USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 805 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 68 SER OG : rot -70:sc= -0.537 USER MOD Set 1.2: A 71 GLN : amide:sc= 0.141 X(o=-0.4,f=-0.4) USER MOD Set 2.1: A 39 SER OG : rot -170:sc= 0.36 USER MOD Set 2.2: A 42 THR OG1 : rot 85:sc= 1.21 USER MOD Set 3.1: A 27 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 40 SER OG : rot 105:sc= 1.68 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -134:sc= 0.721 (180deg=-0.00757) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0152 USER MOD Single : A 15 THR OG1 : rot 70:sc= 1.06 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= -1.84 X(o=-1.8,f=-2.1) USER MOD Single : A 26 HIS : no HD1:sc= -3.47 K(o=-3.5,f=-4.6) USER MOD Single : A 28 THR OG1 : rot 110:sc= -0.183 USER MOD Single : A 30 THR OG1 : rot 80:sc= 0.745 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.616 X(o=-0.62,f=-0.62) USER MOD Single : A 67 MET CE :methyl -153:sc= -2.22 (180deg=-5.14!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 CYS SG : rot 140:sc= -0.272 USER MOD Single : A 78 SER OG : rot 180:sc= -0.231 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot -153:sc= 0.608 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -0.33 K(o=-0.33,f=-1.4) USER MOD Single : A 95 ASN : amide:sc= -0.212 K(o=-0.21,f=-1.1) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0581 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.298 -0.501 0.855 1.00 0.00 N ATOM 2 CA MET A 1 1.696 0.027 -0.444 1.00 0.00 C ATOM 3 C MET A 1 1.175 -0.855 -1.573 1.00 0.00 C ATOM 4 O MET A 1 1.008 -2.062 -1.405 1.00 0.00 O ATOM 5 CB MET A 1 3.220 0.136 -0.528 1.00 0.00 C ATOM 6 CG MET A 1 3.932 -1.203 -0.425 1.00 0.00 C ATOM 7 SD MET A 1 4.353 -1.636 1.274 1.00 0.00 S ATOM 8 CE MET A 1 6.123 -1.360 1.265 1.00 0.00 C ATOM 0 H1 MET A 1 0.932 0.272 1.446 1.00 0.00 H new ATOM 0 H2 MET A 1 0.557 -1.219 0.726 1.00 0.00 H new ATOM 0 H3 MET A 1 2.121 -0.933 1.321 1.00 0.00 H new ATOM 0 HA MET A 1 1.261 1.020 -0.553 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.491 0.610 -1.471 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.574 0.789 0.270 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.297 -1.981 -0.848 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.842 -1.174 -1.025 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.531 -1.586 2.250 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.588 -2.008 0.522 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.328 -0.318 1.017 1.00 0.00 H new ATOM 18 N GLY A 2 0.917 -0.244 -2.726 1.00 0.00 N ATOM 19 CA GLY A 2 0.417 -0.989 -3.866 1.00 0.00 C ATOM 20 C GLY A 2 -1.098 -1.012 -3.924 1.00 0.00 C ATOM 21 O GLY A 2 -1.682 -1.310 -4.965 1.00 0.00 O ATOM 0 H GLY A 2 1.046 0.754 -2.890 1.00 0.00 H new ATOM 0 HA2 GLY A 2 0.806 -0.548 -4.784 1.00 0.00 H new ATOM 0 HA3 GLY A 2 0.791 -2.012 -3.820 1.00 0.00 H new ATOM 25 N VAL A 3 -1.736 -0.697 -2.801 1.00 0.00 N ATOM 26 CA VAL A 3 -3.193 -0.683 -2.728 1.00 0.00 C ATOM 27 C VAL A 3 -3.686 0.438 -1.819 1.00 0.00 C ATOM 28 O VAL A 3 -3.272 0.541 -0.665 1.00 0.00 O ATOM 29 CB VAL A 3 -3.742 -2.026 -2.213 1.00 0.00 C ATOM 30 CG1 VAL A 3 -3.097 -2.394 -0.886 1.00 0.00 C ATOM 31 CG2 VAL A 3 -5.256 -1.967 -2.081 1.00 0.00 C ATOM 0 H VAL A 3 -1.267 -0.448 -1.930 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.560 -0.514 -3.740 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.493 -2.802 -2.937 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.498 -3.346 -0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.018 -2.481 -1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.312 -1.619 -0.150 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.627 -2.925 -1.716 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -5.530 -1.180 -1.378 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.698 -1.754 -3.054 1.00 0.00 H new ATOM 41 N GLN A 4 -4.574 1.274 -2.348 1.00 0.00 N ATOM 42 CA GLN A 4 -5.124 2.387 -1.584 1.00 0.00 C ATOM 43 C GLN A 4 -6.647 2.315 -1.536 1.00 0.00 C ATOM 44 O GLN A 4 -7.287 1.854 -2.482 1.00 0.00 O ATOM 45 CB GLN A 4 -4.683 3.719 -2.194 1.00 0.00 C ATOM 46 CG GLN A 4 -3.521 4.369 -1.461 1.00 0.00 C ATOM 47 CD GLN A 4 -2.188 3.733 -1.802 1.00 0.00 C ATOM 48 OE1 GLN A 4 -1.746 3.768 -2.951 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.537 3.149 -0.802 1.00 0.00 N ATOM 0 H GLN A 4 -4.927 1.201 -3.302 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.743 2.319 -0.565 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -4.400 3.557 -3.234 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.530 4.406 -2.197 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -3.487 5.430 -1.709 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -3.689 4.298 -0.386 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.940 3.143 0.135 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.634 2.706 -0.971 1.00 0.00 H new ATOM 58 N VAL A 5 -7.222 2.772 -0.429 1.00 0.00 N ATOM 59 CA VAL A 5 -8.669 2.760 -0.258 1.00 0.00 C ATOM 60 C VAL A 5 -9.195 4.152 0.074 1.00 0.00 C ATOM 61 O VAL A 5 -9.067 4.623 1.205 1.00 0.00 O ATOM 62 CB VAL A 5 -9.095 1.784 0.855 1.00 0.00 C ATOM 63 CG1 VAL A 5 -10.607 1.796 1.026 1.00 0.00 C ATOM 64 CG2 VAL A 5 -8.596 0.380 0.550 1.00 0.00 C ATOM 0 H VAL A 5 -6.707 3.156 0.364 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.096 2.429 -1.205 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.645 2.110 1.793 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.889 1.101 1.816 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -10.935 2.801 1.292 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.081 1.495 0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -8.906 -0.297 1.346 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.016 0.042 -0.397 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -7.508 0.387 0.482 1.00 0.00 H new ATOM 74 N VAL A 6 -9.788 4.808 -0.919 1.00 0.00 N ATOM 75 CA VAL A 6 -10.335 6.146 -0.733 1.00 0.00 C ATOM 76 C VAL A 6 -11.745 6.088 -0.156 1.00 0.00 C ATOM 77 O VAL A 6 -12.715 5.852 -0.878 1.00 0.00 O ATOM 78 CB VAL A 6 -10.367 6.929 -2.058 1.00 0.00 C ATOM 79 CG1 VAL A 6 -10.747 8.381 -1.812 1.00 0.00 C ATOM 80 CG2 VAL A 6 -9.023 6.834 -2.765 1.00 0.00 C ATOM 0 H VAL A 6 -9.902 4.434 -1.861 1.00 0.00 H new ATOM 0 HA VAL A 6 -9.679 6.661 -0.031 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.124 6.485 -2.704 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.764 8.918 -2.760 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.734 8.426 -1.351 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -10.015 8.841 -1.148 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.063 7.393 -3.700 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.245 7.252 -2.126 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.796 5.789 -2.977 1.00 0.00 H new ATOM 90 N THR A 7 -11.854 6.305 1.151 1.00 0.00 N ATOM 91 CA THR A 7 -13.145 6.277 1.826 1.00 0.00 C ATOM 92 C THR A 7 -14.156 7.169 1.116 1.00 0.00 C ATOM 93 O THR A 7 -13.918 8.362 0.919 1.00 0.00 O ATOM 94 CB THR A 7 -13.022 6.728 3.294 1.00 0.00 C ATOM 95 OG1 THR A 7 -11.828 6.190 3.873 1.00 0.00 O ATOM 96 CG2 THR A 7 -14.230 6.279 4.101 1.00 0.00 C ATOM 0 H THR A 7 -11.063 6.502 1.763 1.00 0.00 H new ATOM 0 HA THR A 7 -13.493 5.244 1.799 1.00 0.00 H new ATOM 0 HB THR A 7 -12.976 7.817 3.314 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.756 6.483 4.806 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.120 6.609 5.134 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.134 6.714 3.675 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.303 5.192 4.073 1.00 0.00 H new ATOM 104 N LEU A 8 -15.287 6.585 0.733 1.00 0.00 N ATOM 105 CA LEU A 8 -16.336 7.328 0.044 1.00 0.00 C ATOM 106 C LEU A 8 -17.537 7.549 0.958 1.00 0.00 C ATOM 107 O LEU A 8 -18.063 8.657 1.052 1.00 0.00 O ATOM 108 CB LEU A 8 -16.772 6.582 -1.218 1.00 0.00 C ATOM 109 CG LEU A 8 -15.709 6.427 -2.307 1.00 0.00 C ATOM 110 CD1 LEU A 8 -15.967 5.174 -3.129 1.00 0.00 C ATOM 111 CD2 LEU A 8 -15.677 7.657 -3.201 1.00 0.00 C ATOM 0 H LEU A 8 -15.500 5.600 0.888 1.00 0.00 H new ATOM 0 HA LEU A 8 -15.933 8.301 -0.237 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -17.115 5.589 -0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -17.629 7.103 -1.646 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.736 6.328 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -15.201 5.080 -3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -15.937 4.300 -2.479 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -16.948 5.243 -3.599 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.915 7.528 -3.970 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.650 7.789 -3.674 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.443 8.537 -2.601 1.00 0.00 H new ATOM 123 N ALA A 9 -17.964 6.486 1.632 1.00 0.00 N ATOM 124 CA ALA A 9 -19.100 6.564 2.542 1.00 0.00 C ATOM 125 C ALA A 9 -18.886 5.678 3.764 1.00 0.00 C ATOM 126 O ALA A 9 -19.037 4.458 3.692 1.00 0.00 O ATOM 127 CB ALA A 9 -20.382 6.173 1.821 1.00 0.00 C ATOM 0 H ALA A 9 -17.540 5.561 1.565 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.189 7.595 2.885 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -21.222 6.236 2.513 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -20.550 6.851 0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -20.294 5.152 1.449 1.00 0.00 H new ATOM 133 N ALA A 10 -18.535 6.298 4.885 1.00 0.00 N ATOM 134 CA ALA A 10 -18.302 5.565 6.124 1.00 0.00 C ATOM 135 C ALA A 10 -19.471 4.640 6.442 1.00 0.00 C ATOM 136 O ALA A 10 -20.632 5.005 6.259 1.00 0.00 O ATOM 137 CB ALA A 10 -18.064 6.533 7.273 1.00 0.00 C ATOM 0 H ALA A 10 -18.405 7.307 4.961 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.412 4.950 5.992 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -17.892 5.972 8.192 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.192 7.149 7.055 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.938 7.172 7.397 1.00 0.00 H new ATOM 143 N GLY A 11 -19.157 3.439 6.920 1.00 0.00 N ATOM 144 CA GLY A 11 -20.193 2.480 7.255 1.00 0.00 C ATOM 145 C GLY A 11 -20.342 2.287 8.751 1.00 0.00 C ATOM 146 O GLY A 11 -20.440 3.257 9.503 1.00 0.00 O ATOM 0 H GLY A 11 -18.204 3.114 7.081 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -21.143 2.816 6.839 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -19.961 1.522 6.789 1.00 0.00 H new ATOM 150 N ASP A 12 -20.361 1.031 9.184 1.00 0.00 N ATOM 151 CA ASP A 12 -20.500 0.713 10.601 1.00 0.00 C ATOM 152 C ASP A 12 -19.187 0.949 11.342 1.00 0.00 C ATOM 153 O ASP A 12 -19.184 1.300 12.521 1.00 0.00 O ATOM 154 CB ASP A 12 -20.947 -0.739 10.778 1.00 0.00 C ATOM 155 CG ASP A 12 -19.781 -1.709 10.767 1.00 0.00 C ATOM 156 OD1 ASP A 12 -19.004 -1.690 9.790 1.00 0.00 O ATOM 157 OD2 ASP A 12 -19.648 -2.487 11.735 1.00 0.00 O ATOM 0 H ASP A 12 -20.282 0.217 8.575 1.00 0.00 H new ATOM 0 HA ASP A 12 -21.258 1.372 11.024 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -21.489 -0.837 11.719 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -21.642 -1.002 9.981 1.00 0.00 H new ATOM 162 N GLU A 13 -18.074 0.752 10.641 1.00 0.00 N ATOM 163 CA GLU A 13 -16.756 0.941 11.234 1.00 0.00 C ATOM 164 C GLU A 13 -16.631 0.164 12.541 1.00 0.00 C ATOM 165 O GLU A 13 -16.349 0.738 13.593 1.00 0.00 O ATOM 166 CB GLU A 13 -16.493 2.427 11.485 1.00 0.00 C ATOM 167 CG GLU A 13 -16.237 3.222 10.216 1.00 0.00 C ATOM 168 CD GLU A 13 -16.311 4.720 10.441 1.00 0.00 C ATOM 169 OE1 GLU A 13 -17.355 5.195 10.934 1.00 0.00 O ATOM 170 OE2 GLU A 13 -15.324 5.417 10.124 1.00 0.00 O ATOM 0 H GLU A 13 -18.060 0.462 9.663 1.00 0.00 H new ATOM 0 HA GLU A 13 -16.013 0.561 10.533 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -17.349 2.856 12.006 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -15.633 2.528 12.147 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -15.253 2.966 9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -16.967 2.936 9.459 1.00 0.00 H new ATOM 177 N ALA A 14 -16.843 -1.146 12.467 1.00 0.00 N ATOM 178 CA ALA A 14 -16.753 -2.003 13.643 1.00 0.00 C ATOM 179 C ALA A 14 -16.593 -3.466 13.245 1.00 0.00 C ATOM 180 O ALA A 14 -15.822 -4.207 13.856 1.00 0.00 O ATOM 181 CB ALA A 14 -17.982 -1.824 14.522 1.00 0.00 C ATOM 0 H ALA A 14 -17.078 -1.637 11.605 1.00 0.00 H new ATOM 0 HA ALA A 14 -15.869 -1.709 14.209 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -17.901 -2.470 15.396 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -18.051 -0.785 14.844 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -18.875 -2.089 13.957 1.00 0.00 H new ATOM 187 N THR A 15 -17.328 -3.879 12.217 1.00 0.00 N ATOM 188 CA THR A 15 -17.269 -5.254 11.738 1.00 0.00 C ATOM 189 C THR A 15 -16.395 -5.367 10.494 1.00 0.00 C ATOM 190 O THR A 15 -16.745 -4.855 9.430 1.00 0.00 O ATOM 191 CB THR A 15 -18.674 -5.798 11.416 1.00 0.00 C ATOM 192 OG1 THR A 15 -19.638 -5.219 12.302 1.00 0.00 O ATOM 193 CG2 THR A 15 -18.709 -7.314 11.540 1.00 0.00 C ATOM 0 H THR A 15 -17.972 -3.280 11.700 1.00 0.00 H new ATOM 0 HA THR A 15 -16.832 -5.849 12.540 1.00 0.00 H new ATOM 0 HB THR A 15 -18.918 -5.528 10.388 1.00 0.00 H new ATOM 0 HG1 THR A 15 -19.754 -4.271 12.084 1.00 0.00 H new ATOM 0 HG21 THR A 15 -19.711 -7.675 11.308 1.00 0.00 H new ATOM 0 HG22 THR A 15 -17.995 -7.753 10.843 1.00 0.00 H new ATOM 0 HG23 THR A 15 -18.446 -7.602 12.558 1.00 0.00 H new ATOM 201 N TYR A 16 -15.259 -6.039 10.634 1.00 0.00 N ATOM 202 CA TYR A 16 -14.334 -6.218 9.521 1.00 0.00 C ATOM 203 C TYR A 16 -14.175 -7.695 9.176 1.00 0.00 C ATOM 204 O TYR A 16 -14.356 -8.578 10.015 1.00 0.00 O ATOM 205 CB TYR A 16 -12.971 -5.612 9.861 1.00 0.00 C ATOM 206 CG TYR A 16 -13.018 -4.124 10.124 1.00 0.00 C ATOM 207 CD1 TYR A 16 -13.547 -3.624 11.308 1.00 0.00 C ATOM 208 CD2 TYR A 16 -12.535 -3.217 9.189 1.00 0.00 C ATOM 209 CE1 TYR A 16 -13.593 -2.266 11.552 1.00 0.00 C ATOM 210 CE2 TYR A 16 -12.575 -1.857 9.425 1.00 0.00 C ATOM 211 CZ TYR A 16 -13.105 -1.386 10.608 1.00 0.00 C ATOM 212 OH TYR A 16 -13.149 -0.032 10.847 1.00 0.00 O ATOM 0 H TYR A 16 -14.956 -6.469 11.508 1.00 0.00 H new ATOM 0 HA TYR A 16 -14.747 -5.704 8.653 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -12.568 -6.115 10.740 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -12.282 -5.806 9.039 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -13.929 -4.310 12.050 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -12.121 -3.582 8.261 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -14.009 -1.894 12.477 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.194 -1.166 8.688 1.00 0.00 H new ATOM 0 HH TYR A 16 -12.765 0.448 10.084 1.00 0.00 H new ATOM 222 N PRO A 17 -13.827 -7.972 7.911 1.00 0.00 N ATOM 223 CA PRO A 17 -13.634 -9.341 7.424 1.00 0.00 C ATOM 224 C PRO A 17 -12.389 -9.996 8.013 1.00 0.00 C ATOM 225 O PRO A 17 -11.273 -9.508 7.832 1.00 0.00 O ATOM 226 CB PRO A 17 -13.479 -9.162 5.912 1.00 0.00 C ATOM 227 CG PRO A 17 -12.975 -7.770 5.745 1.00 0.00 C ATOM 228 CD PRO A 17 -13.594 -6.970 6.857 1.00 0.00 C ATOM 0 HA PRO A 17 -14.460 -9.994 7.707 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -12.780 -9.888 5.497 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -14.429 -9.303 5.397 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -11.887 -7.739 5.801 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -13.255 -7.367 4.772 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -12.930 -6.175 7.198 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -14.523 -6.496 6.541 1.00 0.00 H new ATOM 236 N LYS A 18 -12.587 -11.104 8.719 1.00 0.00 N ATOM 237 CA LYS A 18 -11.480 -11.828 9.334 1.00 0.00 C ATOM 238 C LYS A 18 -10.662 -12.569 8.281 1.00 0.00 C ATOM 239 O LYS A 18 -11.192 -12.990 7.253 1.00 0.00 O ATOM 240 CB LYS A 18 -12.007 -12.818 10.375 1.00 0.00 C ATOM 241 CG LYS A 18 -10.933 -13.347 11.309 1.00 0.00 C ATOM 242 CD LYS A 18 -11.514 -13.759 12.651 1.00 0.00 C ATOM 243 CE LYS A 18 -10.433 -13.876 13.715 1.00 0.00 C ATOM 244 NZ LYS A 18 -10.989 -13.728 15.089 1.00 0.00 N ATOM 0 H LYS A 18 -13.504 -11.521 8.880 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.833 -11.102 9.826 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.783 -12.332 10.966 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.476 -13.657 9.861 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.438 -14.202 10.848 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.172 -12.581 11.461 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.258 -13.028 12.966 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.029 -14.714 12.548 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.938 -14.843 13.626 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.673 -13.113 13.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.221 -13.814 15.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.439 -12.795 15.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.696 -14.472 15.260 1.00 0.00 H new ATOM 258 N ALA A 19 -9.369 -12.725 8.545 1.00 0.00 N ATOM 259 CA ALA A 19 -8.480 -13.419 7.621 1.00 0.00 C ATOM 260 C ALA A 19 -8.915 -14.866 7.422 1.00 0.00 C ATOM 261 O ALA A 19 -8.882 -15.669 8.354 1.00 0.00 O ATOM 262 CB ALA A 19 -7.046 -13.361 8.126 1.00 0.00 C ATOM 0 H ALA A 19 -8.914 -12.381 9.390 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.535 -12.916 6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.393 -13.883 7.427 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.731 -12.321 8.209 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -6.985 -13.838 9.104 1.00 0.00 H new ATOM 268 N GLY A 20 -9.324 -15.194 6.200 1.00 0.00 N ATOM 269 CA GLY A 20 -9.762 -16.545 5.901 1.00 0.00 C ATOM 270 C GLY A 20 -11.272 -16.675 5.881 1.00 0.00 C ATOM 271 O GLY A 20 -11.807 -17.696 5.451 1.00 0.00 O ATOM 0 H GLY A 20 -9.360 -14.548 5.412 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.362 -16.847 4.933 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.352 -17.229 6.644 1.00 0.00 H new ATOM 275 N GLN A 21 -11.959 -15.638 6.350 1.00 0.00 N ATOM 276 CA GLN A 21 -13.417 -15.643 6.386 1.00 0.00 C ATOM 277 C GLN A 21 -13.996 -15.135 5.069 1.00 0.00 C ATOM 278 O GLN A 21 -13.281 -14.569 4.242 1.00 0.00 O ATOM 279 CB GLN A 21 -13.922 -14.781 7.545 1.00 0.00 C ATOM 280 CG GLN A 21 -14.181 -15.567 8.820 1.00 0.00 C ATOM 281 CD GLN A 21 -15.268 -14.949 9.676 1.00 0.00 C ATOM 282 OE1 GLN A 21 -16.157 -15.644 10.168 1.00 0.00 O ATOM 283 NE2 GLN A 21 -15.204 -13.635 9.858 1.00 0.00 N ATOM 0 H GLN A 21 -11.530 -14.785 6.710 1.00 0.00 H new ATOM 0 HA GLN A 21 -13.748 -16.671 6.535 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -13.190 -14.000 7.752 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -14.843 -14.283 7.242 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -14.463 -16.588 8.562 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -13.259 -15.628 9.398 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -14.449 -13.097 9.432 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -15.909 -13.164 10.424 1.00 0.00 H new ATOM 292 N VAL A 22 -15.295 -15.342 4.881 1.00 0.00 N ATOM 293 CA VAL A 22 -15.971 -14.905 3.665 1.00 0.00 C ATOM 294 C VAL A 22 -16.589 -13.523 3.846 1.00 0.00 C ATOM 295 O VAL A 22 -17.213 -13.240 4.868 1.00 0.00 O ATOM 296 CB VAL A 22 -17.073 -15.897 3.247 1.00 0.00 C ATOM 297 CG1 VAL A 22 -18.081 -16.079 4.371 1.00 0.00 C ATOM 298 CG2 VAL A 22 -17.759 -15.425 1.975 1.00 0.00 C ATOM 0 H VAL A 22 -15.901 -15.810 5.555 1.00 0.00 H new ATOM 0 HA VAL A 22 -15.215 -14.862 2.881 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.611 -16.864 3.046 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -18.852 -16.783 4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -17.574 -16.466 5.255 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -18.540 -15.119 4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -18.535 -16.137 1.694 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -18.209 -14.447 2.146 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -17.026 -15.352 1.172 1.00 0.00 H new ATOM 308 N ALA A 23 -16.411 -12.665 2.846 1.00 0.00 N ATOM 309 CA ALA A 23 -16.953 -11.313 2.894 1.00 0.00 C ATOM 310 C ALA A 23 -17.744 -10.994 1.630 1.00 0.00 C ATOM 311 O ALA A 23 -17.349 -11.369 0.526 1.00 0.00 O ATOM 312 CB ALA A 23 -15.832 -10.302 3.086 1.00 0.00 C ATOM 0 H ALA A 23 -15.896 -12.883 1.993 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.634 -11.251 3.743 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.251 -9.296 3.120 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -15.311 -10.510 4.020 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.130 -10.375 2.255 1.00 0.00 H new ATOM 318 N VAL A 24 -18.866 -10.301 1.799 1.00 0.00 N ATOM 319 CA VAL A 24 -19.713 -9.931 0.672 1.00 0.00 C ATOM 320 C VAL A 24 -19.689 -8.425 0.437 1.00 0.00 C ATOM 321 O VAL A 24 -20.071 -7.643 1.308 1.00 0.00 O ATOM 322 CB VAL A 24 -21.169 -10.382 0.893 1.00 0.00 C ATOM 323 CG1 VAL A 24 -21.998 -10.146 -0.361 1.00 0.00 C ATOM 324 CG2 VAL A 24 -21.217 -11.845 1.306 1.00 0.00 C ATOM 0 H VAL A 24 -19.209 -9.985 2.706 1.00 0.00 H new ATOM 0 HA VAL A 24 -19.312 -10.439 -0.205 1.00 0.00 H new ATOM 0 HB VAL A 24 -21.597 -9.786 1.700 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -23.024 -10.471 -0.186 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -21.991 -9.084 -0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -21.574 -10.714 -1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -22.253 -12.146 1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.772 -12.459 0.523 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -20.660 -11.980 2.233 1.00 0.00 H new ATOM 334 N VAL A 25 -19.238 -8.023 -0.747 1.00 0.00 N ATOM 335 CA VAL A 25 -19.165 -6.610 -1.099 1.00 0.00 C ATOM 336 C VAL A 25 -19.462 -6.396 -2.579 1.00 0.00 C ATOM 337 O VAL A 25 -19.544 -7.352 -3.351 1.00 0.00 O ATOM 338 CB VAL A 25 -17.779 -6.022 -0.774 1.00 0.00 C ATOM 339 CG1 VAL A 25 -17.254 -6.585 0.538 1.00 0.00 C ATOM 340 CG2 VAL A 25 -16.805 -6.296 -1.910 1.00 0.00 C ATOM 0 H VAL A 25 -18.917 -8.657 -1.479 1.00 0.00 H new ATOM 0 HA VAL A 25 -19.919 -6.096 -0.503 1.00 0.00 H new ATOM 0 HB VAL A 25 -17.878 -4.942 -0.664 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.274 -6.158 0.751 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -17.943 -6.332 1.344 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -17.169 -7.669 0.461 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.831 -5.874 -1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -16.708 -7.372 -2.055 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -17.177 -5.839 -2.827 1.00 0.00 H new ATOM 350 N HIS A 26 -19.622 -5.135 -2.968 1.00 0.00 N ATOM 351 CA HIS A 26 -19.909 -4.795 -4.357 1.00 0.00 C ATOM 352 C HIS A 26 -18.719 -4.088 -5.000 1.00 0.00 C ATOM 353 O HIS A 26 -18.255 -3.060 -4.508 1.00 0.00 O ATOM 354 CB HIS A 26 -21.150 -3.906 -4.440 1.00 0.00 C ATOM 355 CG HIS A 26 -22.419 -4.669 -4.665 1.00 0.00 C ATOM 356 ND1 HIS A 26 -23.171 -4.557 -5.816 1.00 0.00 N ATOM 357 CD2 HIS A 26 -23.067 -5.561 -3.880 1.00 0.00 C ATOM 358 CE1 HIS A 26 -24.227 -5.346 -5.727 1.00 0.00 C ATOM 359 NE2 HIS A 26 -24.188 -5.966 -4.562 1.00 0.00 N ATOM 0 H HIS A 26 -19.558 -4.333 -2.342 1.00 0.00 H new ATOM 0 HA HIS A 26 -20.097 -5.721 -4.901 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -21.239 -3.333 -3.517 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -21.019 -3.188 -5.249 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -22.760 -5.893 -2.899 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -24.992 -5.464 -6.480 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -24.878 -6.637 -4.224 1.00 0.00 H new ATOM 367 N TYR A 27 -18.231 -4.647 -6.102 1.00 0.00 N ATOM 368 CA TYR A 27 -17.094 -4.073 -6.811 1.00 0.00 C ATOM 369 C TYR A 27 -17.552 -3.311 -8.050 1.00 0.00 C ATOM 370 O TYR A 27 -18.420 -3.772 -8.793 1.00 0.00 O ATOM 371 CB TYR A 27 -16.107 -5.171 -7.210 1.00 0.00 C ATOM 372 CG TYR A 27 -16.655 -6.132 -8.241 1.00 0.00 C ATOM 373 CD1 TYR A 27 -16.576 -5.845 -9.598 1.00 0.00 C ATOM 374 CD2 TYR A 27 -17.251 -7.327 -7.857 1.00 0.00 C ATOM 375 CE1 TYR A 27 -17.076 -6.719 -10.543 1.00 0.00 C ATOM 376 CE2 TYR A 27 -17.752 -8.209 -8.796 1.00 0.00 C ATOM 377 CZ TYR A 27 -17.663 -7.900 -10.137 1.00 0.00 C ATOM 378 OH TYR A 27 -18.161 -8.774 -11.076 1.00 0.00 O ATOM 0 H TYR A 27 -18.605 -5.497 -6.523 1.00 0.00 H new ATOM 0 HA TYR A 27 -16.597 -3.373 -6.140 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -15.201 -4.709 -7.602 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -15.820 -5.731 -6.320 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -16.116 -4.922 -9.919 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -17.324 -7.571 -6.807 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -17.008 -6.480 -11.594 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -18.211 -9.135 -8.481 1.00 0.00 H new ATOM 0 HH TYR A 27 -18.540 -9.557 -10.625 1.00 0.00 H new ATOM 388 N THR A 28 -16.963 -2.139 -8.268 1.00 0.00 N ATOM 389 CA THR A 28 -17.310 -1.311 -9.417 1.00 0.00 C ATOM 390 C THR A 28 -16.064 -0.895 -10.191 1.00 0.00 C ATOM 391 O THR A 28 -15.149 -0.290 -9.634 1.00 0.00 O ATOM 392 CB THR A 28 -18.079 -0.048 -8.987 1.00 0.00 C ATOM 393 OG1 THR A 28 -19.220 -0.412 -8.202 1.00 0.00 O ATOM 394 CG2 THR A 28 -18.527 0.752 -10.201 1.00 0.00 C ATOM 0 H THR A 28 -16.243 -1.742 -7.664 1.00 0.00 H new ATOM 0 HA THR A 28 -17.949 -1.915 -10.061 1.00 0.00 H new ATOM 0 HB THR A 28 -17.410 0.572 -8.389 1.00 0.00 H new ATOM 0 HG1 THR A 28 -19.075 -0.144 -7.270 1.00 0.00 H new ATOM 0 HG21 THR A 28 -19.068 1.639 -9.873 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.654 1.053 -10.781 1.00 0.00 H new ATOM 0 HG23 THR A 28 -19.180 0.138 -10.821 1.00 0.00 H new ATOM 402 N GLY A 29 -16.036 -1.223 -11.479 1.00 0.00 N ATOM 403 CA GLY A 29 -14.898 -0.875 -12.309 1.00 0.00 C ATOM 404 C GLY A 29 -14.720 0.624 -12.449 1.00 0.00 C ATOM 405 O GLY A 29 -15.696 1.365 -12.566 1.00 0.00 O ATOM 0 H GLY A 29 -16.782 -1.724 -11.963 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -13.994 -1.307 -11.880 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -15.024 -1.317 -13.297 1.00 0.00 H new ATOM 409 N THR A 30 -13.469 1.074 -12.436 1.00 0.00 N ATOM 410 CA THR A 30 -13.166 2.494 -12.560 1.00 0.00 C ATOM 411 C THR A 30 -11.677 2.720 -12.794 1.00 0.00 C ATOM 412 O THR A 30 -10.834 2.062 -12.181 1.00 0.00 O ATOM 413 CB THR A 30 -13.601 3.273 -11.304 1.00 0.00 C ATOM 414 OG1 THR A 30 -14.173 2.376 -10.345 1.00 0.00 O ATOM 415 CG2 THR A 30 -14.610 4.354 -11.661 1.00 0.00 C ATOM 0 H THR A 30 -12.649 0.475 -12.341 1.00 0.00 H new ATOM 0 HA THR A 30 -13.726 2.863 -13.419 1.00 0.00 H new ATOM 0 HB THR A 30 -12.720 3.749 -10.874 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.457 1.916 -9.860 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.903 4.891 -10.759 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.161 5.051 -12.369 1.00 0.00 H new ATOM 0 HG23 THR A 30 -15.490 3.896 -12.112 1.00 0.00 H new ATOM 423 N LEU A 31 -11.357 3.654 -13.683 1.00 0.00 N ATOM 424 CA LEU A 31 -9.968 3.968 -13.997 1.00 0.00 C ATOM 425 C LEU A 31 -9.477 5.154 -13.173 1.00 0.00 C ATOM 426 O LEU A 31 -10.275 5.946 -12.672 1.00 0.00 O ATOM 427 CB LEU A 31 -9.818 4.273 -15.489 1.00 0.00 C ATOM 428 CG LEU A 31 -9.726 3.060 -16.416 1.00 0.00 C ATOM 429 CD1 LEU A 31 -9.617 3.504 -17.866 1.00 0.00 C ATOM 430 CD2 LEU A 31 -8.541 2.186 -16.033 1.00 0.00 C ATOM 0 H LEU A 31 -12.041 4.207 -14.199 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.360 3.099 -13.746 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.667 4.881 -15.802 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -8.923 4.880 -15.627 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.637 2.472 -16.306 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.552 2.628 -18.511 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.497 4.088 -18.135 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.723 4.115 -17.993 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.491 1.328 -16.703 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.621 2.765 -16.115 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.662 1.839 -15.007 1.00 0.00 H new ATOM 442 N ALA A 32 -8.160 5.270 -13.038 1.00 0.00 N ATOM 443 CA ALA A 32 -7.564 6.362 -12.278 1.00 0.00 C ATOM 444 C ALA A 32 -7.969 7.715 -12.851 1.00 0.00 C ATOM 445 O ALA A 32 -7.922 8.732 -12.158 1.00 0.00 O ATOM 446 CB ALA A 32 -6.048 6.226 -12.261 1.00 0.00 C ATOM 0 H ALA A 32 -7.486 4.622 -13.445 1.00 0.00 H new ATOM 0 HA ALA A 32 -7.935 6.305 -11.255 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -5.615 7.048 -11.690 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.773 5.278 -11.798 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.669 6.255 -13.282 1.00 0.00 H new ATOM 452 N ASP A 33 -8.367 7.721 -14.118 1.00 0.00 N ATOM 453 CA ASP A 33 -8.781 8.951 -14.784 1.00 0.00 C ATOM 454 C ASP A 33 -10.248 9.255 -14.498 1.00 0.00 C ATOM 455 O ASP A 33 -10.721 10.365 -14.742 1.00 0.00 O ATOM 456 CB ASP A 33 -8.555 8.840 -16.293 1.00 0.00 C ATOM 457 CG ASP A 33 -8.797 10.152 -17.012 1.00 0.00 C ATOM 458 OD1 ASP A 33 -8.356 11.201 -16.498 1.00 0.00 O ATOM 459 OD2 ASP A 33 -9.429 10.131 -18.089 1.00 0.00 O ATOM 0 H ASP A 33 -8.412 6.888 -14.705 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.176 9.769 -14.393 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.534 8.509 -16.481 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.218 8.077 -16.702 1.00 0.00 H new ATOM 464 N GLY A 34 -10.964 8.262 -13.980 1.00 0.00 N ATOM 465 CA GLY A 34 -12.370 8.443 -13.671 1.00 0.00 C ATOM 466 C GLY A 34 -13.274 7.642 -14.588 1.00 0.00 C ATOM 467 O GLY A 34 -14.449 7.434 -14.287 1.00 0.00 O ATOM 0 H GLY A 34 -10.595 7.335 -13.769 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.553 8.148 -12.638 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.623 9.500 -13.750 1.00 0.00 H new ATOM 471 N LYS A 35 -12.725 7.194 -15.712 1.00 0.00 N ATOM 472 CA LYS A 35 -13.489 6.412 -16.677 1.00 0.00 C ATOM 473 C LYS A 35 -14.184 5.236 -15.997 1.00 0.00 C ATOM 474 O LYS A 35 -13.531 4.310 -15.516 1.00 0.00 O ATOM 475 CB LYS A 35 -12.571 5.901 -17.790 1.00 0.00 C ATOM 476 CG LYS A 35 -13.301 5.592 -19.086 1.00 0.00 C ATOM 477 CD LYS A 35 -12.362 5.638 -20.279 1.00 0.00 C ATOM 478 CE LYS A 35 -12.307 7.029 -20.892 1.00 0.00 C ATOM 479 NZ LYS A 35 -13.465 7.284 -21.793 1.00 0.00 N ATOM 0 H LYS A 35 -11.754 7.359 -15.977 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.251 7.060 -17.110 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -11.801 6.647 -17.986 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.062 5.001 -17.445 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.759 4.605 -19.020 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -14.109 6.310 -19.230 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -11.362 5.337 -19.968 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -12.692 4.921 -21.031 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -12.293 7.776 -20.098 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -11.379 7.143 -21.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -13.391 8.242 -22.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -13.464 6.587 -22.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -14.350 7.201 -21.253 1.00 0.00 H new ATOM 493 N VAL A 36 -15.512 5.280 -15.962 1.00 0.00 N ATOM 494 CA VAL A 36 -16.296 4.218 -15.343 1.00 0.00 C ATOM 495 C VAL A 36 -16.196 2.924 -16.144 1.00 0.00 C ATOM 496 O VAL A 36 -16.172 2.943 -17.374 1.00 0.00 O ATOM 497 CB VAL A 36 -17.778 4.616 -15.214 1.00 0.00 C ATOM 498 CG1 VAL A 36 -18.454 4.607 -16.577 1.00 0.00 C ATOM 499 CG2 VAL A 36 -18.497 3.687 -14.247 1.00 0.00 C ATOM 0 H VAL A 36 -16.067 6.040 -16.355 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.883 4.059 -14.347 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.831 5.629 -14.816 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.501 4.891 -16.466 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -17.954 5.317 -17.236 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.393 3.607 -17.007 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -19.543 3.983 -14.168 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.436 2.662 -14.614 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -18.027 3.749 -13.265 1.00 0.00 H new ATOM 509 N PHE A 37 -16.140 1.800 -15.437 1.00 0.00 N ATOM 510 CA PHE A 37 -16.043 0.496 -16.081 1.00 0.00 C ATOM 511 C PHE A 37 -17.147 -0.437 -15.591 1.00 0.00 C ATOM 512 O PHE A 37 -18.017 -0.034 -14.819 1.00 0.00 O ATOM 513 CB PHE A 37 -14.673 -0.130 -15.810 1.00 0.00 C ATOM 514 CG PHE A 37 -13.658 0.166 -16.877 1.00 0.00 C ATOM 515 CD1 PHE A 37 -13.282 1.471 -17.151 1.00 0.00 C ATOM 516 CD2 PHE A 37 -13.079 -0.862 -17.605 1.00 0.00 C ATOM 517 CE1 PHE A 37 -12.347 1.746 -18.131 1.00 0.00 C ATOM 518 CE2 PHE A 37 -12.144 -0.592 -18.586 1.00 0.00 C ATOM 519 CZ PHE A 37 -11.778 0.713 -18.850 1.00 0.00 C ATOM 0 H PHE A 37 -16.160 1.766 -14.418 1.00 0.00 H new ATOM 0 HA PHE A 37 -16.163 0.640 -17.155 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -14.299 0.234 -14.853 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -14.788 -1.210 -15.718 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -13.725 2.283 -16.592 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -13.362 -1.885 -17.403 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.062 2.768 -18.334 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -11.700 -1.401 -19.146 1.00 0.00 H new ATOM 0 HZ PHE A 37 -11.048 0.926 -19.617 1.00 0.00 H new ATOM 529 N ASP A 38 -17.104 -1.685 -16.045 1.00 0.00 N ATOM 530 CA ASP A 38 -18.099 -2.676 -15.652 1.00 0.00 C ATOM 531 C ASP A 38 -18.153 -2.820 -14.135 1.00 0.00 C ATOM 532 O ASP A 38 -17.120 -2.940 -13.475 1.00 0.00 O ATOM 533 CB ASP A 38 -17.785 -4.027 -16.295 1.00 0.00 C ATOM 534 CG ASP A 38 -18.964 -4.979 -16.247 1.00 0.00 C ATOM 535 OD1 ASP A 38 -19.472 -5.239 -15.136 1.00 0.00 O ATOM 536 OD2 ASP A 38 -19.378 -5.466 -17.320 1.00 0.00 O ATOM 0 H ASP A 38 -16.391 -2.034 -16.685 1.00 0.00 H new ATOM 0 HA ASP A 38 -19.074 -2.335 -16.001 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -17.489 -3.872 -17.332 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -16.935 -4.480 -15.785 1.00 0.00 H new ATOM 541 N SER A 39 -19.364 -2.808 -13.587 1.00 0.00 N ATOM 542 CA SER A 39 -19.552 -2.933 -12.146 1.00 0.00 C ATOM 543 C SER A 39 -20.461 -4.113 -11.817 1.00 0.00 C ATOM 544 O SER A 39 -21.250 -4.555 -12.653 1.00 0.00 O ATOM 545 CB SER A 39 -20.145 -1.643 -11.574 1.00 0.00 C ATOM 546 OG SER A 39 -21.514 -1.516 -11.915 1.00 0.00 O ATOM 0 H SER A 39 -20.229 -2.713 -14.119 1.00 0.00 H new ATOM 0 HA SER A 39 -18.577 -3.110 -11.691 1.00 0.00 H new ATOM 0 HB2 SER A 39 -20.035 -1.638 -10.490 1.00 0.00 H new ATOM 0 HB3 SER A 39 -19.591 -0.785 -11.954 1.00 0.00 H new ATOM 0 HG SER A 39 -21.828 -0.619 -11.678 1.00 0.00 H new ATOM 552 N SER A 40 -20.345 -4.619 -10.594 1.00 0.00 N ATOM 553 CA SER A 40 -21.153 -5.750 -10.154 1.00 0.00 C ATOM 554 C SER A 40 -22.565 -5.301 -9.793 1.00 0.00 C ATOM 555 O SER A 40 -23.532 -6.040 -9.986 1.00 0.00 O ATOM 556 CB SER A 40 -20.499 -6.434 -8.952 1.00 0.00 C ATOM 557 OG SER A 40 -20.650 -7.841 -9.021 1.00 0.00 O ATOM 0 H SER A 40 -19.699 -4.263 -9.890 1.00 0.00 H new ATOM 0 HA SER A 40 -21.217 -6.462 -10.977 1.00 0.00 H new ATOM 0 HB2 SER A 40 -19.440 -6.180 -8.917 1.00 0.00 H new ATOM 0 HB3 SER A 40 -20.946 -6.062 -8.030 1.00 0.00 H new ATOM 0 HG SER A 40 -19.799 -8.249 -9.286 1.00 0.00 H new ATOM 563 N ARG A 41 -22.677 -4.086 -9.267 1.00 0.00 N ATOM 564 CA ARG A 41 -23.971 -3.538 -8.877 1.00 0.00 C ATOM 565 C ARG A 41 -24.919 -3.481 -10.071 1.00 0.00 C ATOM 566 O ARG A 41 -26.133 -3.631 -9.922 1.00 0.00 O ATOM 567 CB ARG A 41 -23.797 -2.139 -8.283 1.00 0.00 C ATOM 568 CG ARG A 41 -22.950 -1.213 -9.140 1.00 0.00 C ATOM 569 CD ARG A 41 -23.437 0.225 -9.056 1.00 0.00 C ATOM 570 NE ARG A 41 -23.682 0.640 -7.678 1.00 0.00 N ATOM 571 CZ ARG A 41 -22.717 0.981 -6.830 1.00 0.00 C ATOM 572 NH1 ARG A 41 -21.449 0.956 -7.219 1.00 0.00 N ATOM 573 NH2 ARG A 41 -23.019 1.348 -5.592 1.00 0.00 N ATOM 0 H ARG A 41 -21.887 -3.462 -9.101 1.00 0.00 H new ATOM 0 HA ARG A 41 -24.404 -4.195 -8.122 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -24.780 -1.690 -8.140 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -23.340 -2.227 -7.297 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -21.910 -1.266 -8.816 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -22.978 -1.548 -10.177 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -22.697 0.885 -9.507 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -24.354 0.332 -9.635 1.00 0.00 H new ATOM 0 HE ARG A 41 -24.647 0.670 -7.348 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -21.213 0.675 -8.171 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -20.710 1.218 -6.567 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -23.993 1.369 -5.289 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -22.277 1.609 -4.942 1.00 0.00 H new ATOM 587 N THR A 42 -24.358 -3.262 -11.257 1.00 0.00 N ATOM 588 CA THR A 42 -25.153 -3.184 -12.475 1.00 0.00 C ATOM 589 C THR A 42 -25.834 -4.515 -12.775 1.00 0.00 C ATOM 590 O THR A 42 -26.855 -4.560 -13.461 1.00 0.00 O ATOM 591 CB THR A 42 -24.290 -2.778 -13.684 1.00 0.00 C ATOM 592 OG1 THR A 42 -23.674 -1.508 -13.443 1.00 0.00 O ATOM 593 CG2 THR A 42 -25.130 -2.708 -14.951 1.00 0.00 C ATOM 0 H THR A 42 -23.356 -3.136 -11.399 1.00 0.00 H new ATOM 0 HA THR A 42 -25.913 -2.421 -12.307 1.00 0.00 H new ATOM 0 HB THR A 42 -23.518 -3.535 -13.821 1.00 0.00 H new ATOM 0 HG1 THR A 42 -22.846 -1.637 -12.935 1.00 0.00 H new ATOM 0 HG21 THR A 42 -24.498 -2.419 -15.791 1.00 0.00 H new ATOM 0 HG22 THR A 42 -25.573 -3.684 -15.149 1.00 0.00 H new ATOM 0 HG23 THR A 42 -25.922 -1.970 -14.822 1.00 0.00 H new ATOM 601 N ARG A 43 -25.262 -5.596 -12.256 1.00 0.00 N ATOM 602 CA ARG A 43 -25.813 -6.929 -12.469 1.00 0.00 C ATOM 603 C ARG A 43 -26.710 -7.338 -11.304 1.00 0.00 C ATOM 604 O ARG A 43 -27.194 -8.468 -11.248 1.00 0.00 O ATOM 605 CB ARG A 43 -24.686 -7.949 -12.642 1.00 0.00 C ATOM 606 CG ARG A 43 -23.985 -7.859 -13.987 1.00 0.00 C ATOM 607 CD ARG A 43 -23.281 -9.161 -14.336 1.00 0.00 C ATOM 608 NE ARG A 43 -24.225 -10.258 -14.534 1.00 0.00 N ATOM 609 CZ ARG A 43 -24.932 -10.428 -15.645 1.00 0.00 C ATOM 610 NH1 ARG A 43 -24.802 -9.577 -16.654 1.00 0.00 N ATOM 611 NH2 ARG A 43 -25.771 -11.451 -15.750 1.00 0.00 N ATOM 0 H ARG A 43 -24.417 -5.575 -11.685 1.00 0.00 H new ATOM 0 HA ARG A 43 -26.414 -6.906 -13.378 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -23.952 -7.805 -11.849 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -25.094 -8.953 -12.521 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -24.712 -7.618 -14.762 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -23.259 -7.046 -13.967 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -22.691 -9.022 -15.242 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -22.585 -9.421 -13.539 1.00 0.00 H new ATOM 0 HE ARG A 43 -24.348 -10.931 -13.777 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -24.158 -8.790 -16.578 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -25.346 -9.710 -17.506 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -25.873 -12.108 -14.977 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -26.313 -11.580 -16.604 1.00 0.00 H new ATOM 625 N GLY A 44 -26.927 -6.411 -10.376 1.00 0.00 N ATOM 626 CA GLY A 44 -27.764 -6.695 -9.225 1.00 0.00 C ATOM 627 C GLY A 44 -27.352 -7.965 -8.507 1.00 0.00 C ATOM 628 O GLY A 44 -28.197 -8.776 -8.130 1.00 0.00 O ATOM 0 H GLY A 44 -26.538 -5.468 -10.401 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -27.717 -5.857 -8.530 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -28.801 -6.784 -9.547 1.00 0.00 H new ATOM 632 N LYS A 45 -26.048 -8.140 -8.320 1.00 0.00 N ATOM 633 CA LYS A 45 -25.524 -9.320 -7.643 1.00 0.00 C ATOM 634 C LYS A 45 -24.211 -9.002 -6.934 1.00 0.00 C ATOM 635 O LYS A 45 -23.208 -8.657 -7.560 1.00 0.00 O ATOM 636 CB LYS A 45 -25.313 -10.457 -8.646 1.00 0.00 C ATOM 637 CG LYS A 45 -24.893 -11.766 -8.001 1.00 0.00 C ATOM 638 CD LYS A 45 -24.665 -12.851 -9.040 1.00 0.00 C ATOM 639 CE LYS A 45 -25.971 -13.511 -9.453 1.00 0.00 C ATOM 640 NZ LYS A 45 -25.740 -14.751 -10.245 1.00 0.00 N ATOM 0 H LYS A 45 -25.335 -7.479 -8.628 1.00 0.00 H new ATOM 0 HA LYS A 45 -26.253 -9.634 -6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -26.237 -10.616 -9.202 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -24.553 -10.157 -9.368 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -23.979 -11.613 -7.427 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -25.661 -12.089 -7.298 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -24.181 -12.421 -9.917 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -23.987 -13.604 -8.638 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -26.553 -13.751 -8.564 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -26.562 -12.809 -10.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -26.655 -15.171 -10.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -25.206 -14.518 -11.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -25.198 -15.431 -9.675 1.00 0.00 H new ATOM 654 N PRO A 46 -24.214 -9.122 -5.598 1.00 0.00 N ATOM 655 CA PRO A 46 -23.030 -8.854 -4.777 1.00 0.00 C ATOM 656 C PRO A 46 -21.943 -9.906 -4.966 1.00 0.00 C ATOM 657 O PRO A 46 -22.234 -11.077 -5.210 1.00 0.00 O ATOM 658 CB PRO A 46 -23.573 -8.899 -3.346 1.00 0.00 C ATOM 659 CG PRO A 46 -24.780 -9.769 -3.427 1.00 0.00 C ATOM 660 CD PRO A 46 -25.374 -9.529 -4.787 1.00 0.00 C ATOM 0 HA PRO A 46 -22.558 -7.907 -5.040 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -22.836 -9.308 -2.655 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -23.827 -7.902 -2.987 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -24.514 -10.818 -3.297 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -25.493 -9.521 -2.641 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -25.846 -10.428 -5.184 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -26.138 -8.752 -4.760 1.00 0.00 H new ATOM 668 N PHE A 47 -20.688 -9.481 -4.853 1.00 0.00 N ATOM 669 CA PHE A 47 -19.557 -10.387 -5.012 1.00 0.00 C ATOM 670 C PHE A 47 -19.007 -10.815 -3.655 1.00 0.00 C ATOM 671 O PHE A 47 -18.528 -9.988 -2.879 1.00 0.00 O ATOM 672 CB PHE A 47 -18.453 -9.719 -5.835 1.00 0.00 C ATOM 673 CG PHE A 47 -17.518 -10.695 -6.489 1.00 0.00 C ATOM 674 CD1 PHE A 47 -17.962 -11.528 -7.503 1.00 0.00 C ATOM 675 CD2 PHE A 47 -16.194 -10.781 -6.088 1.00 0.00 C ATOM 676 CE1 PHE A 47 -17.104 -12.427 -8.107 1.00 0.00 C ATOM 677 CE2 PHE A 47 -15.331 -11.678 -6.689 1.00 0.00 C ATOM 678 CZ PHE A 47 -15.787 -12.503 -7.699 1.00 0.00 C ATOM 0 H PHE A 47 -20.429 -8.515 -4.652 1.00 0.00 H new ATOM 0 HA PHE A 47 -19.907 -11.275 -5.538 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -18.911 -9.096 -6.603 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -17.879 -9.056 -5.187 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -18.991 -11.474 -7.825 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -15.833 -10.140 -5.297 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -17.463 -13.070 -8.897 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -14.301 -11.734 -6.369 1.00 0.00 H new ATOM 0 HZ PHE A 47 -15.115 -13.206 -8.168 1.00 0.00 H new ATOM 688 N ARG A 48 -19.081 -12.112 -3.376 1.00 0.00 N ATOM 689 CA ARG A 48 -18.592 -12.650 -2.112 1.00 0.00 C ATOM 690 C ARG A 48 -17.369 -13.536 -2.334 1.00 0.00 C ATOM 691 O ARG A 48 -17.276 -14.243 -3.337 1.00 0.00 O ATOM 692 CB ARG A 48 -19.694 -13.450 -1.414 1.00 0.00 C ATOM 693 CG ARG A 48 -20.199 -14.630 -2.228 1.00 0.00 C ATOM 694 CD ARG A 48 -20.537 -15.816 -1.339 1.00 0.00 C ATOM 695 NE ARG A 48 -20.918 -16.992 -2.117 1.00 0.00 N ATOM 696 CZ ARG A 48 -21.617 -18.007 -1.620 1.00 0.00 C ATOM 697 NH1 ARG A 48 -22.009 -17.990 -0.353 1.00 0.00 N ATOM 698 NH2 ARG A 48 -21.925 -19.042 -2.391 1.00 0.00 N ATOM 0 H ARG A 48 -19.475 -12.810 -4.008 1.00 0.00 H new ATOM 0 HA ARG A 48 -18.302 -11.812 -1.478 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.317 -13.814 -0.458 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.530 -12.786 -1.195 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -21.083 -14.333 -2.792 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -19.441 -14.923 -2.955 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -19.677 -16.058 -0.714 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -21.352 -15.545 -0.668 1.00 0.00 H new ATOM 0 HE ARG A 48 -20.632 -17.037 -3.095 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -21.774 -17.196 0.243 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -22.545 -18.771 0.025 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -21.625 -19.059 -3.366 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -22.462 -19.821 -2.009 1.00 0.00 H new ATOM 712 N PHE A 49 -16.433 -13.490 -1.392 1.00 0.00 N ATOM 713 CA PHE A 49 -15.215 -14.286 -1.485 1.00 0.00 C ATOM 714 C PHE A 49 -14.502 -14.349 -0.138 1.00 0.00 C ATOM 715 O PHE A 49 -14.803 -13.579 0.774 1.00 0.00 O ATOM 716 CB PHE A 49 -14.278 -13.701 -2.544 1.00 0.00 C ATOM 717 CG PHE A 49 -13.731 -12.351 -2.180 1.00 0.00 C ATOM 718 CD1 PHE A 49 -12.562 -12.237 -1.446 1.00 0.00 C ATOM 719 CD2 PHE A 49 -14.386 -11.195 -2.574 1.00 0.00 C ATOM 720 CE1 PHE A 49 -12.058 -10.995 -1.109 1.00 0.00 C ATOM 721 CE2 PHE A 49 -13.886 -9.950 -2.241 1.00 0.00 C ATOM 722 CZ PHE A 49 -12.720 -9.850 -1.508 1.00 0.00 C ATOM 0 H PHE A 49 -16.495 -12.910 -0.555 1.00 0.00 H new ATOM 0 HA PHE A 49 -15.494 -15.299 -1.776 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -13.448 -14.389 -2.704 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -14.815 -13.624 -3.490 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -12.039 -13.128 -1.134 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -15.298 -11.268 -3.148 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -11.147 -10.920 -0.534 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -14.407 -9.057 -2.554 1.00 0.00 H new ATOM 0 HZ PHE A 49 -12.326 -8.879 -1.247 1.00 0.00 H new ATOM 732 N THR A 50 -13.554 -15.274 -0.019 1.00 0.00 N ATOM 733 CA THR A 50 -12.799 -15.440 1.216 1.00 0.00 C ATOM 734 C THR A 50 -11.604 -14.495 1.261 1.00 0.00 C ATOM 735 O THR A 50 -10.650 -14.647 0.497 1.00 0.00 O ATOM 736 CB THR A 50 -12.300 -16.888 1.379 1.00 0.00 C ATOM 737 OG1 THR A 50 -13.413 -17.787 1.433 1.00 0.00 O ATOM 738 CG2 THR A 50 -11.463 -17.034 2.641 1.00 0.00 C ATOM 0 H THR A 50 -13.291 -15.920 -0.764 1.00 0.00 H new ATOM 0 HA THR A 50 -13.478 -15.203 2.035 1.00 0.00 H new ATOM 0 HB THR A 50 -11.677 -17.132 0.519 1.00 0.00 H new ATOM 0 HG1 THR A 50 -13.087 -18.706 1.535 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.122 -18.065 2.734 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.600 -16.370 2.584 1.00 0.00 H new ATOM 0 HG23 THR A 50 -12.066 -16.771 3.510 1.00 0.00 H new ATOM 746 N VAL A 51 -11.660 -13.519 2.161 1.00 0.00 N ATOM 747 CA VAL A 51 -10.581 -12.549 2.307 1.00 0.00 C ATOM 748 C VAL A 51 -9.292 -13.226 2.759 1.00 0.00 C ATOM 749 O VAL A 51 -9.150 -13.602 3.922 1.00 0.00 O ATOM 750 CB VAL A 51 -10.950 -11.446 3.317 1.00 0.00 C ATOM 751 CG1 VAL A 51 -9.913 -10.334 3.295 1.00 0.00 C ATOM 752 CG2 VAL A 51 -12.338 -10.898 3.023 1.00 0.00 C ATOM 0 H VAL A 51 -12.442 -13.379 2.801 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.427 -12.097 1.327 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.960 -11.881 4.317 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.190 -9.564 4.015 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.937 -10.742 3.558 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.868 -9.898 2.297 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -12.583 -10.120 3.746 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -12.358 -10.478 2.017 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.070 -11.703 3.095 1.00 0.00 H new ATOM 762 N GLY A 52 -8.352 -13.378 1.831 1.00 0.00 N ATOM 763 CA GLY A 52 -7.086 -14.010 2.153 1.00 0.00 C ATOM 764 C GLY A 52 -6.843 -15.268 1.343 1.00 0.00 C ATOM 765 O GLY A 52 -5.724 -15.780 1.300 1.00 0.00 O ATOM 0 H GLY A 52 -8.445 -13.075 0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.275 -13.304 1.974 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.066 -14.256 3.215 1.00 0.00 H new ATOM 769 N ARG A 53 -7.894 -15.769 0.702 1.00 0.00 N ATOM 770 CA ARG A 53 -7.790 -16.977 -0.108 1.00 0.00 C ATOM 771 C ARG A 53 -7.091 -16.685 -1.433 1.00 0.00 C ATOM 772 O ARG A 53 -6.790 -15.535 -1.748 1.00 0.00 O ATOM 773 CB ARG A 53 -9.179 -17.562 -0.369 1.00 0.00 C ATOM 774 CG ARG A 53 -9.575 -18.652 0.613 1.00 0.00 C ATOM 775 CD ARG A 53 -8.738 -19.907 0.420 1.00 0.00 C ATOM 776 NE ARG A 53 -9.332 -21.067 1.079 1.00 0.00 N ATOM 777 CZ ARG A 53 -9.242 -21.296 2.385 1.00 0.00 C ATOM 778 NH1 ARG A 53 -8.587 -20.449 3.166 1.00 0.00 N ATOM 779 NH2 ARG A 53 -9.808 -22.374 2.911 1.00 0.00 N ATOM 0 H ARG A 53 -8.827 -15.357 0.728 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.195 -17.705 0.444 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.916 -16.760 -0.325 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.209 -17.967 -1.380 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.454 -18.286 1.633 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.630 -18.894 0.484 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.630 -20.111 -0.645 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.736 -19.739 0.815 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.844 -21.738 0.506 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.150 -19.619 2.765 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -8.519 -20.627 4.168 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.313 -23.028 2.313 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.738 -22.549 3.913 1.00 0.00 H new ATOM 793 N GLY A 54 -6.835 -17.737 -2.205 1.00 0.00 N ATOM 794 CA GLY A 54 -6.173 -17.573 -3.486 1.00 0.00 C ATOM 795 C GLY A 54 -7.154 -17.495 -4.640 1.00 0.00 C ATOM 796 O GLY A 54 -6.803 -17.792 -5.781 1.00 0.00 O ATOM 0 H GLY A 54 -7.074 -18.699 -1.966 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.568 -16.666 -3.465 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.491 -18.408 -3.649 1.00 0.00 H new ATOM 800 N GLU A 55 -8.386 -17.096 -4.341 1.00 0.00 N ATOM 801 CA GLU A 55 -9.421 -16.983 -5.362 1.00 0.00 C ATOM 802 C GLU A 55 -9.527 -15.549 -5.872 1.00 0.00 C ATOM 803 O GLU A 55 -10.021 -15.304 -6.973 1.00 0.00 O ATOM 804 CB GLU A 55 -10.771 -17.439 -4.805 1.00 0.00 C ATOM 805 CG GLU A 55 -10.723 -18.802 -4.134 1.00 0.00 C ATOM 806 CD GLU A 55 -10.519 -19.932 -5.124 1.00 0.00 C ATOM 807 OE1 GLU A 55 -10.791 -19.726 -6.325 1.00 0.00 O ATOM 808 OE2 GLU A 55 -10.087 -21.023 -4.696 1.00 0.00 O ATOM 0 H GLU A 55 -8.692 -16.846 -3.401 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.144 -17.628 -6.196 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -11.126 -16.701 -4.085 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.498 -17.468 -5.616 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.915 -18.815 -3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -11.651 -18.966 -3.587 1.00 0.00 H new ATOM 815 N VAL A 56 -9.060 -14.603 -5.063 1.00 0.00 N ATOM 816 CA VAL A 56 -9.102 -13.193 -5.432 1.00 0.00 C ATOM 817 C VAL A 56 -7.698 -12.642 -5.656 1.00 0.00 C ATOM 818 O VAL A 56 -6.711 -13.371 -5.556 1.00 0.00 O ATOM 819 CB VAL A 56 -9.806 -12.351 -4.351 1.00 0.00 C ATOM 820 CG1 VAL A 56 -11.302 -12.624 -4.351 1.00 0.00 C ATOM 821 CG2 VAL A 56 -9.204 -12.631 -2.982 1.00 0.00 C ATOM 0 H VAL A 56 -8.648 -14.788 -4.148 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.668 -13.125 -6.361 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.654 -11.296 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.782 -12.020 -3.581 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -11.719 -12.368 -5.325 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -11.479 -13.680 -4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.713 -12.028 -2.230 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.323 -13.687 -2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.144 -12.379 -2.992 1.00 0.00 H new ATOM 831 N ILE A 57 -7.617 -11.350 -5.958 1.00 0.00 N ATOM 832 CA ILE A 57 -6.333 -10.701 -6.195 1.00 0.00 C ATOM 833 C ILE A 57 -5.846 -9.975 -4.945 1.00 0.00 C ATOM 834 O ILE A 57 -6.628 -9.681 -4.041 1.00 0.00 O ATOM 835 CB ILE A 57 -6.417 -9.696 -7.359 1.00 0.00 C ATOM 836 CG1 ILE A 57 -7.561 -8.708 -7.128 1.00 0.00 C ATOM 837 CG2 ILE A 57 -6.602 -10.430 -8.679 1.00 0.00 C ATOM 838 CD1 ILE A 57 -7.275 -7.318 -7.652 1.00 0.00 C ATOM 0 H ILE A 57 -8.424 -10.733 -6.044 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.624 -11.487 -6.455 1.00 0.00 H new ATOM 0 HB ILE A 57 -5.483 -9.136 -7.404 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -8.462 -9.090 -7.608 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.769 -8.649 -6.060 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -6.660 -9.707 -9.492 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.756 -11.097 -8.846 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.523 -11.013 -8.645 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -8.130 -6.671 -7.453 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -6.392 -6.916 -7.154 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.097 -7.364 -8.726 1.00 0.00 H new ATOM 850 N ARG A 58 -4.550 -9.686 -4.903 1.00 0.00 N ATOM 851 CA ARG A 58 -3.958 -8.993 -3.765 1.00 0.00 C ATOM 852 C ARG A 58 -4.738 -7.724 -3.436 1.00 0.00 C ATOM 853 O ARG A 58 -5.039 -7.451 -2.275 1.00 0.00 O ATOM 854 CB ARG A 58 -2.497 -8.646 -4.055 1.00 0.00 C ATOM 855 CG ARG A 58 -1.633 -9.858 -4.367 1.00 0.00 C ATOM 856 CD ARG A 58 -0.219 -9.685 -3.837 1.00 0.00 C ATOM 857 NE ARG A 58 0.489 -10.959 -3.741 1.00 0.00 N ATOM 858 CZ ARG A 58 1.606 -11.129 -3.042 1.00 0.00 C ATOM 859 NH1 ARG A 58 2.139 -10.111 -2.380 1.00 0.00 N ATOM 860 NH2 ARG A 58 2.192 -12.319 -3.003 1.00 0.00 N ATOM 0 H ARG A 58 -3.889 -9.921 -5.644 1.00 0.00 H new ATOM 0 HA ARG A 58 -4.001 -9.659 -2.903 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.457 -7.955 -4.897 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -2.079 -8.124 -3.194 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.081 -10.749 -3.927 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.602 -10.016 -5.445 1.00 0.00 H new ATOM 0 HD2 ARG A 58 0.334 -9.011 -4.492 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -0.255 -9.215 -2.854 1.00 0.00 H new ATOM 0 HE ARG A 58 0.105 -11.762 -4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 58 1.691 -9.195 -2.407 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.997 -10.244 -1.844 1.00 0.00 H new ATOM 0 HH21 ARG A 58 1.785 -13.105 -3.510 1.00 0.00 H new ATOM 0 HH22 ARG A 58 3.050 -12.448 -2.466 1.00 0.00 H new ATOM 874 N GLY A 59 -5.062 -6.950 -4.468 1.00 0.00 N ATOM 875 CA GLY A 59 -5.802 -5.718 -4.268 1.00 0.00 C ATOM 876 C GLY A 59 -7.037 -5.917 -3.410 1.00 0.00 C ATOM 877 O GLY A 59 -7.162 -5.317 -2.343 1.00 0.00 O ATOM 0 H GLY A 59 -4.825 -7.155 -5.439 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.152 -4.979 -3.799 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.097 -5.314 -5.236 1.00 0.00 H new ATOM 881 N TRP A 60 -7.950 -6.759 -3.878 1.00 0.00 N ATOM 882 CA TRP A 60 -9.182 -7.034 -3.147 1.00 0.00 C ATOM 883 C TRP A 60 -8.879 -7.529 -1.737 1.00 0.00 C ATOM 884 O TRP A 60 -9.517 -7.108 -0.771 1.00 0.00 O ATOM 885 CB TRP A 60 -10.024 -8.069 -3.894 1.00 0.00 C ATOM 886 CG TRP A 60 -10.778 -7.496 -5.056 1.00 0.00 C ATOM 887 CD1 TRP A 60 -10.883 -6.176 -5.393 1.00 0.00 C ATOM 888 CD2 TRP A 60 -11.532 -8.223 -6.031 1.00 0.00 C ATOM 889 NE1 TRP A 60 -11.658 -6.040 -6.519 1.00 0.00 N ATOM 890 CE2 TRP A 60 -12.068 -7.281 -6.931 1.00 0.00 C ATOM 891 CE3 TRP A 60 -11.806 -9.578 -6.233 1.00 0.00 C ATOM 892 CZ2 TRP A 60 -12.861 -7.652 -8.013 1.00 0.00 C ATOM 893 CZ3 TRP A 60 -12.594 -9.946 -7.307 1.00 0.00 C ATOM 894 CH2 TRP A 60 -13.113 -8.986 -8.187 1.00 0.00 C ATOM 0 H TRP A 60 -7.861 -7.263 -4.760 1.00 0.00 H new ATOM 0 HA TRP A 60 -9.746 -6.104 -3.073 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -9.373 -8.867 -4.251 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -10.731 -8.521 -3.199 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -10.424 -5.360 -4.854 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -11.891 -5.158 -6.975 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -11.409 -10.325 -5.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -13.263 -6.914 -8.691 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -12.814 -10.991 -7.471 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -13.724 -9.305 -9.019 1.00 0.00 H new ATOM 905 N ASP A 61 -7.904 -8.423 -1.625 1.00 0.00 N ATOM 906 CA ASP A 61 -7.516 -8.975 -0.332 1.00 0.00 C ATOM 907 C ASP A 61 -7.284 -7.862 0.685 1.00 0.00 C ATOM 908 O ASP A 61 -7.994 -7.765 1.686 1.00 0.00 O ATOM 909 CB ASP A 61 -6.252 -9.824 -0.474 1.00 0.00 C ATOM 910 CG ASP A 61 -6.220 -10.982 0.504 1.00 0.00 C ATOM 911 OD1 ASP A 61 -7.033 -10.981 1.452 1.00 0.00 O ATOM 912 OD2 ASP A 61 -5.381 -11.890 0.322 1.00 0.00 O ATOM 0 H ASP A 61 -7.367 -8.782 -2.414 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.330 -9.606 0.025 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.189 -10.210 -1.492 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.376 -9.195 -0.317 1.00 0.00 H new ATOM 917 N GLU A 62 -6.285 -7.025 0.423 1.00 0.00 N ATOM 918 CA GLU A 62 -5.958 -5.921 1.317 1.00 0.00 C ATOM 919 C GLU A 62 -7.110 -4.922 1.390 1.00 0.00 C ATOM 920 O GLU A 62 -7.511 -4.498 2.473 1.00 0.00 O ATOM 921 CB GLU A 62 -4.685 -5.215 0.848 1.00 0.00 C ATOM 922 CG GLU A 62 -3.456 -6.108 0.856 1.00 0.00 C ATOM 923 CD GLU A 62 -2.883 -6.301 2.246 1.00 0.00 C ATOM 924 OE1 GLU A 62 -3.343 -5.608 3.178 1.00 0.00 O ATOM 925 OE2 GLU A 62 -1.976 -7.144 2.403 1.00 0.00 O ATOM 0 H GLU A 62 -5.688 -7.091 -0.401 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.791 -6.331 2.313 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.841 -4.835 -0.162 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.501 -4.352 1.488 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.715 -7.080 0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.693 -5.675 0.210 1.00 0.00 H new ATOM 932 N GLY A 63 -7.636 -4.549 0.227 1.00 0.00 N ATOM 933 CA GLY A 63 -8.735 -3.602 0.180 1.00 0.00 C ATOM 934 C GLY A 63 -9.871 -3.986 1.107 1.00 0.00 C ATOM 935 O GLY A 63 -10.179 -3.265 2.056 1.00 0.00 O ATOM 0 H GLY A 63 -7.321 -4.886 -0.683 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.369 -2.611 0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -9.110 -3.536 -0.841 1.00 0.00 H new ATOM 939 N VAL A 64 -10.498 -5.126 0.831 1.00 0.00 N ATOM 940 CA VAL A 64 -11.608 -5.605 1.647 1.00 0.00 C ATOM 941 C VAL A 64 -11.167 -5.849 3.085 1.00 0.00 C ATOM 942 O VAL A 64 -11.943 -5.668 4.023 1.00 0.00 O ATOM 943 CB VAL A 64 -12.204 -6.905 1.076 1.00 0.00 C ATOM 944 CG1 VAL A 64 -11.257 -8.073 1.306 1.00 0.00 C ATOM 945 CG2 VAL A 64 -13.566 -7.183 1.693 1.00 0.00 C ATOM 0 H VAL A 64 -10.256 -5.735 0.049 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.371 -4.827 1.632 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.336 -6.782 0.001 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.695 -8.983 0.896 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.306 -7.873 0.812 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.090 -8.201 2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.972 -8.105 1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -13.462 -7.286 2.773 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -14.242 -6.357 1.471 1.00 0.00 H new ATOM 955 N ALA A 65 -9.915 -6.263 3.252 1.00 0.00 N ATOM 956 CA ALA A 65 -9.369 -6.530 4.577 1.00 0.00 C ATOM 957 C ALA A 65 -9.450 -5.292 5.464 1.00 0.00 C ATOM 958 O ALA A 65 -9.734 -5.391 6.658 1.00 0.00 O ATOM 959 CB ALA A 65 -7.929 -7.010 4.468 1.00 0.00 C ATOM 0 H ALA A 65 -9.260 -6.421 2.486 1.00 0.00 H new ATOM 0 HA ALA A 65 -9.968 -7.315 5.038 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.534 -7.205 5.465 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -7.894 -7.926 3.878 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.326 -6.243 3.983 1.00 0.00 H new ATOM 965 N GLN A 66 -9.198 -4.129 4.874 1.00 0.00 N ATOM 966 CA GLN A 66 -9.241 -2.872 5.612 1.00 0.00 C ATOM 967 C GLN A 66 -10.581 -2.172 5.417 1.00 0.00 C ATOM 968 O GLN A 66 -10.687 -0.957 5.581 1.00 0.00 O ATOM 969 CB GLN A 66 -8.102 -1.954 5.165 1.00 0.00 C ATOM 970 CG GLN A 66 -8.244 -1.462 3.734 1.00 0.00 C ATOM 971 CD GLN A 66 -7.183 -0.447 3.358 1.00 0.00 C ATOM 972 OE1 GLN A 66 -7.253 0.717 3.754 1.00 0.00 O ATOM 973 NE2 GLN A 66 -6.191 -0.882 2.589 1.00 0.00 N ATOM 0 H GLN A 66 -8.962 -4.030 3.887 1.00 0.00 H new ATOM 0 HA GLN A 66 -9.121 -3.098 6.672 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -8.056 -1.094 5.833 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -7.156 -2.487 5.265 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -8.185 -2.312 3.054 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -9.230 -1.017 3.603 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.172 -1.855 2.283 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -5.449 -0.243 2.304 1.00 0.00 H new ATOM 982 N MET A 67 -11.602 -2.946 5.064 1.00 0.00 N ATOM 983 CA MET A 67 -12.937 -2.399 4.847 1.00 0.00 C ATOM 984 C MET A 67 -13.886 -2.822 5.964 1.00 0.00 C ATOM 985 O MET A 67 -13.682 -3.851 6.608 1.00 0.00 O ATOM 986 CB MET A 67 -13.485 -2.858 3.495 1.00 0.00 C ATOM 987 CG MET A 67 -12.905 -2.098 2.314 1.00 0.00 C ATOM 988 SD MET A 67 -13.842 -0.610 1.917 1.00 0.00 S ATOM 989 CE MET A 67 -15.433 -1.315 1.492 1.00 0.00 C ATOM 0 H MET A 67 -11.531 -3.954 4.922 1.00 0.00 H new ATOM 0 HA MET A 67 -12.862 -1.312 4.851 1.00 0.00 H new ATOM 0 HB2 MET A 67 -13.277 -3.921 3.370 1.00 0.00 H new ATOM 0 HB3 MET A 67 -14.569 -2.743 3.494 1.00 0.00 H new ATOM 0 HG2 MET A 67 -11.873 -1.825 2.534 1.00 0.00 H new ATOM 0 HG3 MET A 67 -12.882 -2.752 1.442 1.00 0.00 H new ATOM 0 HE1 MET A 67 -15.950 -0.654 0.797 1.00 0.00 H new ATOM 0 HE2 MET A 67 -15.286 -2.289 1.025 1.00 0.00 H new ATOM 0 HE3 MET A 67 -16.032 -1.432 2.395 1.00 0.00 H new ATOM 999 N SER A 68 -14.922 -2.021 6.189 1.00 0.00 N ATOM 1000 CA SER A 68 -15.900 -2.310 7.231 1.00 0.00 C ATOM 1001 C SER A 68 -17.294 -2.483 6.635 1.00 0.00 C ATOM 1002 O SER A 68 -17.628 -1.872 5.620 1.00 0.00 O ATOM 1003 CB SER A 68 -15.914 -1.190 8.272 1.00 0.00 C ATOM 1004 OG SER A 68 -15.938 0.084 7.651 1.00 0.00 O ATOM 0 H SER A 68 -15.106 -1.166 5.663 1.00 0.00 H new ATOM 0 HA SER A 68 -15.612 -3.243 7.716 1.00 0.00 H new ATOM 0 HB2 SER A 68 -16.786 -1.300 8.917 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.033 -1.271 8.909 1.00 0.00 H new ATOM 0 HG SER A 68 -15.074 0.254 7.220 1.00 0.00 H new ATOM 1010 N VAL A 69 -18.104 -3.321 7.274 1.00 0.00 N ATOM 1011 CA VAL A 69 -19.463 -3.575 6.809 1.00 0.00 C ATOM 1012 C VAL A 69 -20.239 -2.273 6.644 1.00 0.00 C ATOM 1013 O VAL A 69 -20.293 -1.450 7.556 1.00 0.00 O ATOM 1014 CB VAL A 69 -20.226 -4.495 7.780 1.00 0.00 C ATOM 1015 CG1 VAL A 69 -21.668 -4.670 7.329 1.00 0.00 C ATOM 1016 CG2 VAL A 69 -19.528 -5.842 7.897 1.00 0.00 C ATOM 0 H VAL A 69 -17.843 -3.836 8.115 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.379 -4.070 5.842 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.233 -4.028 8.765 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.191 -5.323 8.028 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.161 -3.698 7.302 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -21.687 -5.114 6.334 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.081 -6.479 8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.488 -6.317 6.917 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.515 -5.695 8.271 1.00 0.00 H new ATOM 1026 N GLY A 70 -20.841 -2.094 5.472 1.00 0.00 N ATOM 1027 CA GLY A 70 -21.608 -0.891 5.208 1.00 0.00 C ATOM 1028 C GLY A 70 -20.730 0.279 4.807 1.00 0.00 C ATOM 1029 O GLY A 70 -21.205 1.409 4.698 1.00 0.00 O ATOM 0 H GLY A 70 -20.811 -2.761 4.701 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -22.328 -1.090 4.414 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -22.179 -0.625 6.098 1.00 0.00 H new ATOM 1033 N GLN A 71 -19.448 0.008 4.590 1.00 0.00 N ATOM 1034 CA GLN A 71 -18.502 1.048 4.201 1.00 0.00 C ATOM 1035 C GLN A 71 -18.189 0.970 2.711 1.00 0.00 C ATOM 1036 O GLN A 71 -17.980 -0.115 2.167 1.00 0.00 O ATOM 1037 CB GLN A 71 -17.212 0.922 5.013 1.00 0.00 C ATOM 1038 CG GLN A 71 -16.406 2.210 5.077 1.00 0.00 C ATOM 1039 CD GLN A 71 -14.920 1.978 4.884 1.00 0.00 C ATOM 1040 OE1 GLN A 71 -14.200 1.667 5.834 1.00 0.00 O ATOM 1041 NE2 GLN A 71 -14.453 2.129 3.651 1.00 0.00 N ATOM 0 H GLN A 71 -19.040 -0.923 4.677 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.960 2.016 4.407 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.460 0.607 6.027 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -16.593 0.137 4.578 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -16.765 2.897 4.311 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.573 2.691 6.041 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -15.086 2.387 2.894 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.461 1.987 3.460 1.00 0.00 H new ATOM 1050 N ARG A 72 -18.159 2.126 2.056 1.00 0.00 N ATOM 1051 CA ARG A 72 -17.872 2.188 0.628 1.00 0.00 C ATOM 1052 C ARG A 72 -16.645 3.053 0.357 1.00 0.00 C ATOM 1053 O ARG A 72 -16.504 4.140 0.914 1.00 0.00 O ATOM 1054 CB ARG A 72 -19.078 2.743 -0.132 1.00 0.00 C ATOM 1055 CG ARG A 72 -18.788 3.056 -1.591 1.00 0.00 C ATOM 1056 CD ARG A 72 -20.062 3.077 -2.420 1.00 0.00 C ATOM 1057 NE ARG A 72 -20.854 4.279 -2.177 1.00 0.00 N ATOM 1058 CZ ARG A 72 -21.780 4.732 -3.015 1.00 0.00 C ATOM 1059 NH1 ARG A 72 -22.030 4.084 -4.144 1.00 0.00 N ATOM 1060 NH2 ARG A 72 -22.460 5.834 -2.723 1.00 0.00 N ATOM 0 H ARG A 72 -18.330 3.032 2.492 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.666 1.176 0.280 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -19.893 2.021 -0.079 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -19.423 3.650 0.364 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -18.289 4.022 -1.665 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -18.102 2.311 -1.995 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -19.807 3.019 -3.478 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -20.660 2.196 -2.188 1.00 0.00 H new ATOM 0 HE ARG A 72 -20.687 4.800 -1.316 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -21.511 3.236 -4.371 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -22.741 4.434 -4.786 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -22.272 6.334 -1.854 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -23.171 6.181 -3.367 1.00 0.00 H new ATOM 1074 N ALA A 73 -15.759 2.560 -0.503 1.00 0.00 N ATOM 1075 CA ALA A 73 -14.544 3.288 -0.849 1.00 0.00 C ATOM 1076 C ALA A 73 -13.984 2.816 -2.186 1.00 0.00 C ATOM 1077 O ALA A 73 -14.396 1.783 -2.715 1.00 0.00 O ATOM 1078 CB ALA A 73 -13.502 3.128 0.248 1.00 0.00 C ATOM 0 H ALA A 73 -15.860 1.660 -0.972 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.797 4.344 -0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.600 3.677 -0.024 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.897 3.520 1.185 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.261 2.072 0.370 1.00 0.00 H new ATOM 1084 N LYS A 74 -13.042 3.579 -2.730 1.00 0.00 N ATOM 1085 CA LYS A 74 -12.424 3.240 -4.006 1.00 0.00 C ATOM 1086 C LYS A 74 -11.137 2.448 -3.794 1.00 0.00 C ATOM 1087 O LYS A 74 -10.202 2.925 -3.150 1.00 0.00 O ATOM 1088 CB LYS A 74 -12.127 4.510 -4.807 1.00 0.00 C ATOM 1089 CG LYS A 74 -13.354 5.111 -5.470 1.00 0.00 C ATOM 1090 CD LYS A 74 -12.987 5.882 -6.727 1.00 0.00 C ATOM 1091 CE LYS A 74 -14.151 6.726 -7.223 1.00 0.00 C ATOM 1092 NZ LYS A 74 -14.029 7.042 -8.673 1.00 0.00 N ATOM 0 H LYS A 74 -12.690 4.437 -2.306 1.00 0.00 H new ATOM 0 HA LYS A 74 -13.124 2.620 -4.566 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.682 5.252 -4.144 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.386 4.282 -5.573 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.058 4.318 -5.721 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -13.859 5.775 -4.769 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.131 6.525 -6.524 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.684 5.184 -7.507 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -15.086 6.195 -7.044 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -14.197 7.653 -6.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -14.841 7.618 -8.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.149 7.571 -8.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.011 6.158 -9.221 1.00 0.00 H new ATOM 1106 N LEU A 75 -11.096 1.238 -4.340 1.00 0.00 N ATOM 1107 CA LEU A 75 -9.923 0.380 -4.212 1.00 0.00 C ATOM 1108 C LEU A 75 -8.964 0.592 -5.379 1.00 0.00 C ATOM 1109 O LEU A 75 -9.121 -0.007 -6.443 1.00 0.00 O ATOM 1110 CB LEU A 75 -10.346 -1.089 -4.145 1.00 0.00 C ATOM 1111 CG LEU A 75 -9.538 -1.977 -3.197 1.00 0.00 C ATOM 1112 CD1 LEU A 75 -10.084 -3.396 -3.201 1.00 0.00 C ATOM 1113 CD2 LEU A 75 -8.066 -1.969 -3.584 1.00 0.00 C ATOM 0 H LEU A 75 -11.861 0.829 -4.876 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.408 0.646 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.393 -1.132 -3.846 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.283 -1.511 -5.148 1.00 0.00 H new ATOM 0 HG LEU A 75 -9.630 -1.577 -2.187 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.497 -4.014 -2.521 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -11.124 -3.386 -2.876 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -10.022 -3.807 -4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.506 -2.606 -2.899 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.955 -2.345 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.681 -0.951 -3.529 1.00 0.00 H new ATOM 1125 N VAL A 76 -7.967 1.447 -5.171 1.00 0.00 N ATOM 1126 CA VAL A 76 -6.980 1.735 -6.204 1.00 0.00 C ATOM 1127 C VAL A 76 -5.676 0.990 -5.941 1.00 0.00 C ATOM 1128 O VAL A 76 -4.897 1.370 -5.066 1.00 0.00 O ATOM 1129 CB VAL A 76 -6.686 3.244 -6.294 1.00 0.00 C ATOM 1130 CG1 VAL A 76 -6.361 3.808 -4.920 1.00 0.00 C ATOM 1131 CG2 VAL A 76 -5.550 3.509 -7.270 1.00 0.00 C ATOM 0 H VAL A 76 -7.822 1.952 -4.297 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.404 1.398 -7.150 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.578 3.748 -6.665 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -6.156 4.875 -5.004 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.209 3.653 -4.253 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.484 3.301 -4.517 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.356 4.580 -7.321 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.651 2.993 -6.931 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.827 3.143 -8.259 1.00 0.00 H new ATOM 1141 N CYS A 77 -5.444 -0.072 -6.704 1.00 0.00 N ATOM 1142 CA CYS A 77 -4.233 -0.872 -6.554 1.00 0.00 C ATOM 1143 C CYS A 77 -3.508 -1.016 -7.888 1.00 0.00 C ATOM 1144 O CYS A 77 -4.090 -0.795 -8.950 1.00 0.00 O ATOM 1145 CB CYS A 77 -4.576 -2.254 -5.995 1.00 0.00 C ATOM 1146 SG CYS A 77 -5.621 -3.252 -7.082 1.00 0.00 S ATOM 0 H CYS A 77 -6.078 -0.399 -7.433 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.572 -0.359 -5.855 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.650 -2.796 -5.801 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -5.080 -2.131 -5.036 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.215 -4.487 -7.060 1.00 0.00 H new ATOM 1152 N SER A 78 -2.232 -1.385 -7.825 1.00 0.00 N ATOM 1153 CA SER A 78 -1.425 -1.553 -9.027 1.00 0.00 C ATOM 1154 C SER A 78 -1.852 -2.798 -9.799 1.00 0.00 C ATOM 1155 O SER A 78 -2.564 -3.662 -9.289 1.00 0.00 O ATOM 1156 CB SER A 78 0.058 -1.649 -8.662 1.00 0.00 C ATOM 1157 OG SER A 78 0.764 -0.496 -9.088 1.00 0.00 O ATOM 0 H SER A 78 -1.736 -1.573 -6.954 1.00 0.00 H new ATOM 0 HA SER A 78 -1.580 -0.682 -9.663 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.163 -1.766 -7.583 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.492 -2.536 -9.123 1.00 0.00 H new ATOM 0 HG SER A 78 1.709 -0.581 -8.841 1.00 0.00 H new ATOM 1163 N PRO A 79 -1.406 -2.892 -11.061 1.00 0.00 N ATOM 1164 CA PRO A 79 -1.728 -4.027 -11.931 1.00 0.00 C ATOM 1165 C PRO A 79 -1.038 -5.312 -11.487 1.00 0.00 C ATOM 1166 O PRO A 79 -1.561 -6.409 -11.687 1.00 0.00 O ATOM 1167 CB PRO A 79 -1.204 -3.584 -13.300 1.00 0.00 C ATOM 1168 CG PRO A 79 -0.126 -2.603 -12.993 1.00 0.00 C ATOM 1169 CD PRO A 79 -0.552 -1.899 -11.734 1.00 0.00 C ATOM 0 HA PRO A 79 -2.793 -4.259 -11.921 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -0.819 -4.430 -13.869 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -1.994 -3.130 -13.898 1.00 0.00 H new ATOM 0 HG2 PRO A 79 0.831 -3.106 -12.854 1.00 0.00 H new ATOM 0 HG3 PRO A 79 0.002 -1.895 -13.812 1.00 0.00 H new ATOM 0 HD2 PRO A 79 0.304 -1.622 -11.119 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.098 -0.981 -11.952 1.00 0.00 H new ATOM 1177 N ASP A 80 0.136 -5.170 -10.884 1.00 0.00 N ATOM 1178 CA ASP A 80 0.897 -6.320 -10.410 1.00 0.00 C ATOM 1179 C ASP A 80 0.137 -7.060 -9.313 1.00 0.00 C ATOM 1180 O ASP A 80 0.349 -8.253 -9.093 1.00 0.00 O ATOM 1181 CB ASP A 80 2.264 -5.875 -9.888 1.00 0.00 C ATOM 1182 CG ASP A 80 3.021 -5.031 -10.895 1.00 0.00 C ATOM 1183 OD1 ASP A 80 2.826 -5.240 -12.111 1.00 0.00 O ATOM 1184 OD2 ASP A 80 3.808 -4.161 -10.467 1.00 0.00 O ATOM 0 H ASP A 80 0.582 -4.269 -10.711 1.00 0.00 H new ATOM 0 HA ASP A 80 1.041 -7.000 -11.250 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.131 -5.306 -8.968 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.857 -6.754 -9.636 1.00 0.00 H new ATOM 1189 N TYR A 81 -0.748 -6.344 -8.628 1.00 0.00 N ATOM 1190 CA TYR A 81 -1.537 -6.932 -7.552 1.00 0.00 C ATOM 1191 C TYR A 81 -2.979 -7.159 -7.995 1.00 0.00 C ATOM 1192 O TYR A 81 -3.860 -7.410 -7.174 1.00 0.00 O ATOM 1193 CB TYR A 81 -1.508 -6.028 -6.318 1.00 0.00 C ATOM 1194 CG TYR A 81 -0.350 -6.312 -5.387 1.00 0.00 C ATOM 1195 CD1 TYR A 81 0.879 -6.729 -5.883 1.00 0.00 C ATOM 1196 CD2 TYR A 81 -0.485 -6.161 -4.013 1.00 0.00 C ATOM 1197 CE1 TYR A 81 1.939 -6.990 -5.036 1.00 0.00 C ATOM 1198 CE2 TYR A 81 0.570 -6.418 -3.159 1.00 0.00 C ATOM 1199 CZ TYR A 81 1.780 -6.833 -3.675 1.00 0.00 C ATOM 1200 OH TYR A 81 2.834 -7.090 -2.829 1.00 0.00 O ATOM 0 H TYR A 81 -0.937 -5.356 -8.799 1.00 0.00 H new ATOM 0 HA TYR A 81 -1.097 -7.897 -7.299 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.457 -4.988 -6.641 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.442 -6.146 -5.769 1.00 0.00 H new ATOM 0 HD1 TYR A 81 1.008 -6.851 -6.948 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -1.431 -5.837 -3.605 1.00 0.00 H new ATOM 0 HE1 TYR A 81 2.887 -7.315 -5.438 1.00 0.00 H new ATOM 0 HE2 TYR A 81 0.448 -6.295 -2.093 1.00 0.00 H new ATOM 0 HH TYR A 81 2.557 -6.930 -1.903 1.00 0.00 H new ATOM 1210 N ALA A 82 -3.211 -7.069 -9.301 1.00 0.00 N ATOM 1211 CA ALA A 82 -4.544 -7.267 -9.855 1.00 0.00 C ATOM 1212 C ALA A 82 -4.477 -7.956 -11.214 1.00 0.00 C ATOM 1213 O ALA A 82 -3.449 -8.526 -11.582 1.00 0.00 O ATOM 1214 CB ALA A 82 -5.270 -5.935 -9.972 1.00 0.00 C ATOM 0 H ALA A 82 -2.493 -6.860 -9.994 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.100 -7.913 -9.176 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.265 -6.098 -10.387 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.359 -5.481 -8.985 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.707 -5.270 -10.628 1.00 0.00 H new ATOM 1220 N TYR A 83 -5.578 -7.901 -11.955 1.00 0.00 N ATOM 1221 CA TYR A 83 -5.644 -8.523 -13.272 1.00 0.00 C ATOM 1222 C TYR A 83 -4.968 -7.648 -14.323 1.00 0.00 C ATOM 1223 O TYR A 83 -4.914 -8.000 -15.500 1.00 0.00 O ATOM 1224 CB TYR A 83 -7.100 -8.779 -13.666 1.00 0.00 C ATOM 1225 CG TYR A 83 -7.991 -9.129 -12.495 1.00 0.00 C ATOM 1226 CD1 TYR A 83 -8.039 -10.425 -11.997 1.00 0.00 C ATOM 1227 CD2 TYR A 83 -8.786 -8.164 -11.888 1.00 0.00 C ATOM 1228 CE1 TYR A 83 -8.852 -10.750 -10.928 1.00 0.00 C ATOM 1229 CE2 TYR A 83 -9.601 -8.480 -10.818 1.00 0.00 C ATOM 1230 CZ TYR A 83 -9.630 -9.774 -10.342 1.00 0.00 C ATOM 1231 OH TYR A 83 -10.442 -10.092 -9.277 1.00 0.00 O ATOM 0 H TYR A 83 -6.437 -7.432 -11.666 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.115 -9.475 -13.223 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -7.495 -7.892 -14.160 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.134 -9.591 -14.393 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.430 -11.192 -12.453 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.766 -7.150 -12.259 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -8.878 -11.763 -10.554 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.212 -7.718 -10.357 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.202 -9.474 -9.249 1.00 0.00 H new ATOM 1241 N GLY A 84 -4.452 -6.502 -13.887 1.00 0.00 N ATOM 1242 CA GLY A 84 -3.786 -5.593 -14.800 1.00 0.00 C ATOM 1243 C GLY A 84 -2.751 -6.291 -15.661 1.00 0.00 C ATOM 1244 O GLY A 84 -2.496 -5.880 -16.793 1.00 0.00 O ATOM 0 H GLY A 84 -4.484 -6.188 -12.917 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -4.528 -5.119 -15.442 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -3.304 -4.799 -14.230 1.00 0.00 H new ATOM 1248 N SER A 85 -2.154 -7.350 -15.123 1.00 0.00 N ATOM 1249 CA SER A 85 -1.137 -8.103 -15.848 1.00 0.00 C ATOM 1250 C SER A 85 -1.627 -8.473 -17.245 1.00 0.00 C ATOM 1251 O SER A 85 -1.158 -7.927 -18.243 1.00 0.00 O ATOM 1252 CB SER A 85 -0.762 -9.369 -15.075 1.00 0.00 C ATOM 1253 OG SER A 85 -0.115 -10.308 -15.916 1.00 0.00 O ATOM 0 H SER A 85 -2.357 -7.706 -14.189 1.00 0.00 H new ATOM 0 HA SER A 85 -0.254 -7.471 -15.947 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.107 -9.110 -14.243 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.659 -9.817 -14.647 1.00 0.00 H new ATOM 0 HG SER A 85 0.116 -11.107 -15.398 1.00 0.00 H new ATOM 1259 N ARG A 86 -2.573 -9.404 -17.305 1.00 0.00 N ATOM 1260 CA ARG A 86 -3.126 -9.849 -18.579 1.00 0.00 C ATOM 1261 C ARG A 86 -3.741 -8.679 -19.343 1.00 0.00 C ATOM 1262 O ARG A 86 -3.349 -8.388 -20.472 1.00 0.00 O ATOM 1263 CB ARG A 86 -4.181 -10.933 -18.350 1.00 0.00 C ATOM 1264 CG ARG A 86 -4.346 -11.881 -19.526 1.00 0.00 C ATOM 1265 CD ARG A 86 -5.329 -11.333 -20.550 1.00 0.00 C ATOM 1266 NE ARG A 86 -5.508 -12.243 -21.678 1.00 0.00 N ATOM 1267 CZ ARG A 86 -6.206 -13.371 -21.608 1.00 0.00 C ATOM 1268 NH1 ARG A 86 -6.787 -13.726 -20.471 1.00 0.00 N ATOM 1269 NH2 ARG A 86 -6.323 -14.147 -22.678 1.00 0.00 N ATOM 0 H ARG A 86 -2.972 -9.865 -16.487 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.313 -10.263 -19.175 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.911 -11.509 -17.465 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.139 -10.457 -18.141 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.379 -12.046 -20.001 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.694 -12.850 -19.168 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.292 -11.157 -20.070 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.973 -10.369 -20.915 1.00 0.00 H new ATOM 0 HE ARG A 86 -5.073 -11.999 -22.568 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -6.699 -13.132 -19.646 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -7.322 -14.593 -20.421 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -5.877 -13.877 -23.555 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -6.859 -15.013 -22.624 1.00 0.00 H new ATOM 1283 N GLY A 87 -4.707 -8.013 -18.718 1.00 0.00 N ATOM 1284 CA GLY A 87 -5.360 -6.884 -19.354 1.00 0.00 C ATOM 1285 C GLY A 87 -6.174 -7.292 -20.566 1.00 0.00 C ATOM 1286 O GLY A 87 -5.804 -8.220 -21.287 1.00 0.00 O ATOM 0 H GLY A 87 -5.049 -8.235 -17.783 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.011 -6.391 -18.632 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.607 -6.155 -19.654 1.00 0.00 H new ATOM 1290 N HIS A 88 -7.286 -6.600 -20.791 1.00 0.00 N ATOM 1291 CA HIS A 88 -8.155 -6.896 -21.924 1.00 0.00 C ATOM 1292 C HIS A 88 -8.629 -5.611 -22.596 1.00 0.00 C ATOM 1293 O HIS A 88 -8.656 -4.539 -21.991 1.00 0.00 O ATOM 1294 CB HIS A 88 -9.358 -7.722 -21.469 1.00 0.00 C ATOM 1295 CG HIS A 88 -9.154 -9.200 -21.597 1.00 0.00 C ATOM 1296 ND1 HIS A 88 -8.685 -9.798 -22.747 1.00 0.00 N ATOM 1297 CD2 HIS A 88 -9.355 -10.202 -20.709 1.00 0.00 C ATOM 1298 CE1 HIS A 88 -8.609 -11.104 -22.563 1.00 0.00 C ATOM 1299 NE2 HIS A 88 -9.010 -11.375 -21.334 1.00 0.00 N ATOM 0 H HIS A 88 -7.607 -5.830 -20.204 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.581 -7.473 -22.649 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.580 -7.483 -20.429 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.230 -7.432 -22.055 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -9.719 -10.098 -19.697 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -8.276 -11.827 -23.293 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -9.056 -12.305 -20.917 1.00 0.00 H new ATOM 1307 N PRO A 89 -9.013 -5.719 -23.877 1.00 0.00 N ATOM 1308 CA PRO A 89 -9.493 -4.575 -24.658 1.00 0.00 C ATOM 1309 C PRO A 89 -10.858 -4.084 -24.189 1.00 0.00 C ATOM 1310 O PRO A 89 -11.851 -4.805 -24.275 1.00 0.00 O ATOM 1311 CB PRO A 89 -9.585 -5.131 -26.081 1.00 0.00 C ATOM 1312 CG PRO A 89 -9.771 -6.599 -25.903 1.00 0.00 C ATOM 1313 CD PRO A 89 -9.008 -6.965 -24.661 1.00 0.00 C ATOM 0 HA PRO A 89 -8.833 -3.712 -24.564 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -10.420 -4.689 -26.625 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.682 -4.913 -26.651 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.827 -6.849 -25.800 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -9.396 -7.148 -26.767 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.488 -7.781 -24.121 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.994 -7.289 -24.894 1.00 0.00 H new ATOM 1321 N GLY A 90 -10.900 -2.852 -23.691 1.00 0.00 N ATOM 1322 CA GLY A 90 -12.149 -2.286 -23.216 1.00 0.00 C ATOM 1323 C GLY A 90 -12.553 -2.830 -21.860 1.00 0.00 C ATOM 1324 O GLY A 90 -13.669 -2.596 -21.397 1.00 0.00 O ATOM 0 H GLY A 90 -10.091 -2.236 -23.608 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -12.053 -1.202 -23.155 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -12.938 -2.496 -23.938 1.00 0.00 H new ATOM 1328 N VAL A 91 -11.643 -3.559 -21.222 1.00 0.00 N ATOM 1329 CA VAL A 91 -11.911 -4.139 -19.911 1.00 0.00 C ATOM 1330 C VAL A 91 -10.829 -3.753 -18.908 1.00 0.00 C ATOM 1331 O VAL A 91 -11.121 -3.204 -17.846 1.00 0.00 O ATOM 1332 CB VAL A 91 -12.003 -5.674 -19.984 1.00 0.00 C ATOM 1333 CG1 VAL A 91 -12.451 -6.247 -18.649 1.00 0.00 C ATOM 1334 CG2 VAL A 91 -12.946 -6.098 -21.100 1.00 0.00 C ATOM 0 H VAL A 91 -10.714 -3.762 -21.591 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.870 -3.741 -19.579 1.00 0.00 H new ATOM 0 HB VAL A 91 -11.012 -6.070 -20.207 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -12.510 -7.333 -18.721 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -11.733 -5.973 -17.876 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.432 -5.847 -18.392 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -12.999 -7.186 -21.138 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -13.940 -5.692 -20.910 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.575 -5.720 -22.053 1.00 0.00 H new ATOM 1344 N ILE A 92 -9.579 -4.043 -19.254 1.00 0.00 N ATOM 1345 CA ILE A 92 -8.453 -3.725 -18.384 1.00 0.00 C ATOM 1346 C ILE A 92 -7.225 -3.332 -19.197 1.00 0.00 C ATOM 1347 O ILE A 92 -6.863 -3.984 -20.177 1.00 0.00 O ATOM 1348 CB ILE A 92 -8.093 -4.913 -17.472 1.00 0.00 C ATOM 1349 CG1 ILE A 92 -9.296 -5.308 -16.613 1.00 0.00 C ATOM 1350 CG2 ILE A 92 -6.900 -4.564 -16.595 1.00 0.00 C ATOM 1351 CD1 ILE A 92 -9.020 -6.469 -15.684 1.00 0.00 C ATOM 0 H ILE A 92 -9.321 -4.497 -20.130 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.761 -2.883 -17.764 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.823 -5.764 -18.097 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.609 -4.447 -16.022 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.130 -5.566 -17.266 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.657 -5.413 -15.956 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.042 -4.327 -17.225 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.144 -3.701 -15.975 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.917 -6.694 -15.106 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.736 -7.344 -16.269 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.208 -6.207 -15.006 1.00 0.00 H new ATOM 1363 N PRO A 93 -6.565 -2.240 -18.782 1.00 0.00 N ATOM 1364 CA PRO A 93 -5.365 -1.736 -19.456 1.00 0.00 C ATOM 1365 C PRO A 93 -4.163 -2.655 -19.265 1.00 0.00 C ATOM 1366 O PRO A 93 -4.111 -3.463 -18.337 1.00 0.00 O ATOM 1367 CB PRO A 93 -5.119 -0.386 -18.780 1.00 0.00 C ATOM 1368 CG PRO A 93 -5.749 -0.514 -17.436 1.00 0.00 C ATOM 1369 CD PRO A 93 -6.940 -1.414 -17.622 1.00 0.00 C ATOM 0 HA PRO A 93 -5.502 -1.669 -20.535 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -4.053 -0.173 -18.699 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.565 0.429 -19.350 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.049 -0.937 -16.715 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.052 0.460 -17.052 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.125 -2.024 -16.738 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.849 -0.843 -17.812 1.00 0.00 H new ATOM 1377 N PRO A 94 -3.174 -2.531 -20.161 1.00 0.00 N ATOM 1378 CA PRO A 94 -1.954 -3.342 -20.111 1.00 0.00 C ATOM 1379 C PRO A 94 -1.062 -2.975 -18.930 1.00 0.00 C ATOM 1380 O PRO A 94 -0.348 -1.975 -18.966 1.00 0.00 O ATOM 1381 CB PRO A 94 -1.254 -3.013 -21.432 1.00 0.00 C ATOM 1382 CG PRO A 94 -1.754 -1.658 -21.798 1.00 0.00 C ATOM 1383 CD PRO A 94 -3.169 -1.589 -21.293 1.00 0.00 C ATOM 0 HA PRO A 94 -2.175 -4.402 -19.982 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -0.170 -3.017 -21.318 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -1.496 -3.746 -22.202 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -1.140 -0.880 -21.345 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -1.717 -1.506 -22.877 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.434 -0.580 -20.977 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.885 -1.881 -22.062 1.00 0.00 H new ATOM 1391 N ASN A 95 -1.109 -3.793 -17.883 1.00 0.00 N ATOM 1392 CA ASN A 95 -0.304 -3.554 -16.690 1.00 0.00 C ATOM 1393 C ASN A 95 -0.421 -2.101 -16.238 1.00 0.00 C ATOM 1394 O ASN A 95 0.578 -1.388 -16.142 1.00 0.00 O ATOM 1395 CB ASN A 95 1.161 -3.900 -16.960 1.00 0.00 C ATOM 1396 CG ASN A 95 1.313 -5.106 -17.866 1.00 0.00 C ATOM 1397 OD1 ASN A 95 1.263 -6.249 -17.410 1.00 0.00 O ATOM 1398 ND2 ASN A 95 1.500 -4.857 -19.156 1.00 0.00 N ATOM 0 H ASN A 95 -1.695 -4.626 -17.836 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.680 -4.196 -15.893 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.656 -3.042 -17.415 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.666 -4.094 -16.014 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.609 -5.629 -19.814 1.00 0.00 H new ATOM 0 HD22 ASN A 95 1.535 -3.894 -19.490 1.00 0.00 H new ATOM 1405 N ALA A 96 -1.647 -1.670 -15.960 1.00 0.00 N ATOM 1406 CA ALA A 96 -1.894 -0.304 -15.516 1.00 0.00 C ATOM 1407 C ALA A 96 -2.719 -0.285 -14.234 1.00 0.00 C ATOM 1408 O ALA A 96 -3.517 -1.189 -13.982 1.00 0.00 O ATOM 1409 CB ALA A 96 -2.595 0.488 -16.609 1.00 0.00 C ATOM 0 H ALA A 96 -2.485 -2.247 -16.034 1.00 0.00 H new ATOM 0 HA ALA A 96 -0.932 0.163 -15.305 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.773 1.506 -16.263 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.968 0.512 -17.500 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.547 0.014 -16.848 1.00 0.00 H new ATOM 1415 N THR A 97 -2.522 0.751 -13.424 1.00 0.00 N ATOM 1416 CA THR A 97 -3.247 0.887 -12.166 1.00 0.00 C ATOM 1417 C THR A 97 -4.753 0.828 -12.391 1.00 0.00 C ATOM 1418 O THR A 97 -5.264 1.343 -13.386 1.00 0.00 O ATOM 1419 CB THR A 97 -2.896 2.208 -11.456 1.00 0.00 C ATOM 1420 OG1 THR A 97 -1.563 2.607 -11.793 1.00 0.00 O ATOM 1421 CG2 THR A 97 -3.020 2.060 -9.947 1.00 0.00 C ATOM 0 H THR A 97 -1.866 1.508 -13.617 1.00 0.00 H new ATOM 0 HA THR A 97 -2.944 0.052 -11.534 1.00 0.00 H new ATOM 0 HB THR A 97 -3.598 2.972 -11.790 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.349 3.449 -11.339 1.00 0.00 H new ATOM 0 HG21 THR A 97 -2.767 3.005 -9.467 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.043 1.785 -9.691 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.338 1.283 -9.600 1.00 0.00 H new ATOM 1429 N LEU A 98 -5.461 0.198 -11.460 1.00 0.00 N ATOM 1430 CA LEU A 98 -6.911 0.072 -11.556 1.00 0.00 C ATOM 1431 C LEU A 98 -7.583 0.505 -10.257 1.00 0.00 C ATOM 1432 O LEU A 98 -7.039 0.311 -9.169 1.00 0.00 O ATOM 1433 CB LEU A 98 -7.297 -1.371 -11.886 1.00 0.00 C ATOM 1434 CG LEU A 98 -6.364 -2.113 -12.843 1.00 0.00 C ATOM 1435 CD1 LEU A 98 -6.704 -3.595 -12.878 1.00 0.00 C ATOM 1436 CD2 LEU A 98 -6.444 -1.513 -14.239 1.00 0.00 C ATOM 0 H LEU A 98 -5.054 -0.234 -10.630 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.255 0.726 -12.357 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.351 -1.934 -10.954 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.299 -1.369 -12.316 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.342 -2.004 -12.480 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.030 -4.107 -13.564 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.594 -4.017 -11.879 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.732 -3.725 -13.216 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.773 -2.054 -14.906 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.466 -1.591 -14.610 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -6.150 -0.464 -14.202 1.00 0.00 H new ATOM 1448 N THR A 99 -8.769 1.093 -10.377 1.00 0.00 N ATOM 1449 CA THR A 99 -9.516 1.552 -9.213 1.00 0.00 C ATOM 1450 C THR A 99 -10.916 0.950 -9.184 1.00 0.00 C ATOM 1451 O THR A 99 -11.809 1.395 -9.905 1.00 0.00 O ATOM 1452 CB THR A 99 -9.630 3.088 -9.189 1.00 0.00 C ATOM 1453 OG1 THR A 99 -8.326 3.677 -9.251 1.00 0.00 O ATOM 1454 CG2 THR A 99 -10.345 3.559 -7.932 1.00 0.00 C ATOM 0 H THR A 99 -9.233 1.263 -11.269 1.00 0.00 H new ATOM 0 HA THR A 99 -8.964 1.221 -8.333 1.00 0.00 H new ATOM 0 HB THR A 99 -10.211 3.400 -10.057 1.00 0.00 H new ATOM 0 HG1 THR A 99 -8.407 4.654 -9.237 1.00 0.00 H new ATOM 0 HG21 THR A 99 -10.413 4.647 -7.938 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.348 3.133 -7.902 1.00 0.00 H new ATOM 0 HG23 THR A 99 -9.787 3.235 -7.053 1.00 0.00 H new ATOM 1462 N PHE A 100 -11.101 -0.065 -8.346 1.00 0.00 N ATOM 1463 CA PHE A 100 -12.394 -0.729 -8.223 1.00 0.00 C ATOM 1464 C PHE A 100 -13.107 -0.298 -6.945 1.00 0.00 C ATOM 1465 O PHE A 100 -12.605 -0.507 -5.841 1.00 0.00 O ATOM 1466 CB PHE A 100 -12.213 -2.248 -8.234 1.00 0.00 C ATOM 1467 CG PHE A 100 -11.654 -2.777 -9.524 1.00 0.00 C ATOM 1468 CD1 PHE A 100 -10.285 -2.845 -9.724 1.00 0.00 C ATOM 1469 CD2 PHE A 100 -12.498 -3.205 -10.536 1.00 0.00 C ATOM 1470 CE1 PHE A 100 -9.767 -3.331 -10.910 1.00 0.00 C ATOM 1471 CE2 PHE A 100 -11.986 -3.692 -11.723 1.00 0.00 C ATOM 1472 CZ PHE A 100 -10.619 -3.754 -11.911 1.00 0.00 C ATOM 0 H PHE A 100 -10.372 -0.446 -7.742 1.00 0.00 H new ATOM 0 HA PHE A 100 -13.008 -0.437 -9.075 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.550 -2.533 -7.417 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -13.176 -2.722 -8.043 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -9.615 -2.515 -8.944 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -13.568 -3.157 -10.395 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.698 -3.380 -11.053 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -12.654 -4.024 -12.504 1.00 0.00 H new ATOM 0 HZ PHE A 100 -10.217 -4.133 -12.839 1.00 0.00 H new ATOM 1482 N ASP A 101 -14.281 0.303 -7.104 1.00 0.00 N ATOM 1483 CA ASP A 101 -15.065 0.762 -5.963 1.00 0.00 C ATOM 1484 C ASP A 101 -15.662 -0.418 -5.203 1.00 0.00 C ATOM 1485 O ASP A 101 -16.520 -1.134 -5.720 1.00 0.00 O ATOM 1486 CB ASP A 101 -16.180 1.701 -6.429 1.00 0.00 C ATOM 1487 CG ASP A 101 -16.402 2.855 -5.471 1.00 0.00 C ATOM 1488 OD1 ASP A 101 -16.654 2.594 -4.275 1.00 0.00 O ATOM 1489 OD2 ASP A 101 -16.325 4.019 -5.916 1.00 0.00 O ATOM 0 H ASP A 101 -14.711 0.484 -8.011 1.00 0.00 H new ATOM 0 HA ASP A 101 -14.400 1.304 -5.291 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -15.932 2.094 -7.415 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -17.106 1.136 -6.534 1.00 0.00 H new ATOM 1494 N VAL A 102 -15.201 -0.616 -3.972 1.00 0.00 N ATOM 1495 CA VAL A 102 -15.689 -1.709 -3.140 1.00 0.00 C ATOM 1496 C VAL A 102 -16.687 -1.208 -2.103 1.00 0.00 C ATOM 1497 O VAL A 102 -16.450 -0.201 -1.436 1.00 0.00 O ATOM 1498 CB VAL A 102 -14.531 -2.425 -2.418 1.00 0.00 C ATOM 1499 CG1 VAL A 102 -15.057 -3.577 -1.576 1.00 0.00 C ATOM 1500 CG2 VAL A 102 -13.500 -2.916 -3.423 1.00 0.00 C ATOM 0 H VAL A 102 -14.490 -0.034 -3.529 1.00 0.00 H new ATOM 0 HA VAL A 102 -16.185 -2.415 -3.805 1.00 0.00 H new ATOM 0 HB VAL A 102 -14.045 -1.712 -1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -14.225 -4.070 -1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -15.755 -3.194 -0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -15.569 -4.293 -2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -12.689 -3.419 -2.896 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -13.971 -3.614 -4.116 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -13.100 -2.067 -3.978 1.00 0.00 H new ATOM 1510 N GLU A 103 -17.803 -1.918 -1.972 1.00 0.00 N ATOM 1511 CA GLU A 103 -18.838 -1.543 -1.015 1.00 0.00 C ATOM 1512 C GLU A 103 -19.223 -2.731 -0.138 1.00 0.00 C ATOM 1513 O GLU A 103 -19.944 -3.630 -0.572 1.00 0.00 O ATOM 1514 CB GLU A 103 -20.073 -1.014 -1.747 1.00 0.00 C ATOM 1515 CG GLU A 103 -21.326 -0.989 -0.887 1.00 0.00 C ATOM 1516 CD GLU A 103 -21.162 -0.138 0.357 1.00 0.00 C ATOM 1517 OE1 GLU A 103 -20.373 -0.528 1.242 1.00 0.00 O ATOM 1518 OE2 GLU A 103 -21.824 0.918 0.446 1.00 0.00 O ATOM 0 H GLU A 103 -18.014 -2.755 -2.516 1.00 0.00 H new ATOM 0 HA GLU A 103 -18.439 -0.756 -0.376 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -19.868 -0.005 -2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.257 -1.633 -2.625 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.159 -0.607 -1.477 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -21.582 -2.007 -0.595 1.00 0.00 H new ATOM 1525 N LEU A 104 -18.737 -2.728 1.099 1.00 0.00 N ATOM 1526 CA LEU A 104 -19.029 -3.805 2.038 1.00 0.00 C ATOM 1527 C LEU A 104 -20.515 -3.840 2.382 1.00 0.00 C ATOM 1528 O LEU A 104 -21.096 -2.828 2.776 1.00 0.00 O ATOM 1529 CB LEU A 104 -18.203 -3.633 3.314 1.00 0.00 C ATOM 1530 CG LEU A 104 -17.799 -4.921 4.031 1.00 0.00 C ATOM 1531 CD1 LEU A 104 -18.931 -5.936 3.984 1.00 0.00 C ATOM 1532 CD2 LEU A 104 -16.535 -5.501 3.413 1.00 0.00 C ATOM 0 H LEU A 104 -18.139 -1.992 1.474 1.00 0.00 H new ATOM 0 HA LEU A 104 -18.762 -4.749 1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -17.297 -3.080 3.065 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -18.771 -3.016 4.010 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.594 -4.684 5.075 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.625 -6.846 4.499 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -19.812 -5.521 4.473 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.168 -6.169 2.946 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.262 -6.418 3.936 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -16.713 -5.723 2.361 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.723 -4.779 3.499 1.00 0.00 H new ATOM 1544 N LEU A 105 -21.124 -5.011 2.231 1.00 0.00 N ATOM 1545 CA LEU A 105 -22.543 -5.179 2.527 1.00 0.00 C ATOM 1546 C LEU A 105 -22.743 -6.112 3.717 1.00 0.00 C ATOM 1547 O LEU A 105 -23.571 -5.852 4.590 1.00 0.00 O ATOM 1548 CB LEU A 105 -23.278 -5.728 1.304 1.00 0.00 C ATOM 1549 CG LEU A 105 -23.657 -4.705 0.233 1.00 0.00 C ATOM 1550 CD1 LEU A 105 -24.360 -5.385 -0.931 1.00 0.00 C ATOM 1551 CD2 LEU A 105 -24.537 -3.614 0.826 1.00 0.00 C ATOM 0 H LEU A 105 -20.658 -5.858 1.906 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.955 -4.202 2.781 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.653 -6.493 0.843 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -24.188 -6.222 1.644 1.00 0.00 H new ATOM 0 HG LEU A 105 -22.743 -4.244 -0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -24.622 -4.641 -1.683 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -23.697 -6.129 -1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -25.266 -5.874 -0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -24.797 -2.894 0.050 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -25.447 -4.059 1.228 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -23.998 -3.106 1.626 1.00 0.00 H new ATOM 1563 N ARG A 106 -21.979 -7.199 3.745 1.00 0.00 N ATOM 1564 CA ARG A 106 -22.073 -8.171 4.828 1.00 0.00 C ATOM 1565 C ARG A 106 -20.739 -8.881 5.037 1.00 0.00 C ATOM 1566 O ARG A 106 -19.871 -8.866 4.164 1.00 0.00 O ATOM 1567 CB ARG A 106 -23.167 -9.197 4.528 1.00 0.00 C ATOM 1568 CG ARG A 106 -24.531 -8.575 4.274 1.00 0.00 C ATOM 1569 CD ARG A 106 -25.574 -9.634 3.952 1.00 0.00 C ATOM 1570 NE ARG A 106 -26.886 -9.048 3.691 1.00 0.00 N ATOM 1571 CZ ARG A 106 -27.203 -8.430 2.559 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -26.308 -8.319 1.587 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -28.418 -7.923 2.396 1.00 0.00 N ATOM 0 H ARG A 106 -21.288 -7.429 3.031 1.00 0.00 H new ATOM 0 HA ARG A 106 -22.328 -7.635 5.742 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -22.876 -9.782 3.656 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -23.243 -9.890 5.366 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -24.844 -8.010 5.152 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -24.462 -7.868 3.448 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -25.253 -10.206 3.082 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -25.649 -10.334 4.784 1.00 0.00 H new ATOM 0 HE ARG A 106 -27.598 -9.117 4.418 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -25.373 -8.709 1.708 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -26.554 -7.844 0.719 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -29.110 -8.008 3.141 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -28.660 -7.449 1.526 1.00 0.00 H new ATOM 1587 N VAL A 107 -20.582 -9.504 6.201 1.00 0.00 N ATOM 1588 CA VAL A 107 -19.354 -10.221 6.526 1.00 0.00 C ATOM 1589 C VAL A 107 -19.652 -11.491 7.315 1.00 0.00 C ATOM 1590 O VAL A 107 -20.598 -11.537 8.101 1.00 0.00 O ATOM 1591 CB VAL A 107 -18.387 -9.339 7.338 1.00 0.00 C ATOM 1592 CG1 VAL A 107 -19.028 -8.911 8.650 1.00 0.00 C ATOM 1593 CG2 VAL A 107 -17.080 -10.075 7.589 1.00 0.00 C ATOM 0 H VAL A 107 -21.290 -9.527 6.935 1.00 0.00 H new ATOM 0 HA VAL A 107 -18.883 -10.487 5.580 1.00 0.00 H new ATOM 0 HB VAL A 107 -18.167 -8.442 6.759 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -18.330 -8.289 9.210 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -19.935 -8.343 8.444 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -19.279 -9.794 9.238 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -16.408 -9.438 8.164 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -17.279 -10.990 8.147 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -16.615 -10.326 6.636 1.00 0.00 H new ATOM 1603 N GLU A 108 -18.837 -12.519 7.100 1.00 0.00 N ATOM 1604 CA GLU A 108 -19.014 -13.790 7.792 1.00 0.00 C ATOM 1605 C GLU A 108 -17.693 -14.549 7.883 1.00 0.00 C ATOM 1606 O GLU A 108 -17.136 -14.967 6.868 1.00 0.00 O ATOM 1607 CB GLU A 108 -20.058 -14.647 7.073 1.00 0.00 C ATOM 1608 CG GLU A 108 -21.486 -14.175 7.291 1.00 0.00 C ATOM 1609 CD GLU A 108 -22.508 -15.260 7.009 1.00 0.00 C ATOM 1610 OE1 GLU A 108 -22.095 -16.390 6.675 1.00 0.00 O ATOM 1611 OE2 GLU A 108 -23.719 -14.978 7.121 1.00 0.00 O ATOM 0 H GLU A 108 -18.049 -12.497 6.453 1.00 0.00 H new ATOM 0 HA GLU A 108 -19.362 -13.578 8.803 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -19.843 -14.647 6.004 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -19.968 -15.678 7.416 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -21.599 -13.833 8.320 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -21.684 -13.318 6.647 1.00 0.00 H new TER 1618 GLU A 108