 0.474 -15.557 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.103 1.705 -16.491 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -2.320 0.677 -17.715 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.848 0.160 -16.965 1.00 0.00 H new ATOM 1415 N THR A 97 -2.695 1.101 -13.633 1.00 0.00 N ATOM 1416 CA THR A 97 -3.366 1.276 -12.351 1.00 0.00 C ATOM 1417 C THR A 97 -4.878 1.142 -12.499 1.00 0.00 C ATOM 1418 O THR A 97 -5.488 1.790 -13.351 1.00 0.00 O ATOM 1419 CB THR A 97 -3.042 2.647 -11.729 1.00 0.00 C ATOM 1420 OG1 THR A 97 -1.652 2.946 -11.901 1.00 0.00 O ATOM 1421 CG2 THR A 97 -3.389 2.665 -10.248 1.00 0.00 C ATOM 0 H THR A 97 -2.076 1.869 -13.893 1.00 0.00 H new ATOM 0 HA THR A 97 -2.997 0.490 -11.692 1.00 0.00 H new ATOM 0 HB THR A 97 -3.642 3.402 -12.236 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.454 3.820 -11.504 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.151 3.643 -9.831 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.453 2.465 -10.121 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.812 1.899 -9.730 1.00 0.00 H new ATOM 1429 N LEU A 98 -5.477 0.300 -11.665 1.00 0.00 N ATOM 1430 CA LEU A 98 -6.919 0.083 -11.702 1.00 0.00 C ATOM 1431 C LEU A 98 -7.562 0.461 -10.372 1.00 0.00 C ATOM 1432 O LEU A 98 -7.035 0.148 -9.303 1.00 0.00 O ATOM 1433 CB LEU A 98 -7.226 -1.379 -12.033 1.00 0.00 C ATOM 1434 CG LEU A 98 -6.367 -2.014 -13.126 1.00 0.00 C ATOM 1435 CD1 LEU A 98 -6.754 -3.471 -13.330 1.00 0.00 C ATOM 1436 CD2 LEU A 98 -6.499 -1.238 -14.428 1.00 0.00 C ATOM 0 H LEU A 98 -4.987 -0.244 -10.955 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.337 0.721 -12.480 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.114 -1.968 -11.123 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.272 -1.451 -12.333 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.325 -1.977 -12.809 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.132 -3.907 -14.112 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.606 -4.020 -12.400 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.802 -3.531 -13.624 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.880 -1.705 -15.194 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.540 -1.242 -14.750 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -6.171 -0.210 -14.274 1.00 0.00 H new ATOM 1448 N THR A 99 -8.705 1.135 -10.443 1.00 0.00 N ATOM 1449 CA THR A 99 -9.421 1.555 -9.245 1.00 0.00 C ATOM 1450 C THR A 99 -10.828 0.970 -9.211 1.00 0.00 C ATOM 1451 O THR A 99 -11.731 1.460 -9.890 1.00 0.00 O ATOM 1452 CB THR A 99 -9.513 3.090 -9.154 1.00 0.00 C ATOM 1453 OG1 THR A 99 -8.203 3.664 -9.215 1.00 0.00 O ATOM 1454 CG2 THR A 99 -10.199 3.516 -7.865 1.00 0.00 C ATOM 0 H THR A 99 -9.155 1.402 -11.318 1.00 0.00 H new ATOM 0 HA THR A 99 -8.855 1.181 -8.392 1.00 0.00 H new ATOM 0 HB THR A 99 -10.105 3.447 -9.997 1.00 0.00 H new ATOM 0 HG1 THR A 99 -8.271 4.640 -9.158 1.00 0.00 H new ATOM 0 HG21 THR A 99 -10.252 4.604 -7.823 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.207 3.102 -7.835 1.00 0.00 H new ATOM 0 HG23 THR A 99 -9.630 3.148 -7.011 1.00 0.00 H new ATOM 1462 N PHE A 100 -11.009 -0.080 -8.417 1.00 0.00 N ATOM 1463 CA PHE A 100 -12.307 -0.732 -8.295 1.00 0.00 C ATOM 1464 C PHE A 100 -12.996 -0.335 -6.993 1.00 0.00 C ATOM 1465 O PHE A 100 -12.464 -0.555 -5.905 1.00 0.00 O ATOM 1466 CB PHE A 100 -12.146 -2.252 -8.357 1.00 0.00 C ATOM 1467 CG PHE A 100 -11.703 -2.754 -9.701 1.00 0.00 C ATOM 1468 CD1 PHE A 100 -10.357 -2.806 -10.027 1.00 0.00 C ATOM 1469 CD2 PHE A 100 -12.632 -3.174 -10.640 1.00 0.00 C ATOM 1470 CE1 PHE A 100 -9.946 -3.267 -11.263 1.00 0.00 C ATOM 1471 CE2 PHE A 100 -12.227 -3.636 -11.877 1.00 0.00 C ATOM 1472 CZ PHE A 100 -10.882 -3.682 -12.190 1.00 0.00 C ATOM 0 H PHE A 100 -10.272 -0.498 -7.848 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.929 -0.405 -9.128 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.421 -2.563 -7.605 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -13.095 -2.721 -8.098 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -9.621 -2.482 -9.306 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -13.685 -3.140 -10.402 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.894 -3.303 -11.504 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -12.961 -3.961 -12.599 1.00 0.00 H new ATOM 0 HZ PHE A 100 -10.563 -4.042 -13.157 1.00 0.00 H new ATOM 1482 N ASP A 101 -14.182 0.252 -7.112 1.00 0.00 N ATOM 1483 CA ASP A 101 -14.944 0.680 -5.946 1.00 0.00 C ATOM 1484 C ASP A 101 -15.562 -0.517 -5.231 1.00 0.00 C ATOM 1485 O ASP A 101 -16.372 -1.246 -5.805 1.00 0.00 O ATOM 1486 CB ASP A 101 -16.040 1.665 -6.359 1.00 0.00 C ATOM 1487 CG ASP A 101 -15.665 3.104 -6.067 1.00 0.00 C ATOM 1488 OD1 ASP A 101 -14.947 3.341 -5.072 1.00 0.00 O ATOM 1489 OD2 ASP A 101 -16.088 3.994 -6.833 1.00 0.00 O ATOM 0 H ASP A 101 -14.636 0.442 -8.005 1.00 0.00 H new ATOM 0 HA ASP A 101 -14.260 1.177 -5.259 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -16.241 1.554 -7.424 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -16.962 1.419 -5.833 1.00 0.00 H new ATOM 1494 N VAL A 102 -15.174 -0.716 -3.975 1.00 0.00 N ATOM 1495 CA VAL A 102 -15.690 -1.825 -3.182 1.00 0.00 C ATOM 1496 C VAL A 102 -16.698 -1.339 -2.148 1.00 0.00 C ATOM 1497 O VAL A 102 -16.486 -0.320 -1.491 1.00 0.00 O ATOM 1498 CB VAL A 102 -14.554 -2.576 -2.462 1.00 0.00 C ATOM 1499 CG1 VAL A 102 -15.114 -3.712 -1.619 1.00 0.00 C ATOM 1500 CG2 VAL A 102 -13.539 -3.098 -3.468 1.00 0.00 C ATOM 0 H VAL A 102 -14.504 -0.123 -3.485 1.00 0.00 H new ATOM 0 HA VAL A 102 -16.184 -2.506 -3.875 1.00 0.00 H new ATOM 0 HB VAL A 102 -14.046 -1.878 -1.796 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -14.297 -4.231 -1.118 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -15.799 -3.308 -0.873 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -15.649 -4.412 -2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.744 -3.626 -2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -14.031 -3.781 -4.161 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -13.114 -2.262 -4.023 1.00 0.00 H new ATOM 1510 N GLU A 103 -17.796 -2.075 -2.007 1.00 0.00 N ATOM 1511 CA GLU A 103 -18.838 -1.718 -1.052 1.00 0.00 C ATOM 1512 C GLU A 103 -19.208 -2.913 -0.178 1.00 0.00 C ATOM 1513 O GLU A 103 -19.880 -3.842 -0.628 1.00 0.00 O ATOM 1514 CB GLU A 103 -20.079 -1.206 -1.785 1.00 0.00 C ATOM 1515 CG GLU A 103 -21.327 -1.172 -0.920 1.00 0.00 C ATOM 1516 CD GLU A 103 -21.161 -0.301 0.310 1.00 0.00 C ATOM 1517 OE1 GLU A 103 -20.452 -0.725 1.246 1.00 0.00 O ATOM 1518 OE2 GLU A 103 -21.741 0.805 0.337 1.00 0.00 O ATOM 0 H GLU A 103 -17.987 -2.922 -2.542 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.451 -0.926 -0.411 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.880 -0.202 -2.161 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.266 -1.840 -2.652 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.165 -0.803 -1.512 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.578 -2.187 -0.611 1.00 0.00 H new ATOM 1525 N LEU A 104 -18.763 -2.883 1.074 1.00 0.00 N ATOM 1526 CA LEU A 104 -19.046 -3.963 2.012 1.00 0.00 C ATOM 1527 C LEU A 104 -20.540 -4.050 2.308 1.00 0.00 C ATOM 1528 O LEU A 104 -21.181 -3.047 2.624 1.00 0.00 O ATOM 1529 CB LEU A 104 -18.268 -3.752 3.313 1.00 0.00 C ATOM 1530 CG LEU A 104 -17.823 -5.020 4.042 1.00 0.00 C ATOM 1531 CD1 LEU A 104 -18.952 -6.038 4.081 1.00 0.00 C ATOM 1532 CD2 LEU A 104 -16.590 -5.613 3.376 1.00 0.00 C ATOM 0 H LEU A 104 -18.205 -2.123 1.462 1.00 0.00 H new ATOM 0 HA LEU A 104 -18.730 -4.901 1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -17.383 -3.155 3.091 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -18.887 -3.165 3.992 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.565 -4.755 5.067 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.616 -6.934 4.604 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -19.808 -5.612 4.604 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.242 -6.299 3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.287 -6.515 3.908 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.821 -5.863 2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.778 -4.887 3.402 1.00 0.00 H new ATOM 1544 N LEU A 105 -21.088 -5.256 2.206 1.00 0.00 N ATOM 1545 CA LEU A 105 -22.507 -5.475 2.465 1.00 0.00 C ATOM 1546 C LEU A 105 -22.707 -6.327 3.714 1.00 0.00 C ATOM 1547 O LEU A 105 -23.679 -6.151 4.449 1.00 0.00 O ATOM 1548 CB LEU A 105 -23.167 -6.151 1.261 1.00 0.00 C ATOM 1549 CG LEU A 105 -23.550 -5.231 0.102 1.00 0.00 C ATOM 1550 CD1 LEU A 105 -24.204 -6.027 -1.017 1.00 0.00 C ATOM 1551 CD2 LEU A 105 -24.476 -4.124 0.583 1.00 0.00 C ATOM 0 H LEU A 105 -20.572 -6.097 1.946 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.975 -4.505 2.631 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.489 -6.916 0.883 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -24.066 -6.663 1.605 1.00 0.00 H new ATOM 0 HG LEU A 105 -22.641 -4.773 -0.289 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -24.470 -5.356 -1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -23.508 -6.783 -1.381 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -25.103 -6.514 -0.640 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -24.738 -3.479 -0.256 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -25.382 -4.563 1.000 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -23.972 -3.536 1.350 1.00 0.00 H new ATOM 1563 N ARG A 106 -21.780 -7.250 3.949 1.00 0.00 N ATOM 1564 CA ARG A 106 -21.855 -8.129 5.110 1.00 0.00 C ATOM 1565 C ARG A 106 -20.662 -9.080 5.149 1.00 0.00 C ATOM 1566 O ARG A 106 -19.901 -9.179 4.186 1.00 0.00 O ATOM 1567 CB ARG A 106 -23.158 -8.930 5.087 1.00 0.00 C ATOM 1568 CG ARG A 106 -23.482 -9.528 3.728 1.00 0.00 C ATOM 1569 CD ARG A 106 -24.142 -10.891 3.862 1.00 0.00 C ATOM 1570 NE ARG A 106 -25.566 -10.782 4.169 1.00 0.00 N ATOM 1571 CZ ARG A 106 -26.411 -11.804 4.108 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -25.979 -13.006 3.753 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -27.693 -11.626 4.403 1.00 0.00 N ATOM 0 H ARG A 106 -20.969 -7.408 3.351 1.00 0.00 H new ATOM 0 HA ARG A 106 -21.834 -7.509 6.006 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -23.094 -9.733 5.822 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -23.979 -8.282 5.394 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -24.142 -8.855 3.181 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -22.567 -9.622 3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -24.013 -11.449 2.935 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -23.644 -11.459 4.648 1.00 0.00 H new ATOM 0 HE ARG A 106 -25.931 -9.871 4.445 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -24.995 -13.148 3.526 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -26.631 -13.789 3.707 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -28.030 -10.703 4.677 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -28.341 -12.412 4.356 1.00 0.00 H new ATOM 1587 N VAL A 107 -20.504 -9.777 6.270 1.00 0.00 N ATOM 1588 CA VAL A 107 -19.404 -10.719 6.436 1.00 0.00 C ATOM 1589 C VAL A 107 -19.885 -12.019 7.072 1.00 0.00 C ATOM 1590 O VAL A 107 -20.757 -12.010 7.940 1.00 0.00 O ATOM 1591 CB VAL A 107 -18.278 -10.123 7.301 1.00 0.00 C ATOM 1592 CG1 VAL A 107 -18.815 -9.703 8.661 1.00 0.00 C ATOM 1593 CG2 VAL A 107 -17.139 -11.119 7.453 1.00 0.00 C ATOM 0 H VAL A 107 -21.124 -9.707 7.077 1.00 0.00 H new ATOM 0 HA VAL A 107 -19.014 -10.927 5.440 1.00 0.00 H new ATOM 0 HB VAL A 107 -17.890 -9.236 6.800 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -18.005 -9.284 9.258 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -19.594 -8.952 8.529 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -19.231 -10.571 9.172 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -16.352 -10.681 8.067 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -17.510 -12.026 7.931 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -16.737 -11.365 6.470 1.00 0.00 H new ATOM 1603 N GLU A 108 -19.310 -13.134 6.634 1.00 0.00 N ATOM 1604 CA GLU A 108 -19.681 -14.442 7.161 1.00 0.00 C ATOM 1605 C GLU A 108 -18.442 -15.246 7.544 1.00 0.00 C ATOM 1606 O GLU A 108 -17.553 -15.464 6.722 1.00 0.00 O ATOM 1607 CB GLU A 108 -20.506 -15.217 6.131 1.00 0.00 C ATOM 1608 CG GLU A 108 -21.895 -14.643 5.908 1.00 0.00 C ATOM 1609 CD GLU A 108 -22.887 -15.091 6.964 1.00 0.00 C ATOM 1610 OE1 GLU A 108 -22.801 -16.258 7.401 1.00 0.00 O ATOM 1611 OE2 GLU A 108 -23.749 -14.275 7.353 1.00 0.00 O ATOM 0 H GLU A 108 -18.586 -13.158 5.916 1.00 0.00 H new ATOM 0 HA GLU A 108 -20.283 -14.286 8.056 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -19.970 -15.228 5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -20.598 -16.253 6.457 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -21.838 -13.554 5.906 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -22.255 -14.945 4.925 1.00 0.00 H new