USER MOD reduce.3.24.130724 H: found=0, std=0, add=622, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 618 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 59 CYS SG : rot 160:sc= 0.95 USER MOD Set 1.2: A 71 HIS : no HE2:sc= -0.275 K(o=0.97,f=-3.2!) USER MOD Set 1.3: A 73 SER OG : rot 98:sc= 1.03 USER MOD Set 1.4: A 74 ASN : amide:sc= -0.743 X(o=0.97,f=1.1) USER MOD Set 2.1: A 14 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 17 MET CE :methyl -137:sc= -2.08! (180deg=-2.99!) USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.0572 (180deg=0) USER MOD Single : A 2 SER OG : rot 43:sc= 0.163 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 150:sc= -2.19 USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -1.85 K(o=-1.9,f=-3.2!) USER MOD Single : A 29 TYR OH : rot 17:sc= -0.123 USER MOD Single : A 33 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -127:sc= 0.228 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 80 ASN : amide:sc= -0.145 X(o=-0.15,f=-0.00046) USER MOD Single : A 81 SER OG : rot 51:sc= 0.73 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.555 22.262 -8.896 1.00 0.00 N ATOM 2 CA GLY A 1 -2.938 21.900 -7.632 1.00 0.00 C ATOM 3 C GLY A 1 -3.343 20.517 -7.165 1.00 0.00 C ATOM 4 O GLY A 1 -3.747 19.676 -7.968 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.824 22.595 -9.557 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.034 21.431 -9.299 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.250 23.020 -8.739 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.854 21.942 -7.735 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.215 22.632 -6.873 1.00 0.00 H new ATOM 8 N SER A 2 -3.233 20.279 -5.862 1.00 0.00 N ATOM 9 CA SER A 2 -3.586 18.985 -5.289 1.00 0.00 C ATOM 10 C SER A 2 -3.810 19.100 -3.783 1.00 0.00 C ATOM 11 O SER A 2 -3.129 19.865 -3.101 1.00 0.00 O ATOM 12 CB SER A 2 -2.488 17.960 -5.575 1.00 0.00 C ATOM 13 OG SER A 2 -2.852 17.108 -6.648 1.00 0.00 O ATOM 0 H SER A 2 -2.902 20.965 -5.183 1.00 0.00 H new ATOM 0 HA SER A 2 -4.514 18.652 -5.753 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.558 18.476 -5.815 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.300 17.365 -4.681 1.00 0.00 H new ATOM 0 HG SER A 2 -3.252 17.640 -7.367 1.00 0.00 H new ATOM 19 N SER A 3 -4.770 18.335 -3.274 1.00 0.00 N ATOM 20 CA SER A 3 -5.086 18.353 -1.851 1.00 0.00 C ATOM 21 C SER A 3 -5.993 17.182 -1.481 1.00 0.00 C ATOM 22 O SER A 3 -7.217 17.297 -1.512 1.00 0.00 O ATOM 23 CB SER A 3 -5.761 19.674 -1.475 1.00 0.00 C ATOM 24 OG SER A 3 -6.155 19.675 -0.113 1.00 0.00 O ATOM 0 H SER A 3 -5.342 17.695 -3.825 1.00 0.00 H new ATOM 0 HA SER A 3 -4.153 18.257 -1.295 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.076 20.502 -1.659 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.633 19.834 -2.109 1.00 0.00 H new ATOM 0 HG SER A 3 -6.582 20.530 0.103 1.00 0.00 H new ATOM 30 N GLY A 4 -5.381 16.055 -1.133 1.00 0.00 N ATOM 31 CA GLY A 4 -6.146 14.879 -0.763 1.00 0.00 C ATOM 32 C GLY A 4 -5.262 13.694 -0.427 1.00 0.00 C ATOM 33 O GLY A 4 -4.039 13.822 -0.360 1.00 0.00 O ATOM 0 H GLY A 4 -4.369 15.935 -1.101 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.775 15.114 0.096 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.813 14.610 -1.583 1.00 0.00 H new ATOM 37 N SER A 5 -5.882 12.538 -0.212 1.00 0.00 N ATOM 38 CA SER A 5 -5.143 11.326 0.125 1.00 0.00 C ATOM 39 C SER A 5 -6.061 10.107 0.102 1.00 0.00 C ATOM 40 O SER A 5 -6.709 9.786 1.097 1.00 0.00 O ATOM 41 CB SER A 5 -4.495 11.465 1.504 1.00 0.00 C ATOM 42 OG SER A 5 -3.082 11.442 1.408 1.00 0.00 O ATOM 0 H SER A 5 -6.893 12.415 -0.265 1.00 0.00 H new ATOM 0 HA SER A 5 -4.362 11.186 -0.622 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.816 12.398 1.968 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.832 10.655 2.151 1.00 0.00 H new ATOM 0 HG SER A 5 -2.692 11.534 2.302 1.00 0.00 H new ATOM 48 N SER A 6 -6.108 9.432 -1.043 1.00 0.00 N ATOM 49 CA SER A 6 -6.948 8.250 -1.198 1.00 0.00 C ATOM 50 C SER A 6 -6.107 6.978 -1.168 1.00 0.00 C ATOM 51 O SER A 6 -6.111 6.195 -2.118 1.00 0.00 O ATOM 52 CB SER A 6 -7.733 8.326 -2.509 1.00 0.00 C ATOM 53 OG SER A 6 -8.834 9.211 -2.394 1.00 0.00 O ATOM 0 H SER A 6 -5.575 9.683 -1.876 1.00 0.00 H new ATOM 0 HA SER A 6 -7.649 8.220 -0.364 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.075 8.661 -3.311 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.088 7.332 -2.782 1.00 0.00 H new ATOM 0 HG SER A 6 -9.020 9.617 -3.266 1.00 0.00 H new ATOM 59 N GLY A 7 -5.384 6.778 -0.070 1.00 0.00 N ATOM 60 CA GLY A 7 -4.547 5.600 0.064 1.00 0.00 C ATOM 61 C GLY A 7 -5.014 4.681 1.175 1.00 0.00 C ATOM 62 O GLY A 7 -5.884 5.044 1.967 1.00 0.00 O ATOM 0 H GLY A 7 -5.363 7.411 0.729 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.542 5.052 -0.878 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.520 5.908 0.259 1.00 0.00 H new ATOM 66 N VAL A 8 -4.436 3.486 1.234 1.00 0.00 N ATOM 67 CA VAL A 8 -4.797 2.510 2.255 1.00 0.00 C ATOM 68 C VAL A 8 -3.585 1.698 2.694 1.00 0.00 C ATOM 69 O VAL A 8 -2.634 1.522 1.932 1.00 0.00 O ATOM 70 CB VAL A 8 -5.891 1.549 1.751 1.00 0.00 C ATOM 71 CG1 VAL A 8 -7.269 2.169 1.927 1.00 0.00 C ATOM 72 CG2 VAL A 8 -5.646 1.180 0.296 1.00 0.00 C ATOM 0 H VAL A 8 -3.715 3.170 0.586 1.00 0.00 H new ATOM 0 HA VAL A 8 -5.181 3.071 3.107 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.851 0.636 2.346 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.029 1.476 1.566 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.442 2.378 2.983 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.325 3.098 1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.428 0.501 -0.044 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -5.658 2.082 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -4.676 0.692 0.203 1.00 0.00 H new ATOM 82 N PHE A 9 -3.625 1.205 3.928 1.00 0.00 N ATOM 83 CA PHE A 9 -2.529 0.410 4.468 1.00 0.00 C ATOM 84 C PHE A 9 -2.807 -1.081 4.310 1.00 0.00 C ATOM 85 O PHE A 9 -3.867 -1.572 4.699 1.00 0.00 O ATOM 86 CB PHE A 9 -2.310 0.744 5.946 1.00 0.00 C ATOM 87 CG PHE A 9 -1.654 2.078 6.168 1.00 0.00 C ATOM 88 CD1 PHE A 9 -0.349 2.300 5.761 1.00 0.00 C ATOM 89 CD2 PHE A 9 -2.345 3.109 6.784 1.00 0.00 C ATOM 90 CE1 PHE A 9 0.256 3.526 5.964 1.00 0.00 C ATOM 91 CE2 PHE A 9 -1.746 4.338 6.988 1.00 0.00 C ATOM 92 CZ PHE A 9 -0.442 4.546 6.579 1.00 0.00 C ATOM 0 H PHE A 9 -4.404 1.342 4.572 1.00 0.00 H new ATOM 0 HA PHE A 9 -1.627 0.654 3.908 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -3.271 0.731 6.460 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -1.696 -0.034 6.399 1.00 0.00 H new ATOM 0 HD1 PHE A 9 0.202 1.506 5.279 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -3.363 2.951 7.108 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.274 3.686 5.642 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -2.296 5.135 7.466 1.00 0.00 H new ATOM 0 HZ PHE A 9 0.030 5.504 6.740 1.00 0.00 H new ATOM 102 N VAL A 10 -1.848 -1.799 3.732 1.00 0.00 N ATOM 103 CA VAL A 10 -1.989 -3.235 3.521 1.00 0.00 C ATOM 104 C VAL A 10 -1.076 -4.019 4.456 1.00 0.00 C ATOM 105 O VAL A 10 0.064 -4.328 4.114 1.00 0.00 O ATOM 106 CB VAL A 10 -1.668 -3.621 2.064 1.00 0.00 C ATOM 107 CG1 VAL A 10 -2.052 -5.068 1.800 1.00 0.00 C ATOM 108 CG2 VAL A 10 -2.377 -2.687 1.097 1.00 0.00 C ATOM 0 H VAL A 10 -0.965 -1.409 3.402 1.00 0.00 H new ATOM 0 HA VAL A 10 -3.027 -3.487 3.736 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.594 -3.520 1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.818 -5.324 0.766 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.493 -5.721 2.470 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.120 -5.198 1.974 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.139 -2.974 0.073 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.454 -2.753 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.047 -1.663 1.272 1.00 0.00 H new ATOM 118 N GLY A 11 -1.588 -4.340 5.641 1.00 0.00 N ATOM 119 CA GLY A 11 -0.805 -5.087 6.608 1.00 0.00 C ATOM 120 C GLY A 11 -0.608 -6.535 6.202 1.00 0.00 C ATOM 121 O GLY A 11 -0.790 -6.888 5.037 1.00 0.00 O ATOM 0 H GLY A 11 -2.530 -4.096 5.948 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.168 -4.611 6.728 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.300 -5.049 7.578 1.00 0.00 H new ATOM 125 N ARG A 12 -0.233 -7.372 7.163 1.00 0.00 N ATOM 126 CA ARG A 12 -0.007 -8.788 6.897 1.00 0.00 C ATOM 127 C ARG A 12 0.709 -8.984 5.564 1.00 0.00 C ATOM 128 O ARG A 12 0.414 -9.920 4.821 1.00 0.00 O ATOM 129 CB ARG A 12 -1.337 -9.545 6.890 1.00 0.00 C ATOM 130 CG ARG A 12 -2.040 -9.555 8.238 1.00 0.00 C ATOM 131 CD ARG A 12 -3.427 -10.170 8.137 1.00 0.00 C ATOM 132 NE ARG A 12 -3.776 -10.928 9.336 1.00 0.00 N ATOM 133 CZ ARG A 12 -4.965 -11.489 9.530 1.00 0.00 C ATOM 134 NH1 ARG A 12 -5.912 -11.378 8.610 1.00 0.00 N ATOM 135 NH2 ARG A 12 -5.207 -12.164 10.647 1.00 0.00 N ATOM 0 H ARG A 12 -0.079 -7.095 8.132 1.00 0.00 H new ATOM 0 HA ARG A 12 0.626 -9.185 7.691 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -1.997 -9.095 6.149 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -1.158 -10.573 6.575 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -1.443 -10.116 8.957 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -2.119 -8.536 8.616 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.163 -9.382 7.979 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.471 -10.826 7.267 1.00 0.00 H new ATOM 0 HE ARG A 12 -3.069 -11.032 10.064 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.729 -10.861 7.750 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.824 -11.810 8.762 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -4.480 -12.252 11.357 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.120 -12.594 10.795 1.00 0.00 H new ATOM 149 N CYS A 13 1.651 -8.095 5.269 1.00 0.00 N ATOM 150 CA CYS A 13 2.409 -8.169 4.025 1.00 0.00 C ATOM 151 C CYS A 13 3.790 -8.768 4.265 1.00 0.00 C ATOM 152 O CYS A 13 4.192 -8.991 5.408 1.00 0.00 O ATOM 153 CB CYS A 13 2.543 -6.779 3.401 1.00 0.00 C ATOM 154 SG CYS A 13 1.804 -6.631 1.758 1.00 0.00 S ATOM 0 H CYS A 13 1.908 -7.315 5.874 1.00 0.00 H new ATOM 0 HA CYS A 13 1.867 -8.817 3.336 1.00 0.00 H new ATOM 0 HB2 CYS A 13 2.078 -6.049 4.064 1.00 0.00 H new ATOM 0 HB3 CYS A 13 3.600 -6.522 3.336 1.00 0.00 H new ATOM 0 HG CYS A 13 1.967 -5.419 1.316 1.00 0.00 H new ATOM 160 N THR A 14 4.514 -9.029 3.180 1.00 0.00 N ATOM 161 CA THR A 14 5.848 -9.605 3.273 1.00 0.00 C ATOM 162 C THR A 14 6.847 -8.815 2.434 1.00 0.00 C ATOM 163 O THR A 14 6.510 -8.307 1.365 1.00 0.00 O ATOM 164 CB THR A 14 5.859 -11.075 2.813 1.00 0.00 C ATOM 165 OG1 THR A 14 5.601 -11.151 1.406 1.00 0.00 O ATOM 166 CG2 THR A 14 4.818 -11.886 3.569 1.00 0.00 C ATOM 0 H THR A 14 4.197 -8.850 2.227 1.00 0.00 H new ATOM 0 HA THR A 14 6.140 -9.558 4.322 1.00 0.00 H new ATOM 0 HB THR A 14 6.844 -11.491 3.024 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.612 -12.089 1.122 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.844 -12.921 3.227 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.034 -11.851 4.637 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.828 -11.468 3.386 1.00 0.00 H new ATOM 174 N GLY A 15 8.079 -8.716 2.926 1.00 0.00 N ATOM 175 CA GLY A 15 9.108 -7.987 2.208 1.00 0.00 C ATOM 176 C GLY A 15 9.285 -8.484 0.787 1.00 0.00 C ATOM 177 O GLY A 15 9.402 -7.688 -0.146 1.00 0.00 O ATOM 0 H GLY A 15 8.382 -9.128 3.809 1.00 0.00 H new ATOM 0 HA2 GLY A 15 8.853 -6.927 2.190 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.054 -8.078 2.742 1.00 0.00 H new ATOM 181 N ASP A 16 9.309 -9.801 0.621 1.00 0.00 N ATOM 182 CA ASP A 16 9.475 -10.402 -0.698 1.00 0.00 C ATOM 183 C ASP A 16 8.700 -9.621 -1.753 1.00 0.00 C ATOM 184 O ASP A 16 9.255 -9.220 -2.775 1.00 0.00 O ATOM 185 CB ASP A 16 9.009 -11.860 -0.679 1.00 0.00 C ATOM 186 CG ASP A 16 10.007 -12.795 -1.333 1.00 0.00 C ATOM 187 OD1 ASP A 16 11.137 -12.912 -0.815 1.00 0.00 O ATOM 188 OD2 ASP A 16 9.658 -13.409 -2.363 1.00 0.00 O ATOM 0 H ASP A 16 9.216 -10.473 1.382 1.00 0.00 H new ATOM 0 HA ASP A 16 10.534 -10.370 -0.954 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.845 -12.172 0.352 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.051 -11.939 -1.193 1.00 0.00 H new ATOM 193 N MET A 17 7.413 -9.408 -1.498 1.00 0.00 N ATOM 194 CA MET A 17 6.561 -8.675 -2.427 1.00 0.00 C ATOM 195 C MET A 17 7.141 -7.294 -2.722 1.00 0.00 C ATOM 196 O MET A 17 7.875 -6.731 -1.909 1.00 0.00 O ATOM 197 CB MET A 17 5.149 -8.535 -1.856 1.00 0.00 C ATOM 198 CG MET A 17 4.377 -9.844 -1.819 1.00 0.00 C ATOM 199 SD MET A 17 2.616 -9.603 -1.512 1.00 0.00 S ATOM 200 CE MET A 17 2.228 -11.087 -0.586 1.00 0.00 C ATOM 0 H MET A 17 6.938 -9.733 -0.656 1.00 0.00 H new ATOM 0 HA MET A 17 6.514 -9.238 -3.359 1.00 0.00 H new ATOM 0 HB2 MET A 17 5.213 -8.131 -0.846 1.00 0.00 H new ATOM 0 HB3 MET A 17 4.594 -7.812 -2.454 1.00 0.00 H new ATOM 0 HG2 MET A 17 4.509 -10.366 -2.767 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.793 -10.485 -1.042 1.00 0.00 H new ATOM 0 HE1 MET A 17 1.284 -11.500 -0.940 1.00 0.00 H new ATOM 0 HE2 MET A 17 3.021 -11.821 -0.727 1.00 0.00 H new ATOM 0 HE3 MET A 17 2.143 -10.843 0.473 1.00 0.00 H new ATOM 210 N THR A 18 6.809 -6.755 -3.890 1.00 0.00 N ATOM 211 CA THR A 18 7.297 -5.442 -4.293 1.00 0.00 C ATOM 212 C THR A 18 6.161 -4.566 -4.807 1.00 0.00 C ATOM 213 O THR A 18 5.147 -5.069 -5.290 1.00 0.00 O ATOM 214 CB THR A 18 8.377 -5.556 -5.386 1.00 0.00 C ATOM 215 OG1 THR A 18 7.912 -6.397 -6.449 1.00 0.00 O ATOM 216 CG2 THR A 18 9.668 -6.121 -4.814 1.00 0.00 C ATOM 0 H THR A 18 6.203 -7.208 -4.575 1.00 0.00 H new ATOM 0 HA THR A 18 7.734 -4.982 -3.407 1.00 0.00 H new ATOM 0 HB THR A 18 8.576 -4.557 -5.774 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.603 -6.463 -7.140 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.416 -6.192 -5.604 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.035 -5.464 -4.026 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.480 -7.112 -4.402 1.00 0.00 H new ATOM 224 N GLU A 19 6.336 -3.252 -4.699 1.00 0.00 N ATOM 225 CA GLU A 19 5.324 -2.307 -5.153 1.00 0.00 C ATOM 226 C GLU A 19 4.763 -2.721 -6.510 1.00 0.00 C ATOM 227 O GLU A 19 3.606 -2.444 -6.827 1.00 0.00 O ATOM 228 CB GLU A 19 5.913 -0.898 -5.240 1.00 0.00 C ATOM 229 CG GLU A 19 6.527 -0.412 -3.938 1.00 0.00 C ATOM 230 CD GLU A 19 8.037 -0.292 -4.013 1.00 0.00 C ATOM 231 OE1 GLU A 19 8.534 0.314 -4.985 1.00 0.00 O ATOM 232 OE2 GLU A 19 8.719 -0.802 -3.101 1.00 0.00 O ATOM 0 H GLU A 19 7.169 -2.819 -4.301 1.00 0.00 H new ATOM 0 HA GLU A 19 4.510 -2.308 -4.428 1.00 0.00 H new ATOM 0 HB2 GLU A 19 6.674 -0.879 -6.020 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.129 -0.204 -5.543 1.00 0.00 H new ATOM 0 HG2 GLU A 19 6.102 0.558 -3.680 1.00 0.00 H new ATOM 0 HG3 GLU A 19 6.261 -1.100 -3.136 1.00 0.00 H new ATOM 239 N ASP A 20 5.592 -3.385 -7.309 1.00 0.00 N ATOM 240 CA ASP A 20 5.179 -3.838 -8.632 1.00 0.00 C ATOM 241 C ASP A 20 4.083 -4.894 -8.528 1.00 0.00 C ATOM 242 O ASP A 20 3.040 -4.783 -9.169 1.00 0.00 O ATOM 243 CB ASP A 20 6.377 -4.402 -9.397 1.00 0.00 C ATOM 244 CG ASP A 20 6.105 -4.535 -10.882 1.00 0.00 C ATOM 245 OD1 ASP A 20 4.930 -4.735 -11.255 1.00 0.00 O ATOM 246 OD2 ASP A 20 7.068 -4.440 -11.673 1.00 0.00 O ATOM 0 H ASP A 20 6.553 -3.621 -7.063 1.00 0.00 H new ATOM 0 HA ASP A 20 4.781 -2.981 -9.175 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.239 -3.753 -9.245 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.637 -5.379 -8.989 1.00 0.00 H new ATOM 251 N GLU A 21 4.330 -5.918 -7.718 1.00 0.00 N ATOM 252 CA GLU A 21 3.364 -6.994 -7.532 1.00 0.00 C ATOM 253 C GLU A 21 2.006 -6.441 -7.113 1.00 0.00 C ATOM 254 O GLU A 21 1.003 -6.638 -7.800 1.00 0.00 O ATOM 255 CB GLU A 21 3.868 -7.986 -6.482 1.00 0.00 C ATOM 256 CG GLU A 21 5.169 -8.671 -6.866 1.00 0.00 C ATOM 257 CD GLU A 21 5.218 -10.121 -6.425 1.00 0.00 C ATOM 258 OE1 GLU A 21 4.225 -10.844 -6.649 1.00 0.00 O ATOM 259 OE2 GLU A 21 6.250 -10.533 -5.855 1.00 0.00 O ATOM 0 H GLU A 21 5.190 -6.025 -7.180 1.00 0.00 H new ATOM 0 HA GLU A 21 3.248 -7.511 -8.485 1.00 0.00 H new ATOM 0 HB2 GLU A 21 4.009 -7.461 -5.537 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.103 -8.745 -6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 21 5.297 -8.620 -7.947 1.00 0.00 H new ATOM 0 HG3 GLU A 21 6.005 -8.131 -6.420 1.00 0.00 H new ATOM 266 N LEU A 22 1.980 -5.746 -5.981 1.00 0.00 N ATOM 267 CA LEU A 22 0.746 -5.163 -5.468 1.00 0.00 C ATOM 268 C LEU A 22 0.162 -4.163 -6.461 1.00 0.00 C ATOM 269 O LEU A 22 -1.046 -4.143 -6.701 1.00 0.00 O ATOM 270 CB LEU A 22 1.001 -4.474 -4.126 1.00 0.00 C ATOM 271 CG LEU A 22 1.494 -5.375 -2.993 1.00 0.00 C ATOM 272 CD1 LEU A 22 2.485 -4.631 -2.111 1.00 0.00 C ATOM 273 CD2 LEU A 22 0.321 -5.885 -2.169 1.00 0.00 C ATOM 0 H LEU A 22 2.801 -5.573 -5.401 1.00 0.00 H new ATOM 0 HA LEU A 22 0.026 -5.969 -5.325 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.735 -3.683 -4.280 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.077 -3.993 -3.805 1.00 0.00 H new ATOM 0 HG LEU A 22 2.004 -6.233 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.825 -5.288 -1.311 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.340 -4.316 -2.709 1.00 0.00 H new ATOM 0 HD13 LEU A 22 2.002 -3.754 -1.680 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.690 -6.525 -1.367 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.217 -5.040 -1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.352 -6.457 -2.808 1.00 0.00 H new ATOM 285 N ARG A 23 1.027 -3.337 -7.039 1.00 0.00 N ATOM 286 CA ARG A 23 0.598 -2.336 -8.009 1.00 0.00 C ATOM 287 C ARG A 23 -0.105 -2.992 -9.194 1.00 0.00 C ATOM 288 O ARG A 23 -1.033 -2.425 -9.768 1.00 0.00 O ATOM 289 CB ARG A 23 1.798 -1.523 -8.500 1.00 0.00 C ATOM 290 CG ARG A 23 1.462 -0.566 -9.632 1.00 0.00 C ATOM 291 CD ARG A 23 2.311 0.693 -9.567 1.00 0.00 C ATOM 292 NE ARG A 23 2.496 1.297 -10.884 1.00 0.00 N ATOM 293 CZ ARG A 23 3.497 2.118 -11.182 1.00 0.00 C ATOM 294 NH1 ARG A 23 4.399 2.431 -10.261 1.00 0.00 N ATOM 295 NH2 ARG A 23 3.599 2.628 -12.403 1.00 0.00 N ATOM 0 H ARG A 23 2.030 -3.341 -6.853 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.108 -1.668 -7.515 1.00 0.00 H new ATOM 0 HB2 ARG A 23 2.208 -0.955 -7.665 1.00 0.00 H new ATOM 0 HB3 ARG A 23 2.578 -2.207 -8.833 1.00 0.00 H new ATOM 0 HG2 ARG A 23 1.619 -1.063 -10.589 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.407 -0.298 -9.582 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.839 1.415 -8.900 1.00 0.00 H new ATOM 0 HD3 ARG A 23 3.284 0.452 -9.139 1.00 0.00 H new ATOM 0 HE ARG A 23 1.820 1.076 -11.615 1.00 0.00 H new ATOM 0 HH11 ARG A 23 4.325 2.041 -9.321 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.167 3.062 -10.492 1.00 0.00 H new ATOM 0 HH21 ARG A 23 2.908 2.390 -13.115 1.00 0.00 H new ATOM 0 HH22 ARG A 23 4.368 3.258 -12.630 1.00 0.00 H new ATOM 309 N GLU A 24 0.346 -4.190 -9.553 1.00 0.00 N ATOM 310 CA GLU A 24 -0.240 -4.922 -10.670 1.00 0.00 C ATOM 311 C GLU A 24 -1.438 -5.748 -10.211 1.00 0.00 C ATOM 312 O GLU A 24 -2.335 -6.051 -10.998 1.00 0.00 O ATOM 313 CB GLU A 24 0.806 -5.835 -11.314 1.00 0.00 C ATOM 314 CG GLU A 24 1.340 -5.311 -12.636 1.00 0.00 C ATOM 315 CD GLU A 24 0.312 -5.375 -13.748 1.00 0.00 C ATOM 316 OE1 GLU A 24 -0.804 -4.849 -13.556 1.00 0.00 O ATOM 317 OE2 GLU A 24 0.624 -5.951 -14.811 1.00 0.00 O ATOM 0 H GLU A 24 1.114 -4.674 -9.087 1.00 0.00 H new ATOM 0 HA GLU A 24 -0.583 -4.196 -11.407 1.00 0.00 H new ATOM 0 HB2 GLU A 24 1.638 -5.965 -10.622 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.367 -6.820 -11.474 1.00 0.00 H new ATOM 0 HG2 GLU A 24 1.667 -4.279 -12.508 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.217 -5.890 -12.924 1.00 0.00 H new ATOM 324 N PHE A 25 -1.446 -6.109 -8.932 1.00 0.00 N ATOM 325 CA PHE A 25 -2.533 -6.900 -8.368 1.00 0.00 C ATOM 326 C PHE A 25 -3.765 -6.034 -8.120 1.00 0.00 C ATOM 327 O PHE A 25 -4.898 -6.477 -8.314 1.00 0.00 O ATOM 328 CB PHE A 25 -2.087 -7.558 -7.060 1.00 0.00 C ATOM 329 CG PHE A 25 -3.198 -8.261 -6.334 1.00 0.00 C ATOM 330 CD1 PHE A 25 -3.642 -9.503 -6.757 1.00 0.00 C ATOM 331 CD2 PHE A 25 -3.798 -7.680 -5.228 1.00 0.00 C ATOM 332 CE1 PHE A 25 -4.665 -10.154 -6.091 1.00 0.00 C ATOM 333 CE2 PHE A 25 -4.819 -8.325 -4.558 1.00 0.00 C ATOM 334 CZ PHE A 25 -5.254 -9.564 -4.991 1.00 0.00 C ATOM 0 H PHE A 25 -0.712 -5.866 -8.267 1.00 0.00 H new ATOM 0 HA PHE A 25 -2.795 -7.676 -9.087 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -1.294 -8.274 -7.275 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -1.661 -6.797 -6.406 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -3.184 -9.969 -7.617 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -3.463 -6.712 -4.886 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -5.002 -11.122 -6.431 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -5.277 -7.862 -3.697 1.00 0.00 H new ATOM 0 HZ PHE A 25 -6.053 -10.069 -4.469 1.00 0.00 H new ATOM 344 N PHE A 26 -3.535 -4.798 -7.691 1.00 0.00 N ATOM 345 CA PHE A 26 -4.625 -3.869 -7.415 1.00 0.00 C ATOM 346 C PHE A 26 -5.106 -3.198 -8.699 1.00 0.00 C ATOM 347 O PHE A 26 -6.202 -2.640 -8.747 1.00 0.00 O ATOM 348 CB PHE A 26 -4.177 -2.808 -6.408 1.00 0.00 C ATOM 349 CG PHE A 26 -4.115 -3.312 -4.994 1.00 0.00 C ATOM 350 CD1 PHE A 26 -5.277 -3.601 -4.297 1.00 0.00 C ATOM 351 CD2 PHE A 26 -2.895 -3.495 -4.363 1.00 0.00 C ATOM 352 CE1 PHE A 26 -5.222 -4.065 -2.995 1.00 0.00 C ATOM 353 CE2 PHE A 26 -2.835 -3.959 -3.063 1.00 0.00 C ATOM 354 CZ PHE A 26 -4.000 -4.243 -2.378 1.00 0.00 C ATOM 0 H PHE A 26 -2.604 -4.416 -7.527 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.453 -4.436 -6.990 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.194 -2.437 -6.697 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.863 -1.962 -6.454 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.235 -3.463 -4.775 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.981 -3.272 -4.893 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.134 -4.288 -2.462 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -1.878 -4.099 -2.583 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.955 -4.604 -1.361 1.00 0.00 H new ATOM 364 N SER A 27 -4.277 -3.257 -9.736 1.00 0.00 N ATOM 365 CA SER A 27 -4.614 -2.651 -11.019 1.00 0.00 C ATOM 366 C SER A 27 -5.912 -3.233 -11.570 1.00 0.00 C ATOM 367 O SER A 27 -6.651 -2.560 -12.287 1.00 0.00 O ATOM 368 CB SER A 27 -3.479 -2.866 -12.022 1.00 0.00 C ATOM 369 OG SER A 27 -3.029 -1.632 -12.554 1.00 0.00 O ATOM 0 H SER A 27 -3.367 -3.718 -9.713 1.00 0.00 H new ATOM 0 HA SER A 27 -4.753 -1.581 -10.863 1.00 0.00 H new ATOM 0 HB2 SER A 27 -2.650 -3.379 -11.534 1.00 0.00 H new ATOM 0 HB3 SER A 27 -3.822 -3.511 -12.831 1.00 0.00 H new ATOM 0 HG SER A 27 -2.302 -1.796 -13.191 1.00 0.00 H new ATOM 375 N GLN A 28 -6.182 -4.489 -11.229 1.00 0.00 N ATOM 376 CA GLN A 28 -7.389 -5.164 -11.690 1.00 0.00 C ATOM 377 C GLN A 28 -8.619 -4.640 -10.955 1.00 0.00 C ATOM 378 O GLN A 28 -9.707 -4.558 -11.526 1.00 0.00 O ATOM 379 CB GLN A 28 -7.264 -6.674 -11.487 1.00 0.00 C ATOM 380 CG GLN A 28 -7.225 -7.092 -10.026 1.00 0.00 C ATOM 381 CD GLN A 28 -6.297 -8.264 -9.778 1.00 0.00 C ATOM 382 OE1 GLN A 28 -5.303 -8.444 -10.482 1.00 0.00 O ATOM 383 NE2 GLN A 28 -6.618 -9.071 -8.774 1.00 0.00 N ATOM 0 H GLN A 28 -5.581 -5.060 -10.635 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.507 -4.957 -12.754 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -8.104 -7.168 -11.975 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -6.358 -7.024 -11.981 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.905 -6.245 -9.419 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -8.231 -7.355 -9.701 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -7.451 -8.884 -8.216 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.031 -9.878 -8.561 1.00 0.00 H new ATOM 392 N TYR A 29 -8.438 -4.286 -9.688 1.00 0.00 N ATOM 393 CA TYR A 29 -9.534 -3.773 -8.874 1.00 0.00 C ATOM 394 C TYR A 29 -9.987 -2.403 -9.372 1.00 0.00 C ATOM 395 O TYR A 29 -11.168 -2.185 -9.636 1.00 0.00 O ATOM 396 CB TYR A 29 -9.108 -3.680 -7.409 1.00 0.00 C ATOM 397 CG TYR A 29 -9.017 -5.022 -6.718 1.00 0.00 C ATOM 398 CD1 TYR A 29 -7.892 -5.825 -6.864 1.00 0.00 C ATOM 399 CD2 TYR A 29 -10.054 -5.487 -5.920 1.00 0.00 C ATOM 400 CE1 TYR A 29 -7.805 -7.052 -6.235 1.00 0.00 C ATOM 401 CE2 TYR A 29 -9.975 -6.713 -5.287 1.00 0.00 C ATOM 402 CZ TYR A 29 -8.849 -7.492 -5.449 1.00 0.00 C ATOM 403 OH TYR A 29 -8.764 -8.713 -4.820 1.00 0.00 O ATOM 0 H TYR A 29 -7.543 -4.345 -9.202 1.00 0.00 H new ATOM 0 HA TYR A 29 -10.371 -4.466 -8.959 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -8.139 -3.185 -7.352 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.819 -3.052 -6.872 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.072 -5.484 -7.479 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -10.938 -4.880 -5.792 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.923 -7.664 -6.358 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -10.790 -7.059 -4.669 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.831 -9.012 -4.810 1.00 0.00 H new ATOM 413 N GLY A 30 -9.036 -1.482 -9.497 1.00 0.00 N ATOM 414 CA GLY A 30 -9.355 -0.146 -9.963 1.00 0.00 C ATOM 415 C GLY A 30 -8.182 0.524 -10.651 1.00 0.00 C ATOM 416 O GLY A 30 -7.629 -0.011 -11.612 1.00 0.00 O ATOM 0 H GLY A 30 -8.051 -1.638 -9.284 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.197 -0.197 -10.654 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.673 0.464 -9.118 1.00 0.00 H new ATOM 420 N ASP A 31 -7.801 1.698 -10.160 1.00 0.00 N ATOM 421 CA ASP A 31 -6.687 2.443 -10.734 1.00 0.00 C ATOM 422 C ASP A 31 -5.733 2.920 -9.644 1.00 0.00 C ATOM 423 O ASP A 31 -5.913 3.998 -9.076 1.00 0.00 O ATOM 424 CB ASP A 31 -7.203 3.637 -11.537 1.00 0.00 C ATOM 425 CG ASP A 31 -7.238 3.362 -13.027 1.00 0.00 C ATOM 426 OD1 ASP A 31 -7.418 2.186 -13.410 1.00 0.00 O ATOM 427 OD2 ASP A 31 -7.086 4.321 -13.811 1.00 0.00 O ATOM 0 H ASP A 31 -8.248 2.155 -9.365 1.00 0.00 H new ATOM 0 HA ASP A 31 -6.142 1.776 -11.402 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.205 3.895 -11.195 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.568 4.502 -11.345 1.00 0.00 H new ATOM 432 N VAL A 32 -4.719 2.111 -9.354 1.00 0.00 N ATOM 433 CA VAL A 32 -3.737 2.451 -8.332 1.00 0.00 C ATOM 434 C VAL A 32 -2.741 3.483 -8.848 1.00 0.00 C ATOM 435 O VAL A 32 -1.771 3.140 -9.523 1.00 0.00 O ATOM 436 CB VAL A 32 -2.967 1.204 -7.856 1.00 0.00 C ATOM 437 CG1 VAL A 32 -2.598 0.322 -9.039 1.00 0.00 C ATOM 438 CG2 VAL A 32 -1.728 1.610 -7.074 1.00 0.00 C ATOM 0 H VAL A 32 -4.556 1.215 -9.813 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.289 2.871 -7.491 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.613 0.629 -7.193 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.055 -0.554 -8.684 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.505 0.003 -9.552 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.969 0.884 -9.730 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.196 0.717 -6.745 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -1.075 2.207 -7.711 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.023 2.197 -6.204 1.00 0.00 H new ATOM 448 N MET A 33 -2.988 4.748 -8.523 1.00 0.00 N ATOM 449 CA MET A 33 -2.110 5.831 -8.953 1.00 0.00 C ATOM 450 C MET A 33 -0.645 5.445 -8.780 1.00 0.00 C ATOM 451 O MET A 33 0.138 5.502 -9.730 1.00 0.00 O ATOM 452 CB MET A 33 -2.412 7.104 -8.160 1.00 0.00 C ATOM 453 CG MET A 33 -3.700 7.793 -8.582 1.00 0.00 C ATOM 454 SD MET A 33 -3.949 9.372 -7.747 1.00 0.00 S ATOM 455 CE MET A 33 -4.195 10.460 -9.148 1.00 0.00 C ATOM 0 H MET A 33 -3.787 5.048 -7.965 1.00 0.00 H new ATOM 0 HA MET A 33 -2.294 6.018 -10.011 1.00 0.00 H new ATOM 0 HB2 MET A 33 -2.473 6.856 -7.100 1.00 0.00 H new ATOM 0 HB3 MET A 33 -1.582 7.801 -8.277 1.00 0.00 H new ATOM 0 HG2 MET A 33 -3.685 7.955 -9.660 1.00 0.00 H new ATOM 0 HG3 MET A 33 -4.545 7.137 -8.370 1.00 0.00 H new ATOM 0 HE1 MET A 33 -4.362 11.477 -8.794 1.00 0.00 H new ATOM 0 HE2 MET A 33 -3.311 10.438 -9.785 1.00 0.00 H new ATOM 0 HE3 MET A 33 -5.062 10.128 -9.719 1.00 0.00 H new ATOM 465 N ASP A 34 -0.280 5.054 -7.564 1.00 0.00 N ATOM 466 CA ASP A 34 1.092 4.658 -7.268 1.00 0.00 C ATOM 467 C ASP A 34 1.152 3.818 -5.996 1.00 0.00 C ATOM 468 O ASP A 34 0.195 3.773 -5.223 1.00 0.00 O ATOM 469 CB ASP A 34 1.981 5.893 -7.120 1.00 0.00 C ATOM 470 CG ASP A 34 3.270 5.777 -7.911 1.00 0.00 C ATOM 471 OD1 ASP A 34 4.128 4.954 -7.529 1.00 0.00 O ATOM 472 OD2 ASP A 34 3.418 6.508 -8.912 1.00 0.00 O ATOM 0 H ASP A 34 -0.915 5.003 -6.767 1.00 0.00 H new ATOM 0 HA ASP A 34 1.457 4.054 -8.099 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.432 6.774 -7.452 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.217 6.043 -6.066 1.00 0.00 H new ATOM 477 N VAL A 35 2.283 3.152 -5.786 1.00 0.00 N ATOM 478 CA VAL A 35 2.468 2.312 -4.608 1.00 0.00 C ATOM 479 C VAL A 35 3.840 2.539 -3.983 1.00 0.00 C ATOM 480 O VAL A 35 4.869 2.271 -4.604 1.00 0.00 O ATOM 481 CB VAL A 35 2.312 0.820 -4.952 1.00 0.00 C ATOM 482 CG1 VAL A 35 2.646 -0.045 -3.746 1.00 0.00 C ATOM 483 CG2 VAL A 35 0.904 0.532 -5.452 1.00 0.00 C ATOM 0 H VAL A 35 3.085 3.178 -6.416 1.00 0.00 H new ATOM 0 HA VAL A 35 1.695 2.594 -3.893 1.00 0.00 H new ATOM 0 HB VAL A 35 3.013 0.575 -5.750 1.00 0.00 H new ATOM 0 HG11 VAL A 35 2.530 -1.096 -4.009 1.00 0.00 H new ATOM 0 HG12 VAL A 35 3.675 0.141 -3.439 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.973 0.200 -2.925 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.812 -0.528 -5.690 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.182 0.794 -4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.707 1.123 -6.346 1.00 0.00 H new ATOM 493 N PHE A 36 3.848 3.032 -2.749 1.00 0.00 N ATOM 494 CA PHE A 36 5.094 3.295 -2.039 1.00 0.00 C ATOM 495 C PHE A 36 5.178 2.464 -0.762 1.00 0.00 C ATOM 496 O PHE A 36 4.165 1.975 -0.260 1.00 0.00 O ATOM 497 CB PHE A 36 5.211 4.783 -1.701 1.00 0.00 C ATOM 498 CG PHE A 36 6.306 5.092 -0.722 1.00 0.00 C ATOM 499 CD1 PHE A 36 7.635 5.049 -1.112 1.00 0.00 C ATOM 500 CD2 PHE A 36 6.008 5.424 0.589 1.00 0.00 C ATOM 501 CE1 PHE A 36 8.646 5.332 -0.213 1.00 0.00 C ATOM 502 CE2 PHE A 36 7.014 5.709 1.492 1.00 0.00 C ATOM 503 CZ PHE A 36 8.335 5.662 1.091 1.00 0.00 C ATOM 0 H PHE A 36 3.006 3.257 -2.220 1.00 0.00 H new ATOM 0 HA PHE A 36 5.920 3.012 -2.691 1.00 0.00 H new ATOM 0 HB2 PHE A 36 5.387 5.343 -2.619 1.00 0.00 H new ATOM 0 HB3 PHE A 36 4.262 5.130 -1.293 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.884 4.791 -2.131 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.977 5.461 0.909 1.00 0.00 H new ATOM 0 HE1 PHE A 36 9.678 5.295 -0.530 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.768 5.968 2.511 1.00 0.00 H new ATOM 0 HZ PHE A 36 9.123 5.883 1.796 1.00 0.00 H new ATOM 513 N ILE A 37 6.390 2.309 -0.242 1.00 0.00 N ATOM 514 CA ILE A 37 6.607 1.538 0.977 1.00 0.00 C ATOM 515 C ILE A 37 7.355 2.360 2.021 1.00 0.00 C ATOM 516 O ILE A 37 8.582 2.453 2.012 1.00 0.00 O ATOM 517 CB ILE A 37 7.397 0.247 0.693 1.00 0.00 C ATOM 518 CG1 ILE A 37 6.604 -0.668 -0.241 1.00 0.00 C ATOM 519 CG2 ILE A 37 7.723 -0.470 1.995 1.00 0.00 C ATOM 520 CD1 ILE A 37 7.363 -1.906 -0.663 1.00 0.00 C ATOM 0 H ILE A 37 7.238 2.707 -0.645 1.00 0.00 H new ATOM 0 HA ILE A 37 5.623 1.274 1.363 1.00 0.00 H new ATOM 0 HB ILE A 37 8.333 0.512 0.201 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.682 -0.969 0.256 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.318 -0.106 -1.130 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.282 -1.381 1.779 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.324 0.182 2.629 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.798 -0.726 2.511 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.739 -2.508 -1.324 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.272 -1.614 -1.188 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.625 -2.490 0.219 1.00 0.00 H new ATOM 532 N PRO A 38 6.599 2.970 2.947 1.00 0.00 N ATOM 533 CA PRO A 38 7.169 3.793 4.018 1.00 0.00 C ATOM 534 C PRO A 38 7.929 2.962 5.044 1.00 0.00 C ATOM 535 O PRO A 38 7.414 1.967 5.558 1.00 0.00 O ATOM 536 CB PRO A 38 5.940 4.442 4.658 1.00 0.00 C ATOM 537 CG PRO A 38 4.819 3.507 4.359 1.00 0.00 C ATOM 538 CD PRO A 38 5.129 2.903 3.018 1.00 0.00 C ATOM 0 HA PRO A 38 7.897 4.510 3.639 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.074 4.569 5.732 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.752 5.431 4.241 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.739 2.736 5.125 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.866 4.035 4.338 1.00 0.00 H new ATOM 0 HD2 PRO A 38 4.769 1.877 2.946 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.661 3.462 2.207 1.00 0.00 H new ATOM 546 N LYS A 39 9.156 3.374 5.343 1.00 0.00 N ATOM 547 CA LYS A 39 9.987 2.670 6.311 1.00 0.00 C ATOM 548 C LYS A 39 9.910 3.334 7.681 1.00 0.00 C ATOM 549 O LYS A 39 9.644 4.530 7.804 1.00 0.00 O ATOM 550 CB LYS A 39 11.441 2.631 5.833 1.00 0.00 C ATOM 551 CG LYS A 39 11.656 1.758 4.610 1.00 0.00 C ATOM 552 CD LYS A 39 12.801 0.781 4.816 1.00 0.00 C ATOM 553 CE LYS A 39 13.577 0.550 3.528 1.00 0.00 C ATOM 554 NZ LYS A 39 14.981 1.034 3.631 1.00 0.00 N ATOM 0 H LYS A 39 9.598 4.194 4.927 1.00 0.00 H new ATOM 0 HA LYS A 39 9.612 1.651 6.400 1.00 0.00 H new ATOM 0 HB2 LYS A 39 11.767 3.646 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 39 12.072 2.267 6.644 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.742 1.207 4.390 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.865 2.387 3.745 1.00 0.00 H new ATOM 0 HD2 LYS A 39 13.474 1.164 5.583 1.00 0.00 H new ATOM 0 HD3 LYS A 39 12.409 -0.168 5.181 1.00 0.00 H new ATOM 0 HE2 LYS A 39 13.576 -0.514 3.290 1.00 0.00 H new ATOM 0 HE3 LYS A 39 13.076 1.061 2.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 15.476 0.858 2.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 14.983 2.054 3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 15.467 0.528 4.399 1.00 0.00 H new ATOM 568 N PRO A 40 10.146 2.542 8.738 1.00 0.00 N ATOM 569 CA PRO A 40 10.463 1.117 8.604 1.00 0.00 C ATOM 570 C PRO A 40 9.264 0.300 8.137 1.00 0.00 C ATOM 571 O PRO A 40 8.137 0.523 8.578 1.00 0.00 O ATOM 572 CB PRO A 40 10.868 0.710 10.023 1.00 0.00 C ATOM 573 CG PRO A 40 10.174 1.685 10.910 1.00 0.00 C ATOM 574 CD PRO A 40 10.124 2.978 10.144 1.00 0.00 C ATOM 0 HA PRO A 40 11.237 0.939 7.858 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.563 -0.313 10.244 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.949 0.755 10.154 1.00 0.00 H new ATOM 0 HG2 PRO A 40 9.171 1.340 11.160 1.00 0.00 H new ATOM 0 HG3 PRO A 40 10.712 1.809 11.850 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.223 3.547 10.374 1.00 0.00 H new ATOM 0 HD3 PRO A 40 10.974 3.618 10.380 1.00 0.00 H new ATOM 582 N PHE A 41 9.515 -0.652 7.242 1.00 0.00 N ATOM 583 CA PHE A 41 8.456 -1.503 6.714 1.00 0.00 C ATOM 584 C PHE A 41 8.142 -2.642 7.681 1.00 0.00 C ATOM 585 O PHE A 41 8.971 -3.521 7.910 1.00 0.00 O ATOM 586 CB PHE A 41 8.861 -2.073 5.353 1.00 0.00 C ATOM 587 CG PHE A 41 8.080 -3.292 4.956 1.00 0.00 C ATOM 588 CD1 PHE A 41 6.882 -3.171 4.270 1.00 0.00 C ATOM 589 CD2 PHE A 41 8.541 -4.560 5.271 1.00 0.00 C ATOM 590 CE1 PHE A 41 6.160 -4.291 3.903 1.00 0.00 C ATOM 591 CE2 PHE A 41 7.824 -5.683 4.906 1.00 0.00 C ATOM 592 CZ PHE A 41 6.632 -5.548 4.223 1.00 0.00 C ATOM 0 H PHE A 41 10.443 -0.852 6.868 1.00 0.00 H new ATOM 0 HA PHE A 41 7.560 -0.893 6.593 1.00 0.00 H new ATOM 0 HB2 PHE A 41 8.729 -1.304 4.592 1.00 0.00 H new ATOM 0 HB3 PHE A 41 9.922 -2.322 5.374 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.508 -2.189 4.019 1.00 0.00 H new ATOM 0 HD2 PHE A 41 9.471 -4.672 5.808 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.229 -4.183 3.367 1.00 0.00 H new ATOM 0 HE2 PHE A 41 8.196 -6.666 5.155 1.00 0.00 H new ATOM 0 HZ PHE A 41 6.069 -6.425 3.939 1.00 0.00 H new ATOM 602 N ARG A 42 6.937 -2.616 8.243 1.00 0.00 N ATOM 603 CA ARG A 42 6.513 -3.644 9.187 1.00 0.00 C ATOM 604 C ARG A 42 5.317 -4.420 8.643 1.00 0.00 C ATOM 605 O ARG A 42 4.171 -4.139 8.995 1.00 0.00 O ATOM 606 CB ARG A 42 6.156 -3.014 10.534 1.00 0.00 C ATOM 607 CG ARG A 42 5.549 -3.995 11.523 1.00 0.00 C ATOM 608 CD ARG A 42 5.541 -3.430 12.935 1.00 0.00 C ATOM 609 NE ARG A 42 6.635 -3.961 13.743 1.00 0.00 N ATOM 610 CZ ARG A 42 7.063 -3.392 14.865 1.00 0.00 C ATOM 611 NH1 ARG A 42 6.492 -2.282 15.309 1.00 0.00 N ATOM 612 NH2 ARG A 42 8.064 -3.935 15.545 1.00 0.00 N ATOM 0 H ARG A 42 6.238 -1.895 8.061 1.00 0.00 H new ATOM 0 HA ARG A 42 7.342 -4.338 9.327 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.055 -2.579 10.972 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.454 -2.197 10.369 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.530 -4.235 11.220 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.114 -4.927 11.506 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.617 -2.344 12.891 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.590 -3.664 13.414 1.00 0.00 H new ATOM 0 HE ARG A 42 7.096 -4.815 13.429 1.00 0.00 H new ATOM 0 HH11 ARG A 42 5.722 -1.862 14.789 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.823 -1.848 16.171 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.506 -4.790 15.207 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.392 -3.498 16.406 1.00 0.00 H new ATOM 626 N ALA A 43 5.592 -5.395 7.783 1.00 0.00 N ATOM 627 CA ALA A 43 4.540 -6.211 7.192 1.00 0.00 C ATOM 628 C ALA A 43 3.358 -5.352 6.754 1.00 0.00 C ATOM 629 O ALA A 43 2.206 -5.783 6.817 1.00 0.00 O ATOM 630 CB ALA A 43 4.082 -7.277 8.177 1.00 0.00 C ATOM 0 H ALA A 43 6.535 -5.639 7.480 1.00 0.00 H new ATOM 0 HA ALA A 43 4.948 -6.700 6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.296 -7.879 7.722 1.00 0.00 H new ATOM 0 HB2 ALA A 43 4.925 -7.917 8.438 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.697 -6.799 9.078 1.00 0.00 H new ATOM 636 N PHE A 44 3.651 -4.133 6.312 1.00 0.00 N ATOM 637 CA PHE A 44 2.612 -3.213 5.864 1.00 0.00 C ATOM 638 C PHE A 44 3.160 -2.238 4.827 1.00 0.00 C ATOM 639 O PHE A 44 4.307 -1.800 4.915 1.00 0.00 O ATOM 640 CB PHE A 44 2.040 -2.440 7.055 1.00 0.00 C ATOM 641 CG PHE A 44 2.789 -1.176 7.365 1.00 0.00 C ATOM 642 CD1 PHE A 44 2.653 -0.058 6.557 1.00 0.00 C ATOM 643 CD2 PHE A 44 3.629 -1.105 8.464 1.00 0.00 C ATOM 644 CE1 PHE A 44 3.340 1.107 6.840 1.00 0.00 C ATOM 645 CE2 PHE A 44 4.319 0.058 8.752 1.00 0.00 C ATOM 646 CZ PHE A 44 4.176 1.164 7.939 1.00 0.00 C ATOM 0 H PHE A 44 4.599 -3.760 6.255 1.00 0.00 H new ATOM 0 HA PHE A 44 1.817 -3.798 5.402 1.00 0.00 H new ATOM 0 HB2 PHE A 44 0.998 -2.195 6.852 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.050 -3.084 7.934 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.002 -0.098 5.696 1.00 0.00 H new ATOM 0 HD2 PHE A 44 3.746 -1.968 9.103 1.00 0.00 H new ATOM 0 HE1 PHE A 44 3.224 1.972 6.203 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.970 0.101 9.613 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.716 2.072 8.161 1.00 0.00 H new ATOM 656 N ALA A 45 2.331 -1.902 3.843 1.00 0.00 N ATOM 657 CA ALA A 45 2.731 -0.978 2.789 1.00 0.00 C ATOM 658 C ALA A 45 1.651 0.068 2.537 1.00 0.00 C ATOM 659 O ALA A 45 0.502 -0.100 2.946 1.00 0.00 O ATOM 660 CB ALA A 45 3.039 -1.741 1.508 1.00 0.00 C ATOM 0 H ALA A 45 1.379 -2.256 3.754 1.00 0.00 H new ATOM 0 HA ALA A 45 3.632 -0.460 3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.336 -1.039 0.729 1.00 0.00 H new ATOM 0 HB2 ALA A 45 3.850 -2.446 1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.151 -2.285 1.186 1.00 0.00 H new ATOM 666 N PHE A 46 2.028 1.150 1.863 1.00 0.00 N ATOM 667 CA PHE A 46 1.091 2.225 1.559 1.00 0.00 C ATOM 668 C PHE A 46 0.795 2.283 0.063 1.00 0.00 C ATOM 669 O PHE A 46 1.709 2.343 -0.759 1.00 0.00 O ATOM 670 CB PHE A 46 1.652 3.568 2.031 1.00 0.00 C ATOM 671 CG PHE A 46 0.728 4.725 1.783 1.00 0.00 C ATOM 672 CD1 PHE A 46 -0.469 4.833 2.471 1.00 0.00 C ATOM 673 CD2 PHE A 46 1.057 5.706 0.860 1.00 0.00 C ATOM 674 CE1 PHE A 46 -1.322 5.896 2.245 1.00 0.00 C ATOM 675 CE2 PHE A 46 0.208 6.772 0.631 1.00 0.00 C ATOM 676 CZ PHE A 46 -0.984 6.867 1.323 1.00 0.00 C ATOM 0 H PHE A 46 2.975 1.305 1.517 1.00 0.00 H new ATOM 0 HA PHE A 46 0.160 2.021 2.088 1.00 0.00 H new ATOM 0 HB2 PHE A 46 1.867 3.508 3.098 1.00 0.00 H new ATOM 0 HB3 PHE A 46 2.599 3.755 1.525 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.739 4.077 3.193 1.00 0.00 H new ATOM 0 HD2 PHE A 46 1.986 5.636 0.314 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -2.252 5.968 2.789 1.00 0.00 H new ATOM 0 HE2 PHE A 46 0.476 7.531 -0.089 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.650 7.698 1.143 1.00 0.00 H new ATOM 686 N VAL A 47 -0.488 2.263 -0.282 1.00 0.00 N ATOM 687 CA VAL A 47 -0.905 2.313 -1.678 1.00 0.00 C ATOM 688 C VAL A 47 -1.928 3.420 -1.907 1.00 0.00 C ATOM 689 O VAL A 47 -2.888 3.562 -1.147 1.00 0.00 O ATOM 690 CB VAL A 47 -1.509 0.970 -2.132 1.00 0.00 C ATOM 691 CG1 VAL A 47 -1.921 1.038 -3.594 1.00 0.00 C ATOM 692 CG2 VAL A 47 -0.522 -0.163 -1.899 1.00 0.00 C ATOM 0 H VAL A 47 -1.257 2.213 0.386 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.012 2.520 -2.268 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.401 0.772 -1.537 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.345 0.081 -3.897 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -2.665 1.823 -3.726 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -1.048 1.259 -4.208 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -0.965 -1.104 -2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.389 0.026 -2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.282 -0.224 -0.838 1.00 0.00 H new ATOM 702 N THR A 48 -1.716 4.206 -2.959 1.00 0.00 N ATOM 703 CA THR A 48 -2.618 5.302 -3.287 1.00 0.00 C ATOM 704 C THR A 48 -3.445 4.980 -4.526 1.00 0.00 C ATOM 705 O THR A 48 -2.930 4.447 -5.509 1.00 0.00 O ATOM 706 CB THR A 48 -1.845 6.613 -3.526 1.00 0.00 C ATOM 707 OG1 THR A 48 -1.019 6.907 -2.395 1.00 0.00 O ATOM 708 CG2 THR A 48 -2.804 7.768 -3.774 1.00 0.00 C ATOM 0 H THR A 48 -0.927 4.103 -3.598 1.00 0.00 H new ATOM 0 HA THR A 48 -3.283 5.431 -2.433 1.00 0.00 H new ATOM 0 HB THR A 48 -1.219 6.485 -4.409 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.530 7.741 -2.555 1.00 0.00 H new ATOM 0 HG21 THR A 48 -2.236 8.683 -3.940 1.00 0.00 H new ATOM 0 HG22 THR A 48 -3.412 7.554 -4.653 1.00 0.00 H new ATOM 0 HG23 THR A 48 -3.452 7.896 -2.907 1.00 0.00 H new ATOM 716 N PHE A 49 -4.733 5.307 -4.474 1.00 0.00 N ATOM 717 CA PHE A 49 -5.632 5.053 -5.594 1.00 0.00 C ATOM 718 C PHE A 49 -6.053 6.358 -6.262 1.00 0.00 C ATOM 719 O PHE A 49 -5.943 7.434 -5.672 1.00 0.00 O ATOM 720 CB PHE A 49 -6.868 4.288 -5.118 1.00 0.00 C ATOM 721 CG PHE A 49 -6.671 2.800 -5.068 1.00 0.00 C ATOM 722 CD1 PHE A 49 -6.536 2.066 -6.235 1.00 0.00 C ATOM 723 CD2 PHE A 49 -6.620 2.136 -3.853 1.00 0.00 C ATOM 724 CE1 PHE A 49 -6.355 0.697 -6.190 1.00 0.00 C ATOM 725 CE2 PHE A 49 -6.438 0.766 -3.802 1.00 0.00 C ATOM 726 CZ PHE A 49 -6.305 0.047 -4.973 1.00 0.00 C ATOM 0 H PHE A 49 -5.177 5.748 -3.669 1.00 0.00 H new ATOM 0 HA PHE A 49 -5.098 4.448 -6.327 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.145 4.643 -4.125 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -7.703 4.514 -5.782 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.573 2.569 -7.190 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -6.724 2.695 -2.935 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.253 0.135 -7.107 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -6.400 0.260 -2.849 1.00 0.00 H new ATOM 0 HZ PHE A 49 -6.162 -1.023 -4.937 1.00 0.00 H new ATOM 736 N ALA A 50 -6.534 6.257 -7.497 1.00 0.00 N ATOM 737 CA ALA A 50 -6.973 7.429 -8.244 1.00 0.00 C ATOM 738 C ALA A 50 -8.390 7.831 -7.851 1.00 0.00 C ATOM 739 O ALA A 50 -9.009 8.674 -8.501 1.00 0.00 O ATOM 740 CB ALA A 50 -6.895 7.159 -9.739 1.00 0.00 C ATOM 0 H ALA A 50 -6.629 5.375 -8.001 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.308 8.257 -7.999 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.226 8.042 -10.286 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.866 6.926 -10.013 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.537 6.315 -9.990 1.00 0.00 H new ATOM 746 N ASP A 51 -8.899 7.224 -6.785 1.00 0.00 N ATOM 747 CA ASP A 51 -10.244 7.520 -6.305 1.00 0.00 C ATOM 748 C ASP A 51 -10.445 6.986 -4.890 1.00 0.00 C ATOM 749 O ASP A 51 -10.241 5.801 -4.628 1.00 0.00 O ATOM 750 CB ASP A 51 -11.289 6.916 -7.245 1.00 0.00 C ATOM 751 CG ASP A 51 -12.168 7.970 -7.886 1.00 0.00 C ATOM 752 OD1 ASP A 51 -11.673 8.694 -8.775 1.00 0.00 O ATOM 753 OD2 ASP A 51 -13.351 8.072 -7.500 1.00 0.00 O ATOM 0 H ASP A 51 -8.400 6.523 -6.236 1.00 0.00 H new ATOM 0 HA ASP A 51 -10.367 8.603 -6.287 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -10.785 6.344 -8.024 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -11.913 6.216 -6.689 1.00 0.00 H new ATOM 758 N ASP A 52 -10.847 7.869 -3.982 1.00 0.00 N ATOM 759 CA ASP A 52 -11.077 7.487 -2.594 1.00 0.00 C ATOM 760 C ASP A 52 -12.114 6.373 -2.501 1.00 0.00 C ATOM 761 O ASP A 52 -12.081 5.557 -1.580 1.00 0.00 O ATOM 762 CB ASP A 52 -11.536 8.698 -1.779 1.00 0.00 C ATOM 763 CG ASP A 52 -13.035 8.908 -1.851 1.00 0.00 C ATOM 764 OD1 ASP A 52 -13.546 9.171 -2.959 1.00 0.00 O ATOM 765 OD2 ASP A 52 -13.700 8.811 -0.797 1.00 0.00 O ATOM 0 H ASP A 52 -11.020 8.854 -4.183 1.00 0.00 H new ATOM 0 HA ASP A 52 -10.137 7.118 -2.184 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.240 8.566 -0.738 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -11.029 9.591 -2.143 1.00 0.00 H new ATOM 770 N GLN A 53 -13.033 6.346 -3.460 1.00 0.00 N ATOM 771 CA GLN A 53 -14.082 5.332 -3.485 1.00 0.00 C ATOM 772 C GLN A 53 -13.486 3.938 -3.651 1.00 0.00 C ATOM 773 O GLN A 53 -14.027 2.956 -3.139 1.00 0.00 O ATOM 774 CB GLN A 53 -15.069 5.617 -4.617 1.00 0.00 C ATOM 775 CG GLN A 53 -15.981 6.803 -4.347 1.00 0.00 C ATOM 776 CD GLN A 53 -17.382 6.384 -3.949 1.00 0.00 C ATOM 777 OE1 GLN A 53 -18.073 5.695 -4.699 1.00 0.00 O ATOM 778 NE2 GLN A 53 -17.810 6.799 -2.762 1.00 0.00 N ATOM 0 H GLN A 53 -13.073 7.014 -4.230 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.613 5.369 -2.534 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -14.512 5.800 -5.536 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -15.680 4.731 -4.786 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.550 7.415 -3.554 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -16.032 7.427 -5.239 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -17.204 7.369 -2.172 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -18.745 6.548 -2.441 1.00 0.00 H new ATOM 787 N ILE A 54 -12.372 3.858 -4.370 1.00 0.00 N ATOM 788 CA ILE A 54 -11.704 2.584 -4.603 1.00 0.00 C ATOM 789 C ILE A 54 -10.997 2.095 -3.343 1.00 0.00 C ATOM 790 O ILE A 54 -10.974 0.898 -3.056 1.00 0.00 O ATOM 791 CB ILE A 54 -10.677 2.687 -5.747 1.00 0.00 C ATOM 792 CG1 ILE A 54 -11.337 3.259 -7.003 1.00 0.00 C ATOM 793 CG2 ILE A 54 -10.067 1.323 -6.035 1.00 0.00 C ATOM 794 CD1 ILE A 54 -10.346 3.721 -8.049 1.00 0.00 C ATOM 0 H ILE A 54 -11.913 4.660 -4.801 1.00 0.00 H new ATOM 0 HA ILE A 54 -12.478 1.869 -4.883 1.00 0.00 H new ATOM 0 HB ILE A 54 -9.878 3.362 -5.440 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.987 2.501 -7.440 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.972 4.098 -6.720 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -9.344 1.412 -6.845 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -9.566 0.952 -5.141 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -10.854 0.627 -6.326 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -10.884 4.114 -8.911 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -9.712 4.502 -7.630 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -9.727 2.880 -8.361 1.00 0.00 H new ATOM 806 N ALA A 55 -10.422 3.029 -2.594 1.00 0.00 N ATOM 807 CA ALA A 55 -9.717 2.695 -1.362 1.00 0.00 C ATOM 808 C ALA A 55 -10.697 2.414 -0.229 1.00 0.00 C ATOM 809 O ALA A 55 -10.395 1.651 0.689 1.00 0.00 O ATOM 810 CB ALA A 55 -8.767 3.819 -0.975 1.00 0.00 C ATOM 0 H ALA A 55 -10.430 4.024 -2.818 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.137 1.789 -1.539 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.248 3.556 -0.054 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.038 3.970 -1.772 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.333 4.738 -0.822 1.00 0.00 H new ATOM 816 N GLN A 56 -11.870 3.035 -0.298 1.00 0.00 N ATOM 817 CA GLN A 56 -12.893 2.852 0.725 1.00 0.00 C ATOM 818 C GLN A 56 -13.627 1.530 0.529 1.00 0.00 C ATOM 819 O GLN A 56 -13.705 0.711 1.445 1.00 0.00 O ATOM 820 CB GLN A 56 -13.890 4.012 0.692 1.00 0.00 C ATOM 821 CG GLN A 56 -13.911 4.832 1.971 1.00 0.00 C ATOM 822 CD GLN A 56 -14.923 4.320 2.976 1.00 0.00 C ATOM 823 OE1 GLN A 56 -16.097 4.691 2.938 1.00 0.00 O ATOM 824 NE2 GLN A 56 -14.473 3.463 3.885 1.00 0.00 N ATOM 0 H GLN A 56 -12.136 3.669 -1.051 1.00 0.00 H new ATOM 0 HA GLN A 56 -12.400 2.833 1.697 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -13.646 4.666 -0.145 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -14.889 3.617 0.507 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -12.919 4.820 2.422 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -14.138 5.870 1.729 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -13.492 3.182 3.880 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -15.108 3.085 4.588 1.00 0.00 H new ATOM 833 N SER A 57 -14.163 1.327 -0.670 1.00 0.00 N ATOM 834 CA SER A 57 -14.894 0.105 -0.984 1.00 0.00 C ATOM 835 C SER A 57 -14.030 -1.125 -0.729 1.00 0.00 C ATOM 836 O SER A 57 -14.539 -2.238 -0.593 1.00 0.00 O ATOM 837 CB SER A 57 -15.359 0.124 -2.442 1.00 0.00 C ATOM 838 OG SER A 57 -16.713 -0.278 -2.550 1.00 0.00 O ATOM 0 H SER A 57 -14.105 1.993 -1.440 1.00 0.00 H new ATOM 0 HA SER A 57 -15.767 0.055 -0.333 1.00 0.00 H new ATOM 0 HB2 SER A 57 -15.240 1.127 -2.852 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.731 -0.540 -3.036 1.00 0.00 H new ATOM 0 HG SER A 57 -16.987 -0.256 -3.491 1.00 0.00 H new ATOM 844 N LEU A 58 -12.720 -0.917 -0.667 1.00 0.00 N ATOM 845 CA LEU A 58 -11.782 -2.010 -0.429 1.00 0.00 C ATOM 846 C LEU A 58 -11.527 -2.193 1.064 1.00 0.00 C ATOM 847 O LEU A 58 -11.087 -3.256 1.503 1.00 0.00 O ATOM 848 CB LEU A 58 -10.462 -1.743 -1.154 1.00 0.00 C ATOM 849 CG LEU A 58 -10.324 -2.360 -2.547 1.00 0.00 C ATOM 850 CD1 LEU A 58 -9.067 -1.852 -3.234 1.00 0.00 C ATOM 851 CD2 LEU A 58 -10.309 -3.879 -2.456 1.00 0.00 C ATOM 0 H LEU A 58 -12.282 -0.002 -0.778 1.00 0.00 H new ATOM 0 HA LEU A 58 -12.224 -2.927 -0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -10.330 -0.665 -1.242 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -9.647 -2.114 -0.532 1.00 0.00 H new ATOM 0 HG LEU A 58 -11.185 -2.060 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.986 -2.302 -4.223 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.119 -0.768 -3.332 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.194 -2.122 -2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -10.210 -4.302 -3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -9.467 -4.198 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -11.239 -4.226 -2.005 1.00 0.00 H new ATOM 863 N CYS A 59 -11.807 -1.151 1.838 1.00 0.00 N ATOM 864 CA CYS A 59 -11.609 -1.196 3.283 1.00 0.00 C ATOM 865 C CYS A 59 -12.556 -2.202 3.929 1.00 0.00 C ATOM 866 O CYS A 59 -13.770 -2.001 3.955 1.00 0.00 O ATOM 867 CB CYS A 59 -11.824 0.189 3.892 1.00 0.00 C ATOM 868 SG CYS A 59 -11.668 0.237 5.693 1.00 0.00 S ATOM 0 H CYS A 59 -12.172 -0.264 1.490 1.00 0.00 H new ATOM 0 HA CYS A 59 -10.584 -1.513 3.475 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.103 0.881 3.457 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -12.816 0.546 3.614 1.00 0.00 H new ATOM 0 HG CYS A 59 -11.431 1.457 6.076 1.00 0.00 H new ATOM 874 N GLY A 60 -11.992 -3.288 4.450 1.00 0.00 N ATOM 875 CA GLY A 60 -12.800 -4.311 5.089 1.00 0.00 C ATOM 876 C GLY A 60 -12.861 -5.591 4.279 1.00 0.00 C ATOM 877 O GLY A 60 -13.405 -6.595 4.736 1.00 0.00 O ATOM 0 H GLY A 60 -10.990 -3.478 4.441 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.392 -4.528 6.076 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -13.811 -3.931 5.239 1.00 0.00 H new ATOM 881 N GLU A 61 -12.300 -5.555 3.075 1.00 0.00 N ATOM 882 CA GLU A 61 -12.295 -6.721 2.200 1.00 0.00 C ATOM 883 C GLU A 61 -10.995 -7.506 2.348 1.00 0.00 C ATOM 884 O GLU A 61 -9.927 -6.927 2.547 1.00 0.00 O ATOM 885 CB GLU A 61 -12.483 -6.295 0.743 1.00 0.00 C ATOM 886 CG GLU A 61 -13.701 -5.413 0.519 1.00 0.00 C ATOM 887 CD GLU A 61 -14.921 -6.203 0.086 1.00 0.00 C ATOM 888 OE1 GLU A 61 -15.224 -7.227 0.734 1.00 0.00 O ATOM 889 OE2 GLU A 61 -15.571 -5.800 -0.900 1.00 0.00 O ATOM 0 H GLU A 61 -11.843 -4.731 2.683 1.00 0.00 H new ATOM 0 HA GLU A 61 -13.124 -7.365 2.492 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.592 -5.761 0.411 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.571 -7.186 0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.929 -4.874 1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.469 -4.665 -0.239 1.00 0.00 H new ATOM 896 N ASP A 62 -11.094 -8.827 2.249 1.00 0.00 N ATOM 897 CA ASP A 62 -9.927 -9.693 2.371 1.00 0.00 C ATOM 898 C ASP A 62 -9.444 -10.152 0.998 1.00 0.00 C ATOM 899 O ASP A 62 -10.178 -10.809 0.258 1.00 0.00 O ATOM 900 CB ASP A 62 -10.254 -10.907 3.241 1.00 0.00 C ATOM 901 CG ASP A 62 -11.385 -11.740 2.671 1.00 0.00 C ATOM 902 OD1 ASP A 62 -12.557 -11.436 2.975 1.00 0.00 O ATOM 903 OD2 ASP A 62 -11.098 -12.697 1.921 1.00 0.00 O ATOM 0 H ASP A 62 -11.971 -9.322 2.085 1.00 0.00 H new ATOM 0 HA ASP A 62 -9.130 -9.120 2.845 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.364 -11.528 3.342 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.523 -10.571 4.242 1.00 0.00 H new ATOM 908 N LEU A 63 -8.209 -9.799 0.663 1.00 0.00 N ATOM 909 CA LEU A 63 -7.628 -10.174 -0.622 1.00 0.00 C ATOM 910 C LEU A 63 -6.457 -11.133 -0.432 1.00 0.00 C ATOM 911 O LEU A 63 -5.702 -11.022 0.533 1.00 0.00 O ATOM 912 CB LEU A 63 -7.162 -8.927 -1.377 1.00 0.00 C ATOM 913 CG LEU A 63 -7.994 -7.662 -1.160 1.00 0.00 C ATOM 914 CD1 LEU A 63 -7.434 -6.509 -1.977 1.00 0.00 C ATOM 915 CD2 LEU A 63 -9.451 -7.913 -1.517 1.00 0.00 C ATOM 0 H LEU A 63 -7.590 -9.254 1.263 1.00 0.00 H new ATOM 0 HA LEU A 63 -8.397 -10.680 -1.206 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.133 -8.715 -1.088 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.153 -9.154 -2.443 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.941 -7.393 -0.105 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.039 -5.617 -1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.406 -6.313 -1.672 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.455 -6.769 -3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -10.027 -7.002 -1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -9.523 -8.208 -2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.848 -8.709 -0.887 1.00 0.00 H new ATOM 927 N ILE A 64 -6.314 -12.074 -1.360 1.00 0.00 N ATOM 928 CA ILE A 64 -5.233 -13.050 -1.295 1.00 0.00 C ATOM 929 C ILE A 64 -4.176 -12.772 -2.359 1.00 0.00 C ATOM 930 O ILE A 64 -4.485 -12.687 -3.548 1.00 0.00 O ATOM 931 CB ILE A 64 -5.761 -14.486 -1.475 1.00 0.00 C ATOM 932 CG1 ILE A 64 -6.829 -14.795 -0.426 1.00 0.00 C ATOM 933 CG2 ILE A 64 -4.618 -15.485 -1.386 1.00 0.00 C ATOM 934 CD1 ILE A 64 -6.374 -14.539 0.994 1.00 0.00 C ATOM 0 H ILE A 64 -6.932 -12.181 -2.164 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.783 -12.957 -0.307 1.00 0.00 H new ATOM 0 HB ILE A 64 -6.215 -14.570 -2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -7.713 -14.191 -0.630 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -7.128 -15.839 -0.520 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -5.007 -16.495 -1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -3.889 -15.274 -2.168 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -4.138 -15.403 -0.411 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -7.183 -14.780 1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -5.509 -15.163 1.217 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -6.103 -13.489 1.105 1.00 0.00 H new ATOM 946 N ILE A 65 -2.929 -12.632 -1.923 1.00 0.00 N ATOM 947 CA ILE A 65 -1.827 -12.366 -2.839 1.00 0.00 C ATOM 948 C ILE A 65 -0.732 -13.419 -2.701 1.00 0.00 C ATOM 949 O ILE A 65 -0.105 -13.546 -1.649 1.00 0.00 O ATOM 950 CB ILE A 65 -1.216 -10.973 -2.595 1.00 0.00 C ATOM 951 CG1 ILE A 65 -2.279 -9.888 -2.779 1.00 0.00 C ATOM 952 CG2 ILE A 65 -0.043 -10.737 -3.535 1.00 0.00 C ATOM 953 CD1 ILE A 65 -2.093 -8.700 -1.862 1.00 0.00 C ATOM 0 H ILE A 65 -2.657 -12.698 -0.942 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.239 -12.402 -3.848 1.00 0.00 H new ATOM 0 HB ILE A 65 -0.849 -10.927 -1.570 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.261 -9.545 -3.813 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.264 -10.322 -2.604 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.378 -9.749 -3.350 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.721 -11.495 -3.361 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.386 -10.798 -4.568 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.882 -7.971 -2.047 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.140 -9.030 -0.824 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.123 -8.242 -2.053 1.00 0.00 H new ATOM 965 N LYS A 66 -0.505 -14.172 -3.772 1.00 0.00 N ATOM 966 CA LYS A 66 0.515 -15.214 -3.774 1.00 0.00 C ATOM 967 C LYS A 66 0.149 -16.336 -2.809 1.00 0.00 C ATOM 968 O LYS A 66 0.948 -17.238 -2.559 1.00 0.00 O ATOM 969 CB LYS A 66 1.876 -14.623 -3.394 1.00 0.00 C ATOM 970 CG LYS A 66 2.241 -13.378 -4.184 1.00 0.00 C ATOM 971 CD LYS A 66 3.686 -12.971 -3.947 1.00 0.00 C ATOM 972 CE LYS A 66 4.650 -14.061 -4.385 1.00 0.00 C ATOM 973 NZ LYS A 66 5.819 -13.504 -5.123 1.00 0.00 N ATOM 0 H LYS A 66 -1.014 -14.080 -4.651 1.00 0.00 H new ATOM 0 HA LYS A 66 0.573 -15.630 -4.780 1.00 0.00 H new ATOM 0 HB2 LYS A 66 1.873 -14.381 -2.331 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.646 -15.379 -3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 66 2.083 -13.561 -5.247 1.00 0.00 H new ATOM 0 HG3 LYS A 66 1.580 -12.559 -3.900 1.00 0.00 H new ATOM 0 HD2 LYS A 66 3.901 -12.053 -4.493 1.00 0.00 H new ATOM 0 HD3 LYS A 66 3.836 -12.755 -2.889 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.000 -14.609 -3.510 1.00 0.00 H new ATOM 0 HE3 LYS A 66 4.126 -14.775 -5.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.918 -13.993 -6.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 5.673 -12.488 -5.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.683 -13.642 -4.560 1.00 0.00 H new ATOM 987 N GLY A 67 -1.064 -16.276 -2.270 1.00 0.00 N ATOM 988 CA GLY A 67 -1.515 -17.294 -1.340 1.00 0.00 C ATOM 989 C GLY A 67 -1.722 -16.751 0.060 1.00 0.00 C ATOM 990 O GLY A 67 -2.485 -17.313 0.845 1.00 0.00 O ATOM 0 H GLY A 67 -1.743 -15.540 -2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.449 -17.723 -1.701 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.784 -18.102 -1.308 1.00 0.00 H new ATOM 994 N ILE A 68 -1.040 -15.654 0.374 1.00 0.00 N ATOM 995 CA ILE A 68 -1.153 -15.035 1.688 1.00 0.00 C ATOM 996 C ILE A 68 -2.432 -14.212 1.801 1.00 0.00 C ATOM 997 O ILE A 68 -3.043 -13.854 0.794 1.00 0.00 O ATOM 998 CB ILE A 68 0.056 -14.129 1.990 1.00 0.00 C ATOM 999 CG1 ILE A 68 0.000 -12.865 1.128 1.00 0.00 C ATOM 1000 CG2 ILE A 68 1.355 -14.882 1.749 1.00 0.00 C ATOM 1001 CD1 ILE A 68 -0.308 -11.610 1.915 1.00 0.00 C ATOM 0 H ILE A 68 -0.404 -15.176 -0.264 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.180 -15.845 2.416 1.00 0.00 H new ATOM 0 HB ILE A 68 0.018 -13.835 3.039 1.00 0.00 H new ATOM 0 HG12 ILE A 68 0.956 -12.740 0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.758 -12.995 0.356 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.200 -14.229 1.967 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.395 -15.756 2.399 1.00 0.00 H new ATOM 0 HG23 ILE A 68 1.402 -15.202 0.708 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.332 -10.754 1.240 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -1.277 -11.715 2.403 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.463 -11.456 2.670 1.00 0.00 H new ATOM 1013 N SER A 69 -2.830 -13.914 3.033 1.00 0.00 N ATOM 1014 CA SER A 69 -4.038 -13.135 3.278 1.00 0.00 C ATOM 1015 C SER A 69 -3.695 -11.776 3.883 1.00 0.00 C ATOM 1016 O SER A 69 -2.936 -11.688 4.849 1.00 0.00 O ATOM 1017 CB SER A 69 -4.981 -13.897 4.210 1.00 0.00 C ATOM 1018 OG SER A 69 -6.281 -13.331 4.195 1.00 0.00 O ATOM 0 H SER A 69 -2.334 -14.200 3.877 1.00 0.00 H new ATOM 0 HA SER A 69 -4.536 -12.973 2.322 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.033 -14.942 3.905 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.585 -13.880 5.226 1.00 0.00 H new ATOM 0 HG SER A 69 -6.865 -13.837 4.797 1.00 0.00 H new ATOM 1024 N VAL A 70 -4.259 -10.720 3.307 1.00 0.00 N ATOM 1025 CA VAL A 70 -4.014 -9.366 3.788 1.00 0.00 C ATOM 1026 C VAL A 70 -5.323 -8.651 4.107 1.00 0.00 C ATOM 1027 O VAL A 70 -6.390 -9.048 3.638 1.00 0.00 O ATOM 1028 CB VAL A 70 -3.227 -8.536 2.756 1.00 0.00 C ATOM 1029 CG1 VAL A 70 -1.759 -8.935 2.758 1.00 0.00 C ATOM 1030 CG2 VAL A 70 -3.831 -8.700 1.369 1.00 0.00 C ATOM 0 H VAL A 70 -4.889 -10.776 2.507 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.421 -9.456 4.698 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.293 -7.484 3.034 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.219 -8.338 2.023 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.336 -8.762 3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.669 -9.991 2.505 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.263 -8.107 0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -3.797 -9.750 1.079 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.867 -8.360 1.381 1.00 0.00 H new ATOM 1040 N HIS A 71 -5.233 -7.592 4.907 1.00 0.00 N ATOM 1041 CA HIS A 71 -6.411 -6.821 5.287 1.00 0.00 C ATOM 1042 C HIS A 71 -6.277 -5.368 4.840 1.00 0.00 C ATOM 1043 O HIS A 71 -5.321 -4.682 5.206 1.00 0.00 O ATOM 1044 CB HIS A 71 -6.621 -6.883 6.800 1.00 0.00 C ATOM 1045 CG HIS A 71 -7.577 -5.853 7.316 1.00 0.00 C ATOM 1046 ND1 HIS A 71 -8.845 -6.160 7.765 1.00 0.00 N ATOM 1047 CD2 HIS A 71 -7.446 -4.513 7.454 1.00 0.00 C ATOM 1048 CE1 HIS A 71 -9.452 -5.053 8.154 1.00 0.00 C ATOM 1049 NE2 HIS A 71 -8.623 -4.039 7.977 1.00 0.00 N ATOM 0 H HIS A 71 -4.358 -7.249 5.304 1.00 0.00 H new ATOM 0 HA HIS A 71 -7.277 -7.258 4.789 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.989 -7.874 7.067 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.659 -6.755 7.297 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -9.250 -7.096 7.792 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.576 -3.925 7.200 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.455 -4.988 8.549 1.00 0.00 H new ATOM 1057 N ILE A 72 -7.237 -4.907 4.047 1.00 0.00 N ATOM 1058 CA ILE A 72 -7.226 -3.536 3.552 1.00 0.00 C ATOM 1059 C ILE A 72 -7.932 -2.594 4.521 1.00 0.00 C ATOM 1060 O ILE A 72 -9.064 -2.847 4.935 1.00 0.00 O ATOM 1061 CB ILE A 72 -7.899 -3.432 2.170 1.00 0.00 C ATOM 1062 CG1 ILE A 72 -7.423 -4.566 1.260 1.00 0.00 C ATOM 1063 CG2 ILE A 72 -7.604 -2.079 1.538 1.00 0.00 C ATOM 1064 CD1 ILE A 72 -5.954 -4.486 0.912 1.00 0.00 C ATOM 0 H ILE A 72 -8.033 -5.463 3.733 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.180 -3.242 3.462 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.977 -3.524 2.299 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.621 -5.520 1.749 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -8.007 -4.552 0.340 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.086 -2.020 0.562 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.987 -1.286 2.180 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.527 -1.960 1.418 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -5.687 -5.321 0.265 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -5.753 -3.548 0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -5.361 -4.531 1.825 1.00 0.00 H new ATOM 1076 N SER A 73 -7.257 -1.506 4.878 1.00 0.00 N ATOM 1077 CA SER A 73 -7.819 -0.527 5.801 1.00 0.00 C ATOM 1078 C SER A 73 -7.360 0.883 5.442 1.00 0.00 C ATOM 1079 O SER A 73 -6.248 1.081 4.954 1.00 0.00 O ATOM 1080 CB SER A 73 -7.413 -0.857 7.238 1.00 0.00 C ATOM 1081 OG SER A 73 -8.552 -1.078 8.052 1.00 0.00 O ATOM 0 H SER A 73 -6.321 -1.280 4.542 1.00 0.00 H new ATOM 0 HA SER A 73 -8.905 -0.569 5.720 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.779 -1.744 7.246 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.822 -0.039 7.649 1.00 0.00 H new ATOM 0 HG SER A 73 -8.713 -2.041 8.135 1.00 0.00 H new ATOM 1087 N ASN A 74 -8.226 1.861 5.687 1.00 0.00 N ATOM 1088 CA ASN A 74 -7.911 3.254 5.390 1.00 0.00 C ATOM 1089 C ASN A 74 -7.477 3.995 6.650 1.00 0.00 C ATOM 1090 O ASN A 74 -8.278 4.218 7.558 1.00 0.00 O ATOM 1091 CB ASN A 74 -9.122 3.951 4.766 1.00 0.00 C ATOM 1092 CG ASN A 74 -10.253 4.142 5.758 1.00 0.00 C ATOM 1093 OD1 ASN A 74 -11.090 3.258 5.939 1.00 0.00 O ATOM 1094 ND2 ASN A 74 -10.282 5.300 6.406 1.00 0.00 N ATOM 0 H ASN A 74 -9.151 1.715 6.090 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.085 3.269 4.679 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -8.818 4.922 4.375 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.480 3.364 3.920 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -11.019 5.486 7.086 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.567 6.004 6.224 1.00 0.00 H new ATOM 1101 N ALA A 75 -6.204 4.373 6.700 1.00 0.00 N ATOM 1102 CA ALA A 75 -5.664 5.092 7.847 1.00 0.00 C ATOM 1103 C ALA A 75 -4.799 6.266 7.403 1.00 0.00 C ATOM 1104 O ALA A 75 -4.082 6.178 6.407 1.00 0.00 O ATOM 1105 CB ALA A 75 -4.863 4.147 8.731 1.00 0.00 C ATOM 0 H ALA A 75 -5.527 4.193 5.959 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.500 5.490 8.422 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.465 4.696 9.584 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.510 3.345 9.086 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.040 3.722 8.157 1.00 0.00 H new ATOM 1111 N GLU A 76 -4.872 7.364 8.148 1.00 0.00 N ATOM 1112 CA GLU A 76 -4.096 8.557 7.828 1.00 0.00 C ATOM 1113 C GLU A 76 -3.479 9.158 9.087 1.00 0.00 C ATOM 1114 O GLU A 76 -4.087 9.976 9.777 1.00 0.00 O ATOM 1115 CB GLU A 76 -4.980 9.596 7.134 1.00 0.00 C ATOM 1116 CG GLU A 76 -5.628 9.089 5.857 1.00 0.00 C ATOM 1117 CD GLU A 76 -4.965 9.637 4.608 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -4.830 10.874 4.504 1.00 0.00 O ATOM 1119 OE2 GLU A 76 -4.583 8.830 3.736 1.00 0.00 O ATOM 0 H GLU A 76 -5.460 7.453 8.977 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.291 8.266 7.153 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -5.760 9.916 7.825 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -4.379 10.475 6.902 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -5.584 8.000 5.839 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -6.682 9.365 5.855 1.00 0.00 H new ATOM 1126 N PRO A 77 -2.241 8.742 9.395 1.00 0.00 N ATOM 1127 CA PRO A 77 -1.513 9.225 10.572 1.00 0.00 C ATOM 1128 C PRO A 77 -1.094 10.685 10.435 1.00 0.00 C ATOM 1129 O PRO A 77 -0.934 11.195 9.325 1.00 0.00 O ATOM 1130 CB PRO A 77 -0.282 8.318 10.625 1.00 0.00 C ATOM 1131 CG PRO A 77 -0.083 7.867 9.219 1.00 0.00 C ATOM 1132 CD PRO A 77 -1.457 7.767 8.617 1.00 0.00 C ATOM 0 HA PRO A 77 -2.125 9.188 11.473 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.591 8.856 10.995 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -0.442 7.472 11.293 1.00 0.00 H new ATOM 0 HG2 PRO A 77 0.535 8.575 8.666 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.428 6.905 9.187 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -1.450 8.013 7.555 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.864 6.760 8.708 1.00 0.00 H new ATOM 1140 N LYS A 78 -0.916 11.353 11.569 1.00 0.00 N ATOM 1141 CA LYS A 78 -0.514 12.755 11.577 1.00 0.00 C ATOM 1142 C LYS A 78 0.953 12.902 11.185 1.00 0.00 C ATOM 1143 O LYS A 78 1.805 12.133 11.632 1.00 0.00 O ATOM 1144 CB LYS A 78 -0.746 13.366 12.961 1.00 0.00 C ATOM 1145 CG LYS A 78 -1.753 14.503 12.962 1.00 0.00 C ATOM 1146 CD LYS A 78 -1.307 15.641 13.867 1.00 0.00 C ATOM 1147 CE LYS A 78 -2.051 16.930 13.550 1.00 0.00 C ATOM 1148 NZ LYS A 78 -2.432 17.669 14.785 1.00 0.00 N ATOM 0 H LYS A 78 -1.044 10.946 12.496 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.123 13.286 10.845 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.090 12.586 13.640 1.00 0.00 H new ATOM 0 HB3 LYS A 78 0.204 13.732 13.351 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -1.885 14.875 11.946 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.723 14.132 13.294 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.478 15.368 14.908 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -0.235 15.801 13.751 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.425 17.566 12.925 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.947 16.700 12.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.937 18.541 14.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -3.050 17.072 15.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.575 17.911 15.323 1.00 0.00 H new ATOM 1162 N HIS A 79 1.240 13.894 10.348 1.00 0.00 N ATOM 1163 CA HIS A 79 2.605 14.143 9.896 1.00 0.00 C ATOM 1164 C HIS A 79 3.019 15.582 10.185 1.00 0.00 C ATOM 1165 O HIS A 79 2.625 16.505 9.473 1.00 0.00 O ATOM 1166 CB HIS A 79 2.731 13.852 8.400 1.00 0.00 C ATOM 1167 CG HIS A 79 3.827 12.888 8.068 1.00 0.00 C ATOM 1168 ND1 HIS A 79 5.126 13.045 8.501 1.00 0.00 N ATOM 1169 CD2 HIS A 79 3.810 11.746 7.339 1.00 0.00 C ATOM 1170 CE1 HIS A 79 5.861 12.044 8.053 1.00 0.00 C ATOM 1171 NE2 HIS A 79 5.087 11.242 7.345 1.00 0.00 N ATOM 0 H HIS A 79 0.546 14.538 9.969 1.00 0.00 H new ATOM 0 HA HIS A 79 3.271 13.476 10.444 1.00 0.00 H new ATOM 0 HB2 HIS A 79 1.785 13.453 8.035 1.00 0.00 H new ATOM 0 HB3 HIS A 79 2.908 14.788 7.870 1.00 0.00 H new ATOM 0 HD2 HIS A 79 2.952 11.313 6.846 1.00 0.00 H new ATOM 0 HE1 HIS A 79 6.916 11.905 8.235 1.00 0.00 H new ATOM 0 HE2 HIS A 79 5.389 10.387 6.878 1.00 0.00 H new ATOM 1179 N ASN A 80 3.813 15.766 11.234 1.00 0.00 N ATOM 1180 CA ASN A 80 4.279 17.094 11.617 1.00 0.00 C ATOM 1181 C ASN A 80 5.796 17.111 11.785 1.00 0.00 C ATOM 1182 O ASN A 80 6.309 16.959 12.894 1.00 0.00 O ATOM 1183 CB ASN A 80 3.606 17.537 12.917 1.00 0.00 C ATOM 1184 CG ASN A 80 3.989 18.950 13.314 1.00 0.00 C ATOM 1185 OD1 ASN A 80 3.390 19.921 12.852 1.00 0.00 O ATOM 1186 ND2 ASN A 80 4.994 19.070 14.175 1.00 0.00 N ATOM 0 H ASN A 80 4.148 15.012 11.834 1.00 0.00 H new ATOM 0 HA ASN A 80 4.012 17.789 10.821 1.00 0.00 H new ATOM 0 HB2 ASN A 80 2.524 17.476 12.802 1.00 0.00 H new ATOM 0 HB3 ASN A 80 3.881 16.850 13.718 1.00 0.00 H new ATOM 0 HD21 ASN A 80 5.298 19.995 14.479 1.00 0.00 H new ATOM 0 HD22 ASN A 80 5.462 18.237 14.532 1.00 0.00 H new ATOM 1193 N SER A 81 6.506 17.298 10.678 1.00 0.00 N ATOM 1194 CA SER A 81 7.964 17.332 10.701 1.00 0.00 C ATOM 1195 C SER A 81 8.520 17.743 9.341 1.00 0.00 C ATOM 1196 O SER A 81 8.740 16.904 8.469 1.00 0.00 O ATOM 1197 CB SER A 81 8.520 15.964 11.100 1.00 0.00 C ATOM 1198 OG SER A 81 8.077 14.954 10.210 1.00 0.00 O ATOM 0 H SER A 81 6.096 17.428 9.753 1.00 0.00 H new ATOM 0 HA SER A 81 8.274 18.072 11.439 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.609 15.998 11.103 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.205 15.722 12.115 1.00 0.00 H new ATOM 0 HG SER A 81 8.253 15.231 9.287 1.00 0.00 H new ATOM 1204 N ASN A 82 8.744 19.041 9.169 1.00 0.00 N ATOM 1205 CA ASN A 82 9.273 19.566 7.915 1.00 0.00 C ATOM 1206 C ASN A 82 8.384 19.169 6.740 1.00 0.00 C ATOM 1207 O ASN A 82 8.653 18.186 6.049 1.00 0.00 O ATOM 1208 CB ASN A 82 10.698 19.056 7.686 1.00 0.00 C ATOM 1209 CG ASN A 82 11.476 19.928 6.720 1.00 0.00 C ATOM 1210 OD1 ASN A 82 11.623 19.594 5.544 1.00 0.00 O ATOM 1211 ND2 ASN A 82 11.978 21.054 7.214 1.00 0.00 N ATOM 0 H ASN A 82 8.568 19.749 9.882 1.00 0.00 H new ATOM 0 HA ASN A 82 9.289 20.654 7.983 1.00 0.00 H new ATOM 0 HB2 ASN A 82 11.224 19.016 8.640 1.00 0.00 H new ATOM 0 HB3 ASN A 82 10.659 18.037 7.301 1.00 0.00 H new ATOM 0 HD21 ASN A 82 12.510 21.682 6.612 1.00 0.00 H new ATOM 0 HD22 ASN A 82 11.831 21.290 8.195 1.00 0.00 H new ATOM 1218 N SER A 83 7.324 19.940 6.520 1.00 0.00 N ATOM 1219 CA SER A 83 6.393 19.668 5.431 1.00 0.00 C ATOM 1220 C SER A 83 6.482 20.747 4.357 1.00 0.00 C ATOM 1221 O SER A 83 5.806 21.771 4.432 1.00 0.00 O ATOM 1222 CB SER A 83 4.962 19.580 5.965 1.00 0.00 C ATOM 1223 OG SER A 83 4.142 18.810 5.103 1.00 0.00 O ATOM 0 H SER A 83 7.088 20.758 7.082 1.00 0.00 H new ATOM 0 HA SER A 83 6.666 18.712 4.984 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.969 19.134 6.960 1.00 0.00 H new ATOM 0 HB3 SER A 83 4.547 20.582 6.068 1.00 0.00 H new ATOM 0 HG SER A 83 3.233 18.768 5.467 1.00 0.00 H new ATOM 1229 N GLY A 84 7.325 20.509 3.355 1.00 0.00 N ATOM 1230 CA GLY A 84 7.488 21.469 2.279 1.00 0.00 C ATOM 1231 C GLY A 84 8.050 20.839 1.021 1.00 0.00 C ATOM 1232 O GLY A 84 8.052 19.618 0.859 1.00 0.00 O ATOM 0 H GLY A 84 7.897 19.669 3.270 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.524 21.925 2.054 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.150 22.270 2.608 1.00 0.00 H new ATOM 1236 N PRO A 85 8.539 21.682 0.100 1.00 0.00 N ATOM 1237 CA PRO A 85 9.115 21.223 -1.169 1.00 0.00 C ATOM 1238 C PRO A 85 10.446 20.505 -0.975 1.00 0.00 C ATOM 1239 O PRO A 85 10.987 20.467 0.131 1.00 0.00 O ATOM 1240 CB PRO A 85 9.315 22.520 -1.957 1.00 0.00 C ATOM 1241 CG PRO A 85 9.447 23.579 -0.918 1.00 0.00 C ATOM 1242 CD PRO A 85 8.570 23.149 0.225 1.00 0.00 C ATOM 0 HA PRO A 85 8.473 20.499 -1.671 1.00 0.00 H new ATOM 0 HB2 PRO A 85 10.205 22.468 -2.585 1.00 0.00 H new ATOM 0 HB3 PRO A 85 8.470 22.716 -2.617 1.00 0.00 H new ATOM 0 HG2 PRO A 85 10.483 23.684 -0.597 1.00 0.00 H new ATOM 0 HG3 PRO A 85 9.134 24.548 -1.307 1.00 0.00 H new ATOM 0 HD2 PRO A 85 8.980 23.462 1.185 1.00 0.00 H new ATOM 0 HD3 PRO A 85 7.572 23.580 0.149 1.00 0.00 H new ATOM 1250 N SER A 86 10.971 19.941 -2.057 1.00 0.00 N ATOM 1251 CA SER A 86 12.239 19.221 -2.005 1.00 0.00 C ATOM 1252 C SER A 86 13.344 20.019 -2.691 1.00 0.00 C ATOM 1253 O SER A 86 13.093 21.072 -3.277 1.00 0.00 O ATOM 1254 CB SER A 86 12.099 17.849 -2.667 1.00 0.00 C ATOM 1255 OG SER A 86 12.151 16.811 -1.704 1.00 0.00 O ATOM 0 H SER A 86 10.539 19.968 -2.981 1.00 0.00 H new ATOM 0 HA SER A 86 12.509 19.085 -0.958 1.00 0.00 H new ATOM 0 HB2 SER A 86 11.155 17.798 -3.210 1.00 0.00 H new ATOM 0 HB3 SER A 86 12.896 17.711 -3.398 1.00 0.00 H new ATOM 0 HG SER A 86 12.058 15.944 -2.152 1.00 0.00 H new ATOM 1261 N SER A 87 14.569 19.508 -2.614 1.00 0.00 N ATOM 1262 CA SER A 87 15.714 20.173 -3.224 1.00 0.00 C ATOM 1263 C SER A 87 15.831 19.809 -4.701 1.00 0.00 C ATOM 1264 O SER A 87 16.015 20.677 -5.553 1.00 0.00 O ATOM 1265 CB SER A 87 17.001 19.793 -2.490 1.00 0.00 C ATOM 1266 OG SER A 87 17.901 20.887 -2.438 1.00 0.00 O ATOM 0 H SER A 87 14.794 18.636 -2.135 1.00 0.00 H new ATOM 0 HA SER A 87 15.563 21.249 -3.144 1.00 0.00 H new ATOM 0 HB2 SER A 87 16.763 19.466 -1.478 1.00 0.00 H new ATOM 0 HB3 SER A 87 17.476 18.951 -2.994 1.00 0.00 H new ATOM 0 HG SER A 87 18.715 20.619 -1.962 1.00 0.00 H new ATOM 1272 N GLY A 88 15.723 18.517 -4.996 1.00 0.00 N ATOM 1273 CA GLY A 88 15.818 18.059 -6.370 1.00 0.00 C ATOM 1274 C GLY A 88 16.517 16.719 -6.486 1.00 0.00 C ATOM 1275 O GLY A 88 16.009 15.703 -6.013 1.00 0.00 O ATOM 0 H GLY A 88 15.571 17.779 -4.308 1.00 0.00 H new ATOM 0 HA2 GLY A 88 14.817 17.981 -6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.358 18.799 -6.960 1.00 0.00 H new TER 1279 GLY A 88