USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 872 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 96 ASN : amide:sc= -5.57 X(o=-8.6,f=-8.7!) USER MOD Set 1.2: A 98 HIS : no HD1:sc= -3.05 K(o=-8.6,f=-5.9) USER MOD Set 2.1: A 70 SER OG : rot 180:sc= -0.19 USER MOD Set 2.2: A 71 HIS : no HD1:sc= -0.807 X(o=-1,f=-0.51) USER MOD Set 3.1: A 53 SER OG : rot -160:sc=0.000779 USER MOD Set 3.2: A 68 ASN : amide:sc= -0.194 X(o=-1.1,f=-1.1) USER MOD Set 3.3: A 93 MET CE :methyl 146:sc= -0.864 (180deg=-2.18) USER MOD Set 3.4: A 95 GLN : amide:sc= 0 X(o=-1.1,f=-1.5) USER MOD Set 4.1: A 52 TYR OH : rot 20:sc= -1.07 USER MOD Set 4.2: A 75 MET CE :methyl 176:sc= -2.26 (180deg=-2.26!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -17:sc= 0.784 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00686 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -170:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.834 X(o=-0.83,f=-0.83) USER MOD Single : A 13 THR OG1 : rot 43:sc= 0.0419 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -150:sc= 0.874 USER MOD Single : A 31 THR OG1 : rot -150:sc= -0.0172 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 170:sc= 0 USER MOD Single : A 40 THR OG1 : rot 175:sc= 0.259 USER MOD Single : A 43 SER OG : rot 110:sc= 0.0448 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 49 ASN : amide:sc= -1.88! K(o=-1.9!,f=0.062) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.00835 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot -154:sc= 0.846 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 101:sc= 1.22 USER MOD Single : A 76 GLN : amide:sc= -1.86 K(o=-1.9,f=-5.9!) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.325 USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 81 ASN : amide:sc= -0.628 X(o=-0.63,f=-0.8) USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -154:sc= 1.29 USER MOD Single : A 88 TYR OH : rot 30:sc= -0.546 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 32:sc= 0.615 USER MOD Single : A 103 SER OG : rot 44:sc= 0.108 USER MOD Single : A 104 SER OG : rot -55:sc= 0.319! USER MOD Single : A 111 THR OG1 : rot -154:sc= 1.76 USER MOD Single : A 112 GLN : amide:sc= 0.177 K(o=0.18,f=-2.2!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.467 13.374 -19.573 1.00 0.00 N ATOM 2 CA GLY A 1 3.502 14.330 -19.226 1.00 0.00 C ATOM 3 C GLY A 1 4.693 14.261 -20.161 1.00 0.00 C ATOM 4 O GLY A 1 5.812 13.983 -19.732 1.00 0.00 O ATOM 0 H1 GLY A 1 1.675 13.461 -18.904 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.128 13.564 -20.538 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.855 12.410 -19.526 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.085 15.337 -19.248 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.835 14.146 -18.205 1.00 0.00 H new ATOM 8 N SER A 2 4.451 14.513 -21.444 1.00 0.00 N ATOM 9 CA SER A 2 5.512 14.472 -22.444 1.00 0.00 C ATOM 10 C SER A 2 6.349 13.205 -22.297 1.00 0.00 C ATOM 11 O SER A 2 7.572 13.237 -22.430 1.00 0.00 O ATOM 12 CB SER A 2 6.408 15.706 -22.318 1.00 0.00 C ATOM 13 OG SER A 2 7.274 15.596 -21.201 1.00 0.00 O ATOM 0 H SER A 2 3.530 14.748 -21.815 1.00 0.00 H new ATOM 0 HA SER A 2 5.048 14.467 -23.430 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.996 15.826 -23.228 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.791 16.599 -22.217 1.00 0.00 H new ATOM 0 HG SER A 2 6.940 14.901 -20.596 1.00 0.00 H new ATOM 19 N SER A 3 5.680 12.090 -22.021 1.00 0.00 N ATOM 20 CA SER A 3 6.361 10.812 -21.851 1.00 0.00 C ATOM 21 C SER A 3 7.316 10.547 -23.011 1.00 0.00 C ATOM 22 O SER A 3 7.278 11.235 -24.030 1.00 0.00 O ATOM 23 CB SER A 3 5.341 9.677 -21.746 1.00 0.00 C ATOM 24 OG SER A 3 5.948 8.489 -21.269 1.00 0.00 O ATOM 0 H SER A 3 4.667 12.046 -21.910 1.00 0.00 H new ATOM 0 HA SER A 3 6.941 10.857 -20.929 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.533 9.971 -21.076 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.894 9.494 -22.723 1.00 0.00 H new ATOM 0 HG SER A 3 5.275 7.779 -21.209 1.00 0.00 H new ATOM 30 N GLY A 4 8.173 9.544 -22.847 1.00 0.00 N ATOM 31 CA GLY A 4 9.126 9.205 -23.887 1.00 0.00 C ATOM 32 C GLY A 4 9.168 7.717 -24.173 1.00 0.00 C ATOM 33 O GLY A 4 8.272 6.975 -23.771 1.00 0.00 O ATOM 0 H GLY A 4 8.224 8.960 -22.012 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.867 9.740 -24.801 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.119 9.543 -23.590 1.00 0.00 H new ATOM 37 N SER A 5 10.211 7.279 -24.871 1.00 0.00 N ATOM 38 CA SER A 5 10.364 5.870 -25.215 1.00 0.00 C ATOM 39 C SER A 5 11.838 5.488 -25.299 1.00 0.00 C ATOM 40 O SER A 5 12.707 6.349 -25.434 1.00 0.00 O ATOM 41 CB SER A 5 9.671 5.571 -26.547 1.00 0.00 C ATOM 42 OG SER A 5 9.509 4.176 -26.735 1.00 0.00 O ATOM 0 H SER A 5 10.963 7.880 -25.209 1.00 0.00 H new ATOM 0 HA SER A 5 9.897 5.276 -24.429 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.697 6.060 -26.572 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.257 5.986 -27.367 1.00 0.00 H new ATOM 0 HG SER A 5 9.063 4.011 -27.592 1.00 0.00 H new ATOM 48 N SER A 6 12.112 4.190 -25.217 1.00 0.00 N ATOM 49 CA SER A 6 13.481 3.692 -25.280 1.00 0.00 C ATOM 50 C SER A 6 13.521 2.284 -25.867 1.00 0.00 C ATOM 51 O SER A 6 12.483 1.669 -26.105 1.00 0.00 O ATOM 52 CB SER A 6 14.110 3.693 -23.885 1.00 0.00 C ATOM 53 OG SER A 6 13.310 2.974 -22.964 1.00 0.00 O ATOM 0 H SER A 6 11.404 3.464 -25.107 1.00 0.00 H new ATOM 0 HA SER A 6 14.053 4.354 -25.930 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.105 3.249 -23.931 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.234 4.719 -23.540 1.00 0.00 H new ATOM 0 HG SER A 6 13.646 3.120 -22.055 1.00 0.00 H new ATOM 59 N GLY A 7 14.730 1.780 -26.098 1.00 0.00 N ATOM 60 CA GLY A 7 14.884 0.450 -26.656 1.00 0.00 C ATOM 61 C GLY A 7 15.313 -0.568 -25.617 1.00 0.00 C ATOM 62 O GLY A 7 14.743 -1.655 -25.532 1.00 0.00 O ATOM 0 H GLY A 7 15.605 2.269 -25.909 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.941 0.135 -27.101 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.621 0.479 -27.458 1.00 0.00 H new ATOM 66 N GLU A 8 16.322 -0.215 -24.827 1.00 0.00 N ATOM 67 CA GLU A 8 16.828 -1.108 -23.791 1.00 0.00 C ATOM 68 C GLU A 8 16.864 -0.405 -22.437 1.00 0.00 C ATOM 69 O GLU A 8 17.837 -0.521 -21.691 1.00 0.00 O ATOM 70 CB GLU A 8 18.227 -1.608 -24.156 1.00 0.00 C ATOM 71 CG GLU A 8 18.220 -2.845 -25.038 1.00 0.00 C ATOM 72 CD GLU A 8 17.634 -2.580 -26.411 1.00 0.00 C ATOM 73 OE1 GLU A 8 18.238 -1.795 -27.172 1.00 0.00 O ATOM 74 OE2 GLU A 8 16.572 -3.156 -26.725 1.00 0.00 O ATOM 0 H GLU A 8 16.805 0.682 -24.884 1.00 0.00 H new ATOM 0 HA GLU A 8 16.153 -1.961 -23.720 1.00 0.00 H new ATOM 0 HB2 GLU A 8 18.767 -0.811 -24.667 1.00 0.00 H new ATOM 0 HB3 GLU A 8 18.775 -1.828 -23.240 1.00 0.00 H new ATOM 0 HG2 GLU A 8 19.240 -3.214 -25.148 1.00 0.00 H new ATOM 0 HG3 GLU A 8 17.647 -3.632 -24.548 1.00 0.00 H new ATOM 81 N HIS A 9 15.798 0.325 -22.127 1.00 0.00 N ATOM 82 CA HIS A 9 15.707 1.047 -20.863 1.00 0.00 C ATOM 83 C HIS A 9 16.939 1.921 -20.647 1.00 0.00 C ATOM 84 O HIS A 9 17.376 2.125 -19.514 1.00 0.00 O ATOM 85 CB HIS A 9 15.552 0.066 -19.700 1.00 0.00 C ATOM 86 CG HIS A 9 15.345 0.734 -18.376 1.00 0.00 C ATOM 87 ND1 HIS A 9 16.064 0.405 -17.246 1.00 0.00 N ATOM 88 CD2 HIS A 9 14.495 1.720 -18.005 1.00 0.00 C ATOM 89 CE1 HIS A 9 15.664 1.158 -16.237 1.00 0.00 C ATOM 90 NE2 HIS A 9 14.713 1.965 -16.672 1.00 0.00 N ATOM 0 H HIS A 9 14.985 0.432 -22.734 1.00 0.00 H new ATOM 0 HA HIS A 9 14.829 1.691 -20.903 1.00 0.00 H new ATOM 0 HB2 HIS A 9 14.707 -0.593 -19.901 1.00 0.00 H new ATOM 0 HB3 HIS A 9 16.441 -0.563 -19.645 1.00 0.00 H new ATOM 0 HD2 HIS A 9 13.779 2.221 -18.640 1.00 0.00 H new ATOM 0 HE1 HIS A 9 16.049 1.120 -15.229 1.00 0.00 H new ATOM 0 HE2 HIS A 9 14.220 2.658 -16.109 1.00 0.00 H new ATOM 99 N ALA A 10 17.494 2.433 -21.740 1.00 0.00 N ATOM 100 CA ALA A 10 18.675 3.285 -21.669 1.00 0.00 C ATOM 101 C ALA A 10 18.612 4.210 -20.459 1.00 0.00 C ATOM 102 O ALA A 10 17.550 4.699 -20.074 1.00 0.00 O ATOM 103 CB ALA A 10 18.818 4.096 -22.949 1.00 0.00 C ATOM 0 H ALA A 10 17.145 2.273 -22.685 1.00 0.00 H new ATOM 0 HA ALA A 10 19.550 2.644 -21.558 1.00 0.00 H new ATOM 0 HB1 ALA A 10 19.704 4.728 -22.882 1.00 0.00 H new ATOM 0 HB2 ALA A 10 18.917 3.420 -23.799 1.00 0.00 H new ATOM 0 HB3 ALA A 10 17.936 4.722 -23.084 1.00 0.00 H new ATOM 109 N PRO A 11 19.777 4.458 -19.841 1.00 0.00 N ATOM 110 CA PRO A 11 19.881 5.326 -18.665 1.00 0.00 C ATOM 111 C PRO A 11 19.636 6.792 -19.003 1.00 0.00 C ATOM 112 O PRO A 11 19.869 7.226 -20.131 1.00 0.00 O ATOM 113 CB PRO A 11 21.324 5.118 -18.197 1.00 0.00 C ATOM 114 CG PRO A 11 22.062 4.699 -19.421 1.00 0.00 C ATOM 115 CD PRO A 11 21.083 3.909 -20.245 1.00 0.00 C ATOM 0 HA PRO A 11 19.134 5.081 -17.910 1.00 0.00 H new ATOM 0 HB2 PRO A 11 21.740 6.034 -17.778 1.00 0.00 H new ATOM 0 HB3 PRO A 11 21.382 4.356 -17.419 1.00 0.00 H new ATOM 0 HG2 PRO A 11 22.426 5.566 -19.973 1.00 0.00 H new ATOM 0 HG3 PRO A 11 22.933 4.095 -19.164 1.00 0.00 H new ATOM 0 HD2 PRO A 11 21.260 4.038 -21.313 1.00 0.00 H new ATOM 0 HD3 PRO A 11 21.152 2.841 -20.037 1.00 0.00 H new ATOM 123 N ALA A 12 19.167 7.552 -18.019 1.00 0.00 N ATOM 124 CA ALA A 12 18.893 8.970 -18.212 1.00 0.00 C ATOM 125 C ALA A 12 19.320 9.783 -16.994 1.00 0.00 C ATOM 126 O ALA A 12 19.198 9.327 -15.857 1.00 0.00 O ATOM 127 CB ALA A 12 17.416 9.188 -18.503 1.00 0.00 C ATOM 0 H ALA A 12 18.969 7.209 -17.079 1.00 0.00 H new ATOM 0 HA ALA A 12 19.475 9.313 -19.067 1.00 0.00 H new ATOM 0 HB1 ALA A 12 17.226 10.252 -18.645 1.00 0.00 H new ATOM 0 HB2 ALA A 12 17.140 8.646 -19.408 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.822 8.822 -17.665 1.00 0.00 H new ATOM 133 N THR A 13 19.821 10.989 -17.239 1.00 0.00 N ATOM 134 CA THR A 13 20.268 11.864 -16.163 1.00 0.00 C ATOM 135 C THR A 13 19.085 12.410 -15.371 1.00 0.00 C ATOM 136 O THR A 13 18.197 13.058 -15.927 1.00 0.00 O ATOM 137 CB THR A 13 21.096 13.044 -16.705 1.00 0.00 C ATOM 138 OG1 THR A 13 20.499 13.552 -17.904 1.00 0.00 O ATOM 139 CG2 THR A 13 22.528 12.616 -16.988 1.00 0.00 C ATOM 0 H THR A 13 19.927 11.382 -18.174 1.00 0.00 H new ATOM 0 HA THR A 13 20.895 11.261 -15.506 1.00 0.00 H new ATOM 0 HB THR A 13 21.111 13.827 -15.947 1.00 0.00 H new ATOM 0 HG1 THR A 13 19.528 13.608 -17.787 1.00 0.00 H new ATOM 0 HG21 THR A 13 23.093 13.466 -17.370 1.00 0.00 H new ATOM 0 HG22 THR A 13 22.989 12.258 -16.068 1.00 0.00 H new ATOM 0 HG23 THR A 13 22.529 11.817 -17.730 1.00 0.00 H new ATOM 147 N THR A 14 19.077 12.145 -14.068 1.00 0.00 N ATOM 148 CA THR A 14 18.003 12.609 -13.200 1.00 0.00 C ATOM 149 C THR A 14 18.514 12.879 -11.789 1.00 0.00 C ATOM 150 O THR A 14 19.452 12.234 -11.325 1.00 0.00 O ATOM 151 CB THR A 14 16.854 11.585 -13.131 1.00 0.00 C ATOM 152 OG1 THR A 14 15.805 12.081 -12.292 1.00 0.00 O ATOM 153 CG2 THR A 14 17.351 10.251 -12.595 1.00 0.00 C ATOM 0 H THR A 14 19.803 11.611 -13.591 1.00 0.00 H new ATOM 0 HA THR A 14 17.627 13.537 -13.631 1.00 0.00 H new ATOM 0 HB THR A 14 16.470 11.434 -14.140 1.00 0.00 H new ATOM 0 HG1 THR A 14 15.078 11.425 -12.255 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.523 9.544 -12.555 1.00 0.00 H new ATOM 0 HG22 THR A 14 18.129 9.862 -13.252 1.00 0.00 H new ATOM 0 HG23 THR A 14 17.758 10.390 -11.593 1.00 0.00 H new ATOM 161 N GLY A 15 17.888 13.837 -11.112 1.00 0.00 N ATOM 162 CA GLY A 15 18.294 14.175 -9.760 1.00 0.00 C ATOM 163 C GLY A 15 17.917 13.102 -8.757 1.00 0.00 C ATOM 164 O GLY A 15 17.576 11.976 -9.118 1.00 0.00 O ATOM 0 H GLY A 15 17.108 14.385 -11.475 1.00 0.00 H new ATOM 0 HA2 GLY A 15 19.373 14.328 -9.735 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.831 15.118 -9.470 1.00 0.00 H new ATOM 168 N PRO A 16 17.980 13.449 -7.462 1.00 0.00 N ATOM 169 CA PRO A 16 17.648 12.521 -6.377 1.00 0.00 C ATOM 170 C PRO A 16 16.157 12.204 -6.322 1.00 0.00 C ATOM 171 O PRO A 16 15.331 12.966 -6.826 1.00 0.00 O ATOM 172 CB PRO A 16 18.081 13.277 -5.119 1.00 0.00 C ATOM 173 CG PRO A 16 18.017 14.716 -5.500 1.00 0.00 C ATOM 174 CD PRO A 16 18.379 14.774 -6.959 1.00 0.00 C ATOM 0 HA PRO A 16 18.139 11.556 -6.501 1.00 0.00 H new ATOM 0 HB2 PRO A 16 17.420 13.060 -4.280 1.00 0.00 H new ATOM 0 HB3 PRO A 16 19.088 12.993 -4.813 1.00 0.00 H new ATOM 0 HG2 PRO A 16 17.020 15.121 -5.329 1.00 0.00 H new ATOM 0 HG3 PRO A 16 18.709 15.309 -4.902 1.00 0.00 H new ATOM 0 HD2 PRO A 16 17.849 15.575 -7.473 1.00 0.00 H new ATOM 0 HD3 PRO A 16 19.444 14.954 -7.102 1.00 0.00 H new ATOM 182 N LEU A 17 15.819 11.076 -5.706 1.00 0.00 N ATOM 183 CA LEU A 17 14.427 10.659 -5.584 1.00 0.00 C ATOM 184 C LEU A 17 14.039 10.479 -4.120 1.00 0.00 C ATOM 185 O LEU A 17 14.870 10.171 -3.265 1.00 0.00 O ATOM 186 CB LEU A 17 14.196 9.354 -6.348 1.00 0.00 C ATOM 187 CG LEU A 17 14.031 9.483 -7.863 1.00 0.00 C ATOM 188 CD1 LEU A 17 14.219 8.134 -8.538 1.00 0.00 C ATOM 189 CD2 LEU A 17 12.667 10.067 -8.202 1.00 0.00 C ATOM 0 H LEU A 17 16.490 10.434 -5.284 1.00 0.00 H new ATOM 0 HA LEU A 17 13.801 11.441 -6.014 1.00 0.00 H new ATOM 0 HB2 LEU A 17 15.035 8.687 -6.150 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.304 8.874 -5.945 1.00 0.00 H new ATOM 0 HG LEU A 17 14.798 10.162 -8.237 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.098 8.246 -9.615 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.218 7.756 -8.323 1.00 0.00 H new ATOM 0 HD13 LEU A 17 13.476 7.432 -8.161 1.00 0.00 H new ATOM 0 HD21 LEU A 17 12.566 10.152 -9.284 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.885 9.414 -7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.571 11.054 -7.750 1.00 0.00 H new ATOM 201 N PRO A 18 12.746 10.673 -3.822 1.00 0.00 N ATOM 202 CA PRO A 18 12.217 10.535 -2.462 1.00 0.00 C ATOM 203 C PRO A 18 12.210 9.086 -1.987 1.00 0.00 C ATOM 204 O PRO A 18 12.845 8.222 -2.591 1.00 0.00 O ATOM 205 CB PRO A 18 10.786 11.065 -2.582 1.00 0.00 C ATOM 206 CG PRO A 18 10.425 10.861 -4.013 1.00 0.00 C ATOM 207 CD PRO A 18 11.699 11.041 -4.791 1.00 0.00 C ATOM 0 HA PRO A 18 12.825 11.070 -1.732 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.107 10.525 -1.922 1.00 0.00 H new ATOM 0 HB3 PRO A 18 10.729 12.118 -2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 18 10.008 9.867 -4.172 1.00 0.00 H new ATOM 0 HG3 PRO A 18 9.669 11.579 -4.331 1.00 0.00 H new ATOM 0 HD2 PRO A 18 11.725 10.401 -5.673 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.816 12.067 -5.138 1.00 0.00 H new ATOM 215 N SER A 19 11.489 8.827 -0.901 1.00 0.00 N ATOM 216 CA SER A 19 11.402 7.483 -0.343 1.00 0.00 C ATOM 217 C SER A 19 9.957 7.126 -0.005 1.00 0.00 C ATOM 218 O SER A 19 9.234 7.922 0.593 1.00 0.00 O ATOM 219 CB SER A 19 12.273 7.371 0.910 1.00 0.00 C ATOM 220 OG SER A 19 13.645 7.531 0.594 1.00 0.00 O ATOM 0 H SER A 19 10.956 9.531 -0.390 1.00 0.00 H new ATOM 0 HA SER A 19 11.765 6.781 -1.094 1.00 0.00 H new ATOM 0 HB2 SER A 19 11.973 8.128 1.634 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.116 6.400 1.380 1.00 0.00 H new ATOM 0 HG SER A 19 14.180 7.457 1.412 1.00 0.00 H new ATOM 226 N ALA A 20 9.545 5.925 -0.395 1.00 0.00 N ATOM 227 CA ALA A 20 8.188 5.461 -0.132 1.00 0.00 C ATOM 228 C ALA A 20 7.721 5.886 1.256 1.00 0.00 C ATOM 229 O ALA A 20 8.522 6.115 2.163 1.00 0.00 O ATOM 230 CB ALA A 20 8.110 3.948 -0.278 1.00 0.00 C ATOM 0 H ALA A 20 10.131 5.255 -0.894 1.00 0.00 H new ATOM 0 HA ALA A 20 7.525 5.920 -0.865 1.00 0.00 H new ATOM 0 HB1 ALA A 20 7.091 3.615 -0.079 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.392 3.665 -1.292 1.00 0.00 H new ATOM 0 HB3 ALA A 20 8.790 3.478 0.432 1.00 0.00 H new ATOM 236 N PRO A 21 6.396 5.994 1.428 1.00 0.00 N ATOM 237 CA PRO A 21 5.793 6.393 2.703 1.00 0.00 C ATOM 238 C PRO A 21 5.942 5.319 3.775 1.00 0.00 C ATOM 239 O PRO A 21 6.346 4.192 3.487 1.00 0.00 O ATOM 240 CB PRO A 21 4.317 6.594 2.351 1.00 0.00 C ATOM 241 CG PRO A 21 4.091 5.729 1.159 1.00 0.00 C ATOM 242 CD PRO A 21 5.383 5.737 0.390 1.00 0.00 C ATOM 0 HA PRO A 21 6.271 7.280 3.119 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.670 6.305 3.179 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.102 7.639 2.128 1.00 0.00 H new ATOM 0 HG2 PRO A 21 3.821 4.716 1.458 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.272 6.111 0.550 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.556 4.786 -0.114 1.00 0.00 H new ATOM 0 HD3 PRO A 21 5.389 6.511 -0.378 1.00 0.00 H new ATOM 250 N ARG A 22 5.614 5.675 5.013 1.00 0.00 N ATOM 251 CA ARG A 22 5.713 4.741 6.128 1.00 0.00 C ATOM 252 C ARG A 22 4.337 4.460 6.726 1.00 0.00 C ATOM 253 O ARG A 22 3.331 5.009 6.277 1.00 0.00 O ATOM 254 CB ARG A 22 6.645 5.298 7.207 1.00 0.00 C ATOM 255 CG ARG A 22 7.861 6.018 6.648 1.00 0.00 C ATOM 256 CD ARG A 22 9.021 5.060 6.423 1.00 0.00 C ATOM 257 NE ARG A 22 8.883 4.316 5.174 1.00 0.00 N ATOM 258 CZ ARG A 22 9.653 3.285 4.843 1.00 0.00 C ATOM 259 NH1 ARG A 22 10.610 2.878 5.665 1.00 0.00 N ATOM 260 NH2 ARG A 22 9.466 2.660 3.688 1.00 0.00 N ATOM 0 H ARG A 22 5.278 6.603 5.269 1.00 0.00 H new ATOM 0 HA ARG A 22 6.124 3.805 5.749 1.00 0.00 H new ATOM 0 HB2 ARG A 22 6.084 5.986 7.839 1.00 0.00 H new ATOM 0 HB3 ARG A 22 6.979 4.480 7.845 1.00 0.00 H new ATOM 0 HG2 ARG A 22 7.599 6.501 5.707 1.00 0.00 H new ATOM 0 HG3 ARG A 22 8.167 6.806 7.336 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.956 5.620 6.410 1.00 0.00 H new ATOM 0 HD3 ARG A 22 9.080 4.360 7.257 1.00 0.00 H new ATOM 0 HE ARG A 22 8.155 4.604 4.520 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.757 3.357 6.554 1.00 0.00 H new ATOM 0 HH12 ARG A 22 11.200 2.086 5.409 1.00 0.00 H new ATOM 0 HH21 ARG A 22 8.731 2.971 3.053 1.00 0.00 H new ATOM 0 HH22 ARG A 22 10.058 1.869 3.435 1.00 0.00 H new ATOM 274 N ASP A 23 4.302 3.601 7.739 1.00 0.00 N ATOM 275 CA ASP A 23 3.051 3.247 8.398 1.00 0.00 C ATOM 276 C ASP A 23 1.999 2.825 7.377 1.00 0.00 C ATOM 277 O ASP A 23 0.817 3.137 7.521 1.00 0.00 O ATOM 278 CB ASP A 23 2.533 4.426 9.223 1.00 0.00 C ATOM 279 CG ASP A 23 1.347 4.050 10.090 1.00 0.00 C ATOM 280 OD1 ASP A 23 1.357 2.937 10.657 1.00 0.00 O ATOM 281 OD2 ASP A 23 0.409 4.867 10.200 1.00 0.00 O ATOM 0 H ASP A 23 5.126 3.137 8.121 1.00 0.00 H new ATOM 0 HA ASP A 23 3.245 2.405 9.063 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.336 4.804 9.855 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.247 5.237 8.553 1.00 0.00 H new ATOM 286 N VAL A 24 2.438 2.114 6.343 1.00 0.00 N ATOM 287 CA VAL A 24 1.535 1.648 5.297 1.00 0.00 C ATOM 288 C VAL A 24 0.601 0.563 5.820 1.00 0.00 C ATOM 289 O VAL A 24 1.001 -0.590 5.983 1.00 0.00 O ATOM 290 CB VAL A 24 2.314 1.100 4.086 1.00 0.00 C ATOM 291 CG1 VAL A 24 1.361 0.492 3.069 1.00 0.00 C ATOM 292 CG2 VAL A 24 3.155 2.198 3.452 1.00 0.00 C ATOM 0 H VAL A 24 3.413 1.848 6.207 1.00 0.00 H new ATOM 0 HA VAL A 24 0.946 2.509 4.981 1.00 0.00 H new ATOM 0 HB VAL A 24 2.986 0.315 4.433 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.929 0.110 2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.807 -0.325 3.532 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.662 1.254 2.724 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.698 1.793 2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.505 3.007 3.118 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.865 2.582 4.185 1.00 0.00 H new ATOM 302 N VAL A 25 -0.647 0.939 6.082 1.00 0.00 N ATOM 303 CA VAL A 25 -1.640 -0.002 6.585 1.00 0.00 C ATOM 304 C VAL A 25 -3.002 0.242 5.947 1.00 0.00 C ATOM 305 O VAL A 25 -3.224 1.270 5.307 1.00 0.00 O ATOM 306 CB VAL A 25 -1.778 0.093 8.116 1.00 0.00 C ATOM 307 CG1 VAL A 25 -0.416 -0.027 8.784 1.00 0.00 C ATOM 308 CG2 VAL A 25 -2.461 1.395 8.509 1.00 0.00 C ATOM 0 H VAL A 25 -0.994 1.890 5.954 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.292 -1.000 6.320 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.398 -0.735 8.460 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.534 0.042 9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.031 -0.988 8.529 1.00 0.00 H new ATOM 0 HG13 VAL A 25 0.232 0.778 8.437 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.550 1.446 9.594 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.869 2.238 8.154 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.454 1.435 8.061 1.00 0.00 H new ATOM 318 N ALA A 26 -3.913 -0.709 6.126 1.00 0.00 N ATOM 319 CA ALA A 26 -5.255 -0.596 5.569 1.00 0.00 C ATOM 320 C ALA A 26 -6.262 -0.195 6.642 1.00 0.00 C ATOM 321 O ALA A 26 -6.644 -1.009 7.484 1.00 0.00 O ATOM 322 CB ALA A 26 -5.669 -1.907 4.918 1.00 0.00 C ATOM 0 H ALA A 26 -3.746 -1.566 6.653 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.242 0.185 4.809 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.673 -1.808 4.506 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -4.971 -2.152 4.117 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.659 -2.702 5.663 1.00 0.00 H new ATOM 328 N SER A 27 -6.689 1.063 6.607 1.00 0.00 N ATOM 329 CA SER A 27 -7.648 1.573 7.579 1.00 0.00 C ATOM 330 C SER A 27 -8.919 0.728 7.583 1.00 0.00 C ATOM 331 O SER A 27 -9.567 0.566 8.618 1.00 0.00 O ATOM 332 CB SER A 27 -7.993 3.031 7.271 1.00 0.00 C ATOM 333 OG SER A 27 -9.211 3.409 7.890 1.00 0.00 O ATOM 0 H SER A 27 -6.385 1.748 5.915 1.00 0.00 H new ATOM 0 HA SER A 27 -7.191 1.516 8.567 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.189 3.679 7.618 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.071 3.169 6.193 1.00 0.00 H new ATOM 0 HG SER A 27 -9.408 4.345 7.679 1.00 0.00 H new ATOM 339 N LEU A 28 -9.268 0.192 6.419 1.00 0.00 N ATOM 340 CA LEU A 28 -10.461 -0.637 6.286 1.00 0.00 C ATOM 341 C LEU A 28 -10.331 -1.593 5.104 1.00 0.00 C ATOM 342 O LEU A 28 -9.635 -1.302 4.131 1.00 0.00 O ATOM 343 CB LEU A 28 -11.700 0.242 6.112 1.00 0.00 C ATOM 344 CG LEU A 28 -12.910 -0.425 5.457 1.00 0.00 C ATOM 345 CD1 LEU A 28 -14.193 0.292 5.850 1.00 0.00 C ATOM 346 CD2 LEU A 28 -12.752 -0.450 3.944 1.00 0.00 C ATOM 0 H LEU A 28 -8.742 0.316 5.554 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.567 -1.227 7.196 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -12.000 0.610 7.093 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -11.423 1.112 5.516 1.00 0.00 H new ATOM 0 HG LEU A 28 -12.970 -1.454 5.812 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -15.043 -0.197 5.374 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -14.313 0.256 6.933 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -14.143 1.331 5.525 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.623 -0.928 3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -12.666 0.570 3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -11.855 -1.010 3.681 1.00 0.00 H new ATOM 358 N VAL A 29 -11.008 -2.733 5.195 1.00 0.00 N ATOM 359 CA VAL A 29 -10.971 -3.731 4.131 1.00 0.00 C ATOM 360 C VAL A 29 -12.378 -4.097 3.673 1.00 0.00 C ATOM 361 O VAL A 29 -13.073 -4.873 4.328 1.00 0.00 O ATOM 362 CB VAL A 29 -10.242 -5.009 4.586 1.00 0.00 C ATOM 363 CG1 VAL A 29 -10.494 -6.144 3.606 1.00 0.00 C ATOM 364 CG2 VAL A 29 -8.752 -4.746 4.739 1.00 0.00 C ATOM 0 H VAL A 29 -11.589 -2.989 5.994 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.425 -3.287 3.299 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.636 -5.306 5.558 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -9.971 -7.039 3.943 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.564 -6.347 3.552 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.128 -5.861 2.619 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.252 -5.660 5.061 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -8.339 -4.424 3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -8.595 -3.965 5.483 1.00 0.00 H new ATOM 374 N SER A 30 -12.791 -3.533 2.542 1.00 0.00 N ATOM 375 CA SER A 30 -14.117 -3.798 1.996 1.00 0.00 C ATOM 376 C SER A 30 -14.102 -5.040 1.111 1.00 0.00 C ATOM 377 O SER A 30 -13.041 -5.517 0.706 1.00 0.00 O ATOM 378 CB SER A 30 -14.611 -2.592 1.194 1.00 0.00 C ATOM 379 OG SER A 30 -15.593 -2.978 0.247 1.00 0.00 O ATOM 0 H SER A 30 -12.227 -2.890 1.986 1.00 0.00 H new ATOM 0 HA SER A 30 -14.797 -3.975 2.829 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.027 -1.846 1.871 1.00 0.00 H new ATOM 0 HB3 SER A 30 -13.771 -2.123 0.681 1.00 0.00 H new ATOM 0 HG SER A 30 -15.551 -2.382 -0.530 1.00 0.00 H new ATOM 385 N THR A 31 -15.289 -5.562 0.814 1.00 0.00 N ATOM 386 CA THR A 31 -15.414 -6.749 -0.021 1.00 0.00 C ATOM 387 C THR A 31 -15.193 -6.413 -1.492 1.00 0.00 C ATOM 388 O THR A 31 -14.859 -7.285 -2.294 1.00 0.00 O ATOM 389 CB THR A 31 -16.797 -7.407 0.141 1.00 0.00 C ATOM 390 OG1 THR A 31 -17.829 -6.432 -0.051 1.00 0.00 O ATOM 391 CG2 THR A 31 -16.938 -8.038 1.518 1.00 0.00 C ATOM 0 H THR A 31 -16.177 -5.180 1.140 1.00 0.00 H new ATOM 0 HA THR A 31 -14.646 -7.449 0.308 1.00 0.00 H new ATOM 0 HB THR A 31 -16.893 -8.190 -0.611 1.00 0.00 H new ATOM 0 HG1 THR A 31 -18.613 -6.676 0.484 1.00 0.00 H new ATOM 0 HG21 THR A 31 -17.923 -8.496 1.609 1.00 0.00 H new ATOM 0 HG22 THR A 31 -16.170 -8.800 1.650 1.00 0.00 H new ATOM 0 HG23 THR A 31 -16.823 -7.271 2.283 1.00 0.00 H new ATOM 399 N ARG A 32 -15.381 -5.144 -1.838 1.00 0.00 N ATOM 400 CA ARG A 32 -15.202 -4.693 -3.213 1.00 0.00 C ATOM 401 C ARG A 32 -14.083 -3.660 -3.305 1.00 0.00 C ATOM 402 O ARG A 32 -13.741 -3.195 -4.393 1.00 0.00 O ATOM 403 CB ARG A 32 -16.505 -4.098 -3.750 1.00 0.00 C ATOM 404 CG ARG A 32 -17.587 -5.134 -4.006 1.00 0.00 C ATOM 405 CD ARG A 32 -18.726 -4.557 -4.832 1.00 0.00 C ATOM 406 NE ARG A 32 -18.470 -4.662 -6.266 1.00 0.00 N ATOM 407 CZ ARG A 32 -19.191 -4.036 -7.190 1.00 0.00 C ATOM 408 NH1 ARG A 32 -20.206 -3.262 -6.831 1.00 0.00 N ATOM 409 NH2 ARG A 32 -18.896 -4.181 -8.475 1.00 0.00 N ATOM 0 H ARG A 32 -15.657 -4.410 -1.186 1.00 0.00 H new ATOM 0 HA ARG A 32 -14.927 -5.556 -3.819 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -16.879 -3.362 -3.038 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -16.296 -3.566 -4.678 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -17.157 -5.990 -4.525 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -17.975 -5.500 -3.055 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -19.651 -5.080 -4.590 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -18.873 -3.510 -4.566 1.00 0.00 H new ATOM 0 HE ARG A 32 -17.695 -5.248 -6.575 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -20.435 -3.146 -5.844 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -20.758 -2.782 -7.542 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -18.115 -4.774 -8.755 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -19.451 -3.700 -9.183 1.00 0.00 H new ATOM 423 N PHE A 33 -13.516 -3.305 -2.157 1.00 0.00 N ATOM 424 CA PHE A 33 -12.436 -2.326 -2.108 1.00 0.00 C ATOM 425 C PHE A 33 -11.666 -2.431 -0.794 1.00 0.00 C ATOM 426 O PHE A 33 -11.981 -3.263 0.057 1.00 0.00 O ATOM 427 CB PHE A 33 -12.994 -0.911 -2.273 1.00 0.00 C ATOM 428 CG PHE A 33 -13.466 -0.299 -0.985 1.00 0.00 C ATOM 429 CD1 PHE A 33 -12.584 0.384 -0.163 1.00 0.00 C ATOM 430 CD2 PHE A 33 -14.791 -0.406 -0.596 1.00 0.00 C ATOM 431 CE1 PHE A 33 -13.014 0.949 1.022 1.00 0.00 C ATOM 432 CE2 PHE A 33 -15.228 0.157 0.588 1.00 0.00 C ATOM 433 CZ PHE A 33 -14.338 0.835 1.399 1.00 0.00 C ATOM 0 H PHE A 33 -13.786 -3.681 -1.248 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.750 -2.537 -2.929 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.224 -0.274 -2.708 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.824 -0.936 -2.980 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -11.548 0.476 -0.452 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -15.491 -0.936 -1.225 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -12.316 1.479 1.653 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -16.264 0.067 0.879 1.00 0.00 H new ATOM 0 HZ PHE A 33 -14.677 1.275 2.325 1.00 0.00 H new ATOM 443 N ILE A 34 -10.656 -1.583 -0.639 1.00 0.00 N ATOM 444 CA ILE A 34 -9.841 -1.580 0.570 1.00 0.00 C ATOM 445 C ILE A 34 -9.302 -0.184 0.866 1.00 0.00 C ATOM 446 O ILE A 34 -8.682 0.449 0.011 1.00 0.00 O ATOM 447 CB ILE A 34 -8.659 -2.560 0.455 1.00 0.00 C ATOM 448 CG1 ILE A 34 -9.170 -3.984 0.228 1.00 0.00 C ATOM 449 CG2 ILE A 34 -7.794 -2.496 1.705 1.00 0.00 C ATOM 450 CD1 ILE A 34 -8.085 -4.959 -0.174 1.00 0.00 C ATOM 0 H ILE A 34 -10.382 -0.889 -1.335 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.488 -1.898 1.387 1.00 0.00 H new ATOM 0 HB ILE A 34 -8.049 -2.271 -0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.647 -4.340 1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -9.937 -3.967 -0.546 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.963 -3.194 1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.406 -1.485 1.828 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.393 -2.763 2.576 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.520 -5.948 -0.318 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.623 -4.627 -1.104 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.329 -5.006 0.610 1.00 0.00 H new ATOM 462 N LYS A 35 -9.541 0.291 2.084 1.00 0.00 N ATOM 463 CA LYS A 35 -9.078 1.610 2.496 1.00 0.00 C ATOM 464 C LYS A 35 -7.630 1.554 2.972 1.00 0.00 C ATOM 465 O LYS A 35 -7.284 0.761 3.849 1.00 0.00 O ATOM 466 CB LYS A 35 -9.971 2.162 3.610 1.00 0.00 C ATOM 467 CG LYS A 35 -9.766 3.643 3.876 1.00 0.00 C ATOM 468 CD LYS A 35 -10.313 4.495 2.743 1.00 0.00 C ATOM 469 CE LYS A 35 -9.636 5.855 2.690 1.00 0.00 C ATOM 470 NZ LYS A 35 -10.324 6.852 3.557 1.00 0.00 N ATOM 0 H LYS A 35 -10.053 -0.219 2.803 1.00 0.00 H new ATOM 0 HA LYS A 35 -9.133 2.273 1.632 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -11.015 1.990 3.347 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -9.778 1.606 4.528 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -10.258 3.917 4.809 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.703 3.847 4.005 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -10.167 3.978 1.795 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -11.387 4.627 2.872 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.597 5.756 3.005 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -9.625 6.215 1.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -9.832 7.766 3.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -11.308 6.966 3.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -10.313 6.521 4.543 1.00 0.00 H new ATOM 484 N LEU A 36 -6.788 2.401 2.389 1.00 0.00 N ATOM 485 CA LEU A 36 -5.376 2.449 2.755 1.00 0.00 C ATOM 486 C LEU A 36 -5.063 3.711 3.551 1.00 0.00 C ATOM 487 O LEU A 36 -5.753 4.724 3.428 1.00 0.00 O ATOM 488 CB LEU A 36 -4.502 2.393 1.501 1.00 0.00 C ATOM 489 CG LEU A 36 -4.065 0.999 1.049 1.00 0.00 C ATOM 490 CD1 LEU A 36 -3.115 0.382 2.063 1.00 0.00 C ATOM 491 CD2 LEU A 36 -5.277 0.103 0.837 1.00 0.00 C ATOM 0 H LEU A 36 -7.058 3.063 1.662 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.158 1.584 3.381 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.045 2.865 0.682 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.609 2.992 1.678 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.538 1.095 0.100 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.815 -0.610 1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.232 1.013 2.165 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.616 0.300 3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.947 -0.885 0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.832 0.014 1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.921 0.537 0.072 1.00 0.00 H new ATOM 503 N THR A 37 -4.015 3.645 4.368 1.00 0.00 N ATOM 504 CA THR A 37 -3.609 4.783 5.184 1.00 0.00 C ATOM 505 C THR A 37 -2.137 4.687 5.566 1.00 0.00 C ATOM 506 O THR A 37 -1.703 3.699 6.159 1.00 0.00 O ATOM 507 CB THR A 37 -4.456 4.885 6.466 1.00 0.00 C ATOM 508 OG1 THR A 37 -4.576 3.596 7.078 1.00 0.00 O ATOM 509 CG2 THR A 37 -5.840 5.436 6.158 1.00 0.00 C ATOM 0 H THR A 37 -3.433 2.815 4.482 1.00 0.00 H new ATOM 0 HA THR A 37 -3.767 5.677 4.582 1.00 0.00 H new ATOM 0 HB THR A 37 -3.955 5.568 7.152 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.974 3.692 7.968 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.420 5.499 7.079 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.747 6.429 5.719 1.00 0.00 H new ATOM 0 HG23 THR A 37 -6.347 4.775 5.455 1.00 0.00 H new ATOM 517 N TRP A 38 -1.373 5.718 5.225 1.00 0.00 N ATOM 518 CA TRP A 38 0.052 5.750 5.534 1.00 0.00 C ATOM 519 C TRP A 38 0.478 7.139 5.996 1.00 0.00 C ATOM 520 O TRP A 38 -0.286 8.099 5.892 1.00 0.00 O ATOM 521 CB TRP A 38 0.869 5.332 4.311 1.00 0.00 C ATOM 522 CG TRP A 38 0.614 6.185 3.106 1.00 0.00 C ATOM 523 CD1 TRP A 38 1.204 7.380 2.808 1.00 0.00 C ATOM 524 CD2 TRP A 38 -0.301 5.910 2.039 1.00 0.00 C ATOM 525 NE1 TRP A 38 0.712 7.864 1.620 1.00 0.00 N ATOM 526 CE2 TRP A 38 -0.212 6.981 1.128 1.00 0.00 C ATOM 527 CE3 TRP A 38 -1.184 4.863 1.764 1.00 0.00 C ATOM 528 CZ2 TRP A 38 -0.974 7.032 -0.036 1.00 0.00 C ATOM 529 CZ3 TRP A 38 -1.940 4.915 0.608 1.00 0.00 C ATOM 530 CH2 TRP A 38 -1.831 5.993 -0.281 1.00 0.00 C ATOM 0 H TRP A 38 -1.716 6.544 4.734 1.00 0.00 H new ATOM 0 HA TRP A 38 0.239 5.046 6.345 1.00 0.00 H new ATOM 0 HB2 TRP A 38 1.929 5.375 4.560 1.00 0.00 H new ATOM 0 HB3 TRP A 38 0.640 4.294 4.068 1.00 0.00 H new ATOM 0 HD1 TRP A 38 1.948 7.872 3.417 1.00 0.00 H new ATOM 0 HE1 TRP A 38 0.990 8.739 1.176 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -1.274 4.028 2.443 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.892 7.862 -0.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -2.626 4.111 0.386 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -2.435 6.004 -1.176 1.00 0.00 H new ATOM 541 N ARG A 39 1.702 7.239 6.505 1.00 0.00 N ATOM 542 CA ARG A 39 2.228 8.512 6.983 1.00 0.00 C ATOM 543 C ARG A 39 3.220 9.099 5.984 1.00 0.00 C ATOM 544 O ARG A 39 3.502 8.500 4.945 1.00 0.00 O ATOM 545 CB ARG A 39 2.905 8.329 8.343 1.00 0.00 C ATOM 546 CG ARG A 39 4.227 7.584 8.269 1.00 0.00 C ATOM 547 CD ARG A 39 5.071 7.824 9.512 1.00 0.00 C ATOM 548 NE ARG A 39 5.504 9.215 9.619 1.00 0.00 N ATOM 549 CZ ARG A 39 6.470 9.623 10.434 1.00 0.00 C ATOM 550 NH1 ARG A 39 7.102 8.751 11.207 1.00 0.00 N ATOM 551 NH2 ARG A 39 6.807 10.906 10.476 1.00 0.00 N ATOM 0 H ARG A 39 2.347 6.454 6.597 1.00 0.00 H new ATOM 0 HA ARG A 39 1.394 9.205 7.090 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.074 9.309 8.790 1.00 0.00 H new ATOM 0 HB3 ARG A 39 2.229 7.788 9.006 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.039 6.516 8.156 1.00 0.00 H new ATOM 0 HG3 ARG A 39 4.778 7.906 7.385 1.00 0.00 H new ATOM 0 HD2 ARG A 39 4.496 7.554 10.398 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.945 7.173 9.488 1.00 0.00 H new ATOM 0 HE ARG A 39 5.039 9.911 9.036 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.847 7.764 11.177 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.844 9.067 11.832 1.00 0.00 H new ATOM 0 HH21 ARG A 39 6.324 11.580 9.882 1.00 0.00 H new ATOM 0 HH22 ARG A 39 7.549 11.218 11.102 1.00 0.00 H new ATOM 565 N THR A 40 3.748 10.277 6.304 1.00 0.00 N ATOM 566 CA THR A 40 4.707 10.947 5.435 1.00 0.00 C ATOM 567 C THR A 40 6.047 10.220 5.432 1.00 0.00 C ATOM 568 O THR A 40 6.516 9.727 6.458 1.00 0.00 O ATOM 569 CB THR A 40 4.929 12.409 5.865 1.00 0.00 C ATOM 570 OG1 THR A 40 4.781 12.530 7.284 1.00 0.00 O ATOM 571 CG2 THR A 40 3.945 13.334 5.165 1.00 0.00 C ATOM 0 H THR A 40 3.527 10.787 7.160 1.00 0.00 H new ATOM 0 HA THR A 40 4.287 10.932 4.429 1.00 0.00 H new ATOM 0 HB THR A 40 5.940 12.699 5.580 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.005 13.443 7.560 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.121 14.361 5.484 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.082 13.261 4.086 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.926 13.043 5.422 1.00 0.00 H new ATOM 579 N PRO A 41 6.682 10.152 4.252 1.00 0.00 N ATOM 580 CA PRO A 41 7.979 9.489 4.088 1.00 0.00 C ATOM 581 C PRO A 41 9.111 10.254 4.764 1.00 0.00 C ATOM 582 O PRO A 41 9.007 11.458 4.998 1.00 0.00 O ATOM 583 CB PRO A 41 8.178 9.469 2.571 1.00 0.00 C ATOM 584 CG PRO A 41 7.367 10.614 2.068 1.00 0.00 C ATOM 585 CD PRO A 41 6.183 10.718 2.988 1.00 0.00 C ATOM 0 HA PRO A 41 7.992 8.500 4.546 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.230 9.583 2.308 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.842 8.526 2.140 1.00 0.00 H new ATOM 0 HG2 PRO A 41 7.948 11.536 2.074 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.048 10.445 1.039 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.859 11.752 3.111 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.328 10.159 2.607 1.00 0.00 H new ATOM 593 N ALA A 42 10.193 9.548 5.076 1.00 0.00 N ATOM 594 CA ALA A 42 11.346 10.163 5.723 1.00 0.00 C ATOM 595 C ALA A 42 11.906 11.303 4.879 1.00 0.00 C ATOM 596 O ALA A 42 12.313 12.337 5.408 1.00 0.00 O ATOM 597 CB ALA A 42 12.422 9.119 5.985 1.00 0.00 C ATOM 0 H ALA A 42 10.295 8.550 4.891 1.00 0.00 H new ATOM 0 HA ALA A 42 11.019 10.579 6.676 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.277 9.591 6.468 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.023 8.340 6.634 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.738 8.677 5.040 1.00 0.00 H new ATOM 603 N SER A 43 11.924 11.107 3.565 1.00 0.00 N ATOM 604 CA SER A 43 12.439 12.117 2.648 1.00 0.00 C ATOM 605 C SER A 43 11.548 13.355 2.648 1.00 0.00 C ATOM 606 O SER A 43 12.031 14.482 2.534 1.00 0.00 O ATOM 607 CB SER A 43 12.540 11.547 1.232 1.00 0.00 C ATOM 608 OG SER A 43 11.281 11.569 0.583 1.00 0.00 O ATOM 0 H SER A 43 11.588 10.258 3.111 1.00 0.00 H new ATOM 0 HA SER A 43 13.434 12.407 2.987 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.261 12.126 0.654 1.00 0.00 H new ATOM 0 HB3 SER A 43 12.913 10.524 1.274 1.00 0.00 H new ATOM 0 HG SER A 43 11.292 12.241 -0.131 1.00 0.00 H new ATOM 614 N ASP A 44 10.244 13.137 2.777 1.00 0.00 N ATOM 615 CA ASP A 44 9.283 14.234 2.793 1.00 0.00 C ATOM 616 C ASP A 44 8.343 14.116 3.989 1.00 0.00 C ATOM 617 O ASP A 44 7.371 13.360 3.974 1.00 0.00 O ATOM 618 CB ASP A 44 8.475 14.252 1.494 1.00 0.00 C ATOM 619 CG ASP A 44 9.170 15.028 0.392 1.00 0.00 C ATOM 620 OD1 ASP A 44 9.954 14.415 -0.362 1.00 0.00 O ATOM 621 OD2 ASP A 44 8.928 16.248 0.283 1.00 0.00 O ATOM 0 H ASP A 44 9.828 12.211 2.872 1.00 0.00 H new ATOM 0 HA ASP A 44 9.838 15.168 2.880 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.304 13.228 1.161 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.497 14.693 1.684 1.00 0.00 H new ATOM 626 N PRO A 45 8.638 14.879 5.052 1.00 0.00 N ATOM 627 CA PRO A 45 7.832 14.877 6.276 1.00 0.00 C ATOM 628 C PRO A 45 6.464 15.520 6.070 1.00 0.00 C ATOM 629 O PRO A 45 5.588 15.427 6.931 1.00 0.00 O ATOM 630 CB PRO A 45 8.669 15.705 7.254 1.00 0.00 C ATOM 631 CG PRO A 45 9.496 16.592 6.388 1.00 0.00 C ATOM 632 CD PRO A 45 9.780 15.804 5.139 1.00 0.00 C ATOM 0 HA PRO A 45 7.622 13.865 6.624 1.00 0.00 H new ATOM 0 HB2 PRO A 45 8.035 16.285 7.925 1.00 0.00 H new ATOM 0 HB3 PRO A 45 9.294 15.067 7.879 1.00 0.00 H new ATOM 0 HG2 PRO A 45 8.965 17.515 6.155 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.421 16.875 6.890 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.842 16.449 4.262 1.00 0.00 H new ATOM 0 HD3 PRO A 45 10.727 15.268 5.208 1.00 0.00 H new ATOM 640 N HIS A 46 6.287 16.170 4.925 1.00 0.00 N ATOM 641 CA HIS A 46 5.024 16.827 4.606 1.00 0.00 C ATOM 642 C HIS A 46 4.348 16.156 3.415 1.00 0.00 C ATOM 643 O HIS A 46 3.126 16.203 3.274 1.00 0.00 O ATOM 644 CB HIS A 46 5.257 18.308 4.307 1.00 0.00 C ATOM 645 CG HIS A 46 5.197 19.182 5.522 1.00 0.00 C ATOM 646 ND1 HIS A 46 4.127 20.005 5.805 1.00 0.00 N ATOM 647 CD2 HIS A 46 6.081 19.356 6.531 1.00 0.00 C ATOM 648 CE1 HIS A 46 4.357 20.649 6.935 1.00 0.00 C ATOM 649 NE2 HIS A 46 5.536 20.273 7.396 1.00 0.00 N ATOM 0 H HIS A 46 7.002 16.256 4.202 1.00 0.00 H new ATOM 0 HA HIS A 46 4.368 16.737 5.472 1.00 0.00 H new ATOM 0 HB2 HIS A 46 6.232 18.425 3.833 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.510 18.647 3.589 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.037 18.865 6.637 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.694 21.362 7.402 1.00 0.00 H new ATOM 0 HE2 HIS A 46 5.971 20.609 8.255 1.00 0.00 H new ATOM 658 N GLY A 47 5.151 15.530 2.559 1.00 0.00 N ATOM 659 CA GLY A 47 4.612 14.859 1.391 1.00 0.00 C ATOM 660 C GLY A 47 3.377 15.548 0.845 1.00 0.00 C ATOM 661 O GLY A 47 2.438 14.890 0.395 1.00 0.00 O ATOM 0 H GLY A 47 6.165 15.476 2.654 1.00 0.00 H new ATOM 0 HA2 GLY A 47 5.375 14.819 0.614 1.00 0.00 H new ATOM 0 HA3 GLY A 47 4.366 13.829 1.649 1.00 0.00 H new ATOM 665 N ASP A 48 3.376 16.875 0.885 1.00 0.00 N ATOM 666 CA ASP A 48 2.246 17.654 0.390 1.00 0.00 C ATOM 667 C ASP A 48 2.493 18.120 -1.041 1.00 0.00 C ATOM 668 O ASP A 48 1.565 18.526 -1.740 1.00 0.00 O ATOM 669 CB ASP A 48 1.996 18.861 1.296 1.00 0.00 C ATOM 670 CG ASP A 48 0.839 19.715 0.817 1.00 0.00 C ATOM 671 OD1 ASP A 48 1.079 20.645 0.019 1.00 0.00 O ATOM 672 OD2 ASP A 48 -0.307 19.453 1.239 1.00 0.00 O ATOM 0 H ASP A 48 4.144 17.435 1.255 1.00 0.00 H new ATOM 0 HA ASP A 48 1.364 17.014 0.398 1.00 0.00 H new ATOM 0 HB2 ASP A 48 1.793 18.515 2.309 1.00 0.00 H new ATOM 0 HB3 ASP A 48 2.899 19.470 1.342 1.00 0.00 H new ATOM 677 N ASN A 49 3.749 18.059 -1.470 1.00 0.00 N ATOM 678 CA ASN A 49 4.118 18.477 -2.818 1.00 0.00 C ATOM 679 C ASN A 49 4.413 17.267 -3.700 1.00 0.00 C ATOM 680 O ASN A 49 4.946 17.404 -4.802 1.00 0.00 O ATOM 681 CB ASN A 49 5.338 19.399 -2.773 1.00 0.00 C ATOM 682 CG ASN A 49 6.469 18.822 -1.944 1.00 0.00 C ATOM 683 OD1 ASN A 49 7.489 18.390 -2.481 1.00 0.00 O ATOM 684 ND2 ASN A 49 6.292 18.812 -0.628 1.00 0.00 N ATOM 0 H ASN A 49 4.529 17.724 -0.904 1.00 0.00 H new ATOM 0 HA ASN A 49 3.276 19.021 -3.246 1.00 0.00 H new ATOM 0 HB2 ASN A 49 5.691 19.580 -3.788 1.00 0.00 H new ATOM 0 HB3 ASN A 49 5.045 20.365 -2.361 1.00 0.00 H new ATOM 0 HD21 ASN A 49 7.018 18.436 -0.019 1.00 0.00 H new ATOM 0 HD22 ASN A 49 5.430 19.181 -0.227 1.00 0.00 H new ATOM 691 N LEU A 50 4.063 16.084 -3.209 1.00 0.00 N ATOM 692 CA LEU A 50 4.289 14.849 -3.952 1.00 0.00 C ATOM 693 C LEU A 50 3.072 13.933 -3.870 1.00 0.00 C ATOM 694 O LEU A 50 2.525 13.704 -2.790 1.00 0.00 O ATOM 695 CB LEU A 50 5.524 14.125 -3.413 1.00 0.00 C ATOM 696 CG LEU A 50 5.773 14.251 -1.909 1.00 0.00 C ATOM 697 CD1 LEU A 50 4.939 13.235 -1.144 1.00 0.00 C ATOM 698 CD2 LEU A 50 7.251 14.074 -1.597 1.00 0.00 C ATOM 0 H LEU A 50 3.621 15.953 -2.299 1.00 0.00 H new ATOM 0 HA LEU A 50 4.455 15.109 -4.998 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.436 13.067 -3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.401 14.503 -3.939 1.00 0.00 H new ATOM 0 HG LEU A 50 5.473 15.250 -1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.129 13.339 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.881 13.408 -1.343 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.208 12.228 -1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.410 14.167 -0.523 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.577 13.088 -1.928 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.827 14.840 -2.116 1.00 0.00 H new ATOM 710 N THR A 51 2.653 13.410 -5.018 1.00 0.00 N ATOM 711 CA THR A 51 1.502 12.518 -5.076 1.00 0.00 C ATOM 712 C THR A 51 1.872 11.112 -4.615 1.00 0.00 C ATOM 713 O THR A 51 3.049 10.758 -4.554 1.00 0.00 O ATOM 714 CB THR A 51 0.921 12.442 -6.500 1.00 0.00 C ATOM 715 OG1 THR A 51 1.151 13.677 -7.189 1.00 0.00 O ATOM 716 CG2 THR A 51 -0.571 12.148 -6.461 1.00 0.00 C ATOM 0 H THR A 51 3.094 13.589 -5.920 1.00 0.00 H new ATOM 0 HA THR A 51 0.748 12.931 -4.406 1.00 0.00 H new ATOM 0 HB THR A 51 1.421 11.631 -7.030 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.780 13.620 -8.094 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.959 12.099 -7.478 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.741 11.194 -5.962 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.084 12.940 -5.915 1.00 0.00 H new ATOM 724 N TYR A 52 0.859 10.315 -4.292 1.00 0.00 N ATOM 725 CA TYR A 52 1.078 8.948 -3.835 1.00 0.00 C ATOM 726 C TYR A 52 0.411 7.947 -4.773 1.00 0.00 C ATOM 727 O TYR A 52 -0.772 8.070 -5.092 1.00 0.00 O ATOM 728 CB TYR A 52 0.540 8.771 -2.415 1.00 0.00 C ATOM 729 CG TYR A 52 1.270 9.600 -1.383 1.00 0.00 C ATOM 730 CD1 TYR A 52 2.543 9.247 -0.953 1.00 0.00 C ATOM 731 CD2 TYR A 52 0.685 10.736 -0.836 1.00 0.00 C ATOM 732 CE1 TYR A 52 3.214 10.002 -0.010 1.00 0.00 C ATOM 733 CE2 TYR A 52 1.349 11.497 0.107 1.00 0.00 C ATOM 734 CZ TYR A 52 2.613 11.126 0.517 1.00 0.00 C ATOM 735 OH TYR A 52 3.276 11.881 1.456 1.00 0.00 O ATOM 0 H TYR A 52 -0.121 10.592 -4.338 1.00 0.00 H new ATOM 0 HA TYR A 52 2.151 8.759 -3.836 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.517 9.036 -2.400 1.00 0.00 H new ATOM 0 HB3 TYR A 52 0.608 7.719 -2.138 1.00 0.00 H new ATOM 0 HD1 TYR A 52 3.016 8.367 -1.363 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -0.305 11.029 -1.153 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.204 9.714 0.313 1.00 0.00 H new ATOM 0 HE2 TYR A 52 0.881 12.378 0.521 1.00 0.00 H new ATOM 0 HH TYR A 52 4.237 11.693 1.408 1.00 0.00 H new ATOM 745 N SER A 53 1.179 6.954 -5.211 1.00 0.00 N ATOM 746 CA SER A 53 0.664 5.932 -6.115 1.00 0.00 C ATOM 747 C SER A 53 0.537 4.590 -5.401 1.00 0.00 C ATOM 748 O SER A 53 1.441 4.169 -4.680 1.00 0.00 O ATOM 749 CB SER A 53 1.580 5.790 -7.333 1.00 0.00 C ATOM 750 OG SER A 53 1.239 6.726 -8.340 1.00 0.00 O ATOM 0 H SER A 53 2.159 6.836 -4.955 1.00 0.00 H new ATOM 0 HA SER A 53 -0.326 6.242 -6.448 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.617 5.938 -7.031 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.505 4.778 -7.732 1.00 0.00 H new ATOM 0 HG SER A 53 1.599 6.426 -9.201 1.00 0.00 H new ATOM 756 N VAL A 54 -0.594 3.922 -5.608 1.00 0.00 N ATOM 757 CA VAL A 54 -0.842 2.627 -4.985 1.00 0.00 C ATOM 758 C VAL A 54 -0.984 1.531 -6.035 1.00 0.00 C ATOM 759 O VAL A 54 -1.878 1.577 -6.880 1.00 0.00 O ATOM 760 CB VAL A 54 -2.112 2.656 -4.114 1.00 0.00 C ATOM 761 CG1 VAL A 54 -2.444 1.261 -3.607 1.00 0.00 C ATOM 762 CG2 VAL A 54 -1.940 3.627 -2.956 1.00 0.00 C ATOM 0 H VAL A 54 -1.353 4.256 -6.202 1.00 0.00 H new ATOM 0 HA VAL A 54 0.018 2.411 -4.352 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.945 3.001 -4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.344 1.301 -2.994 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.612 0.596 -4.454 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.614 0.884 -3.009 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.846 3.635 -2.351 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.096 3.314 -2.341 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.754 4.628 -3.345 1.00 0.00 H new ATOM 772 N PHE A 55 -0.095 0.544 -5.977 1.00 0.00 N ATOM 773 CA PHE A 55 -0.121 -0.565 -6.923 1.00 0.00 C ATOM 774 C PHE A 55 -0.661 -1.830 -6.264 1.00 0.00 C ATOM 775 O PHE A 55 -0.072 -2.350 -5.316 1.00 0.00 O ATOM 776 CB PHE A 55 1.282 -0.824 -7.476 1.00 0.00 C ATOM 777 CG PHE A 55 1.980 0.420 -7.947 1.00 0.00 C ATOM 778 CD1 PHE A 55 2.459 1.348 -7.037 1.00 0.00 C ATOM 779 CD2 PHE A 55 2.156 0.661 -9.300 1.00 0.00 C ATOM 780 CE1 PHE A 55 3.102 2.494 -7.467 1.00 0.00 C ATOM 781 CE2 PHE A 55 2.798 1.805 -9.736 1.00 0.00 C ATOM 782 CZ PHE A 55 3.271 2.723 -8.818 1.00 0.00 C ATOM 0 H PHE A 55 0.652 0.490 -5.285 1.00 0.00 H new ATOM 0 HA PHE A 55 -0.784 -0.293 -7.744 1.00 0.00 H new ATOM 0 HB2 PHE A 55 1.886 -1.300 -6.703 1.00 0.00 H new ATOM 0 HB3 PHE A 55 1.213 -1.528 -8.305 1.00 0.00 H new ATOM 0 HD1 PHE A 55 2.329 1.174 -5.979 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.788 -0.053 -10.022 1.00 0.00 H new ATOM 0 HE1 PHE A 55 3.472 3.209 -6.747 1.00 0.00 H new ATOM 0 HE2 PHE A 55 2.930 1.981 -10.793 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.772 3.618 -9.157 1.00 0.00 H new ATOM 792 N TYR A 56 -1.787 -2.320 -6.772 1.00 0.00 N ATOM 793 CA TYR A 56 -2.409 -3.523 -6.231 1.00 0.00 C ATOM 794 C TYR A 56 -2.361 -4.663 -7.243 1.00 0.00 C ATOM 795 O TYR A 56 -2.565 -4.457 -8.440 1.00 0.00 O ATOM 796 CB TYR A 56 -3.859 -3.238 -5.836 1.00 0.00 C ATOM 797 CG TYR A 56 -4.639 -2.489 -6.893 1.00 0.00 C ATOM 798 CD1 TYR A 56 -4.633 -1.100 -6.934 1.00 0.00 C ATOM 799 CD2 TYR A 56 -5.383 -3.170 -7.849 1.00 0.00 C ATOM 800 CE1 TYR A 56 -5.345 -0.412 -7.898 1.00 0.00 C ATOM 801 CE2 TYR A 56 -6.096 -2.490 -8.816 1.00 0.00 C ATOM 802 CZ TYR A 56 -6.074 -1.111 -8.837 1.00 0.00 C ATOM 803 OH TYR A 56 -6.785 -0.430 -9.798 1.00 0.00 O ATOM 0 H TYR A 56 -2.287 -1.903 -7.557 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.850 -3.824 -5.345 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -4.362 -4.182 -5.626 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -3.868 -2.660 -4.912 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -4.063 -0.549 -6.201 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -5.404 -4.250 -7.835 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -5.331 0.668 -7.916 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -6.668 -3.035 -9.552 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.242 -1.071 -10.382 1.00 0.00 H new ATOM 813 N THR A 57 -2.090 -5.869 -6.754 1.00 0.00 N ATOM 814 CA THR A 57 -2.014 -7.044 -7.613 1.00 0.00 C ATOM 815 C THR A 57 -2.194 -8.326 -6.809 1.00 0.00 C ATOM 816 O THR A 57 -1.525 -8.536 -5.797 1.00 0.00 O ATOM 817 CB THR A 57 -0.670 -7.105 -8.363 1.00 0.00 C ATOM 818 OG1 THR A 57 -0.407 -8.447 -8.788 1.00 0.00 O ATOM 819 CG2 THR A 57 0.466 -6.617 -7.478 1.00 0.00 C ATOM 0 H THR A 57 -1.919 -6.058 -5.766 1.00 0.00 H new ATOM 0 HA THR A 57 -2.823 -6.958 -8.339 1.00 0.00 H new ATOM 0 HB THR A 57 -0.736 -6.454 -9.235 1.00 0.00 H new ATOM 0 HG1 THR A 57 0.560 -8.580 -8.871 1.00 0.00 H new ATOM 0 HG21 THR A 57 1.405 -6.669 -8.029 1.00 0.00 H new ATOM 0 HG22 THR A 57 0.277 -5.586 -7.179 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.531 -7.246 -6.590 1.00 0.00 H new ATOM 827 N LYS A 58 -3.100 -9.183 -7.266 1.00 0.00 N ATOM 828 CA LYS A 58 -3.367 -10.448 -6.590 1.00 0.00 C ATOM 829 C LYS A 58 -2.069 -11.194 -6.299 1.00 0.00 C ATOM 830 O LYS A 58 -1.147 -11.194 -7.115 1.00 0.00 O ATOM 831 CB LYS A 58 -4.289 -11.321 -7.444 1.00 0.00 C ATOM 832 CG LYS A 58 -4.841 -12.527 -6.704 1.00 0.00 C ATOM 833 CD LYS A 58 -6.049 -13.114 -7.416 1.00 0.00 C ATOM 834 CE LYS A 58 -5.651 -13.803 -8.712 1.00 0.00 C ATOM 835 NZ LYS A 58 -5.150 -15.185 -8.474 1.00 0.00 N ATOM 0 H LYS A 58 -3.662 -9.025 -8.102 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.859 -10.228 -5.643 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.120 -10.714 -7.803 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.741 -11.663 -8.322 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.065 -13.287 -6.616 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.120 -12.237 -5.691 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.547 -13.829 -6.761 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.767 -12.322 -7.629 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.509 -13.838 -9.383 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.879 -13.218 -9.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.889 -15.621 -9.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.316 -15.150 -7.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.895 -15.751 -8.020 1.00 0.00 H new ATOM 849 N GLU A 59 -2.005 -11.829 -5.133 1.00 0.00 N ATOM 850 CA GLU A 59 -0.819 -12.579 -4.737 1.00 0.00 C ATOM 851 C GLU A 59 -0.349 -13.490 -5.867 1.00 0.00 C ATOM 852 O GLU A 59 -1.084 -14.367 -6.318 1.00 0.00 O ATOM 853 CB GLU A 59 -1.109 -13.409 -3.484 1.00 0.00 C ATOM 854 CG GLU A 59 0.112 -13.635 -2.608 1.00 0.00 C ATOM 855 CD GLU A 59 -0.182 -14.527 -1.417 1.00 0.00 C ATOM 856 OE1 GLU A 59 -0.970 -14.111 -0.543 1.00 0.00 O ATOM 857 OE2 GLU A 59 0.378 -15.642 -1.361 1.00 0.00 O ATOM 0 H GLU A 59 -2.760 -11.839 -4.447 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.025 -11.865 -4.516 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.879 -12.909 -2.897 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -1.514 -14.375 -3.784 1.00 0.00 H new ATOM 0 HG2 GLU A 59 0.906 -14.083 -3.206 1.00 0.00 H new ATOM 0 HG3 GLU A 59 0.484 -12.673 -2.254 1.00 0.00 H new ATOM 864 N GLY A 60 0.883 -13.275 -6.319 1.00 0.00 N ATOM 865 CA GLY A 60 1.431 -14.083 -7.393 1.00 0.00 C ATOM 866 C GLY A 60 1.385 -13.375 -8.732 1.00 0.00 C ATOM 867 O GLY A 60 2.345 -13.427 -9.502 1.00 0.00 O ATOM 0 H GLY A 60 1.511 -12.556 -5.961 1.00 0.00 H new ATOM 0 HA2 GLY A 60 2.463 -14.343 -7.158 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.875 -15.018 -7.460 1.00 0.00 H new ATOM 871 N ILE A 61 0.267 -12.714 -9.013 1.00 0.00 N ATOM 872 CA ILE A 61 0.101 -11.994 -10.269 1.00 0.00 C ATOM 873 C ILE A 61 1.092 -10.840 -10.377 1.00 0.00 C ATOM 874 O ILE A 61 1.338 -10.127 -9.405 1.00 0.00 O ATOM 875 CB ILE A 61 -1.329 -11.442 -10.416 1.00 0.00 C ATOM 876 CG1 ILE A 61 -2.355 -12.551 -10.172 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.521 -10.830 -11.796 1.00 0.00 C ATOM 878 CD1 ILE A 61 -2.161 -13.760 -11.061 1.00 0.00 C ATOM 0 H ILE A 61 -0.537 -12.662 -8.388 1.00 0.00 H new ATOM 0 HA ILE A 61 0.291 -12.709 -11.070 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.480 -10.662 -9.670 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -2.299 -12.864 -9.129 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.356 -12.150 -10.331 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.537 -10.444 -11.885 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.810 -10.016 -11.935 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.354 -11.591 -12.558 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.923 -14.505 -10.833 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.247 -13.461 -12.106 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.173 -14.186 -10.886 1.00 0.00 H new ATOM 890 N ALA A 62 1.657 -10.662 -11.566 1.00 0.00 N ATOM 891 CA ALA A 62 2.619 -9.592 -11.803 1.00 0.00 C ATOM 892 C ALA A 62 1.923 -8.326 -12.289 1.00 0.00 C ATOM 893 O ALA A 62 2.396 -7.215 -12.049 1.00 0.00 O ATOM 894 CB ALA A 62 3.669 -10.039 -12.809 1.00 0.00 C ATOM 0 H ALA A 62 1.465 -11.245 -12.381 1.00 0.00 H new ATOM 0 HA ALA A 62 3.112 -9.364 -10.858 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.380 -9.230 -12.976 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.196 -10.911 -12.422 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.184 -10.296 -13.751 1.00 0.00 H new ATOM 900 N ARG A 63 0.797 -8.500 -12.974 1.00 0.00 N ATOM 901 CA ARG A 63 0.037 -7.371 -13.496 1.00 0.00 C ATOM 902 C ARG A 63 -0.604 -6.577 -12.361 1.00 0.00 C ATOM 903 O ARG A 63 -1.554 -7.037 -11.729 1.00 0.00 O ATOM 904 CB ARG A 63 -1.042 -7.859 -14.464 1.00 0.00 C ATOM 905 CG ARG A 63 -2.234 -6.921 -14.571 1.00 0.00 C ATOM 906 CD ARG A 63 -3.182 -7.350 -15.679 1.00 0.00 C ATOM 907 NE ARG A 63 -4.205 -8.274 -15.197 1.00 0.00 N ATOM 908 CZ ARG A 63 -4.974 -9.004 -15.998 1.00 0.00 C ATOM 909 NH1 ARG A 63 -4.835 -8.917 -17.314 1.00 0.00 N ATOM 910 NH2 ARG A 63 -5.882 -9.822 -15.484 1.00 0.00 N ATOM 0 H ARG A 63 0.391 -9.413 -13.180 1.00 0.00 H new ATOM 0 HA ARG A 63 0.726 -6.717 -14.031 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.601 -7.986 -15.453 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.390 -8.840 -14.142 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.768 -6.900 -13.621 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -1.884 -5.907 -14.762 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.661 -6.470 -16.107 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.613 -7.824 -16.479 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.337 -8.364 -14.190 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.137 -8.289 -17.713 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.426 -9.478 -17.927 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.991 -9.892 -14.472 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.471 -10.382 -16.100 1.00 0.00 H new ATOM 924 N GLU A 64 -0.078 -5.382 -12.110 1.00 0.00 N ATOM 925 CA GLU A 64 -0.598 -4.526 -11.051 1.00 0.00 C ATOM 926 C GLU A 64 -1.057 -3.183 -11.614 1.00 0.00 C ATOM 927 O GLU A 64 -0.491 -2.679 -12.584 1.00 0.00 O ATOM 928 CB GLU A 64 0.466 -4.303 -9.975 1.00 0.00 C ATOM 929 CG GLU A 64 1.443 -3.188 -10.307 1.00 0.00 C ATOM 930 CD GLU A 64 2.240 -3.465 -11.566 1.00 0.00 C ATOM 931 OE1 GLU A 64 3.149 -4.320 -11.518 1.00 0.00 O ATOM 932 OE2 GLU A 64 1.955 -2.826 -12.601 1.00 0.00 O ATOM 0 H GLU A 64 0.708 -4.985 -12.626 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.457 -5.026 -10.603 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.027 -4.073 -9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.021 -5.229 -9.828 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.895 -2.254 -10.427 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.128 -3.050 -9.471 1.00 0.00 H new ATOM 939 N ARG A 65 -2.086 -2.611 -10.998 1.00 0.00 N ATOM 940 CA ARG A 65 -2.623 -1.329 -11.437 1.00 0.00 C ATOM 941 C ARG A 65 -2.330 -0.237 -10.412 1.00 0.00 C ATOM 942 O ARG A 65 -2.443 -0.456 -9.206 1.00 0.00 O ATOM 943 CB ARG A 65 -4.131 -1.435 -11.668 1.00 0.00 C ATOM 944 CG ARG A 65 -4.514 -2.439 -12.743 1.00 0.00 C ATOM 945 CD ARG A 65 -5.962 -2.269 -13.174 1.00 0.00 C ATOM 946 NE ARG A 65 -6.382 -3.311 -14.107 1.00 0.00 N ATOM 947 CZ ARG A 65 -6.667 -4.555 -13.739 1.00 0.00 C ATOM 948 NH1 ARG A 65 -6.578 -4.910 -12.465 1.00 0.00 N ATOM 949 NH2 ARG A 65 -7.042 -5.447 -14.647 1.00 0.00 N ATOM 0 H ARG A 65 -2.565 -3.015 -10.193 1.00 0.00 H new ATOM 0 HA ARG A 65 -2.137 -1.063 -12.376 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.614 -1.715 -10.732 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -4.517 -0.454 -11.945 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -3.860 -2.317 -13.606 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -4.361 -3.451 -12.368 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.606 -2.288 -12.295 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.089 -1.292 -13.641 1.00 0.00 H new ATOM 0 HE ARG A 65 -6.461 -3.070 -15.095 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.290 -4.227 -11.764 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.798 -5.866 -12.185 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -7.112 -5.178 -15.628 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -7.261 -6.402 -14.364 1.00 0.00 H new ATOM 963 N VAL A 66 -1.951 0.940 -10.901 1.00 0.00 N ATOM 964 CA VAL A 66 -1.643 2.066 -10.028 1.00 0.00 C ATOM 965 C VAL A 66 -2.848 2.986 -9.871 1.00 0.00 C ATOM 966 O VAL A 66 -3.582 3.233 -10.827 1.00 0.00 O ATOM 967 CB VAL A 66 -0.453 2.884 -10.567 1.00 0.00 C ATOM 968 CG1 VAL A 66 -0.893 3.767 -11.725 1.00 0.00 C ATOM 969 CG2 VAL A 66 0.166 3.718 -9.455 1.00 0.00 C ATOM 0 H VAL A 66 -1.850 1.138 -11.897 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.379 1.650 -9.056 1.00 0.00 H new ATOM 0 HB VAL A 66 0.304 2.192 -10.936 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.040 4.337 -12.093 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.287 3.144 -12.528 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.668 4.453 -11.385 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.005 4.289 -9.853 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.582 4.402 -9.054 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.519 3.061 -8.661 1.00 0.00 H new ATOM 979 N GLU A 67 -3.045 3.492 -8.657 1.00 0.00 N ATOM 980 CA GLU A 67 -4.163 4.385 -8.375 1.00 0.00 C ATOM 981 C GLU A 67 -3.674 5.685 -7.743 1.00 0.00 C ATOM 982 O GLU A 67 -3.330 5.723 -6.563 1.00 0.00 O ATOM 983 CB GLU A 67 -5.169 3.701 -7.447 1.00 0.00 C ATOM 984 CG GLU A 67 -6.595 4.193 -7.627 1.00 0.00 C ATOM 985 CD GLU A 67 -7.313 3.497 -8.767 1.00 0.00 C ATOM 986 OE1 GLU A 67 -6.624 2.950 -9.654 1.00 0.00 O ATOM 987 OE2 GLU A 67 -8.561 3.500 -8.774 1.00 0.00 O ATOM 0 H GLU A 67 -2.446 3.299 -7.854 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.653 4.622 -9.319 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.140 2.626 -7.623 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.865 3.863 -6.413 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.150 4.034 -6.702 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.584 5.267 -7.811 1.00 0.00 H new ATOM 994 N ASN A 68 -3.646 6.749 -8.540 1.00 0.00 N ATOM 995 CA ASN A 68 -3.198 8.051 -8.060 1.00 0.00 C ATOM 996 C ASN A 68 -4.241 8.681 -7.141 1.00 0.00 C ATOM 997 O ASN A 68 -5.407 8.824 -7.512 1.00 0.00 O ATOM 998 CB ASN A 68 -2.914 8.983 -9.240 1.00 0.00 C ATOM 999 CG ASN A 68 -2.312 8.249 -10.423 1.00 0.00 C ATOM 1000 OD1 ASN A 68 -2.822 8.327 -11.541 1.00 0.00 O ATOM 1001 ND2 ASN A 68 -1.221 7.532 -10.182 1.00 0.00 N ATOM 0 H ASN A 68 -3.928 6.735 -9.520 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.280 7.904 -7.492 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.841 9.467 -9.549 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.233 9.772 -8.921 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -0.771 7.017 -10.939 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -0.832 7.496 -9.240 1.00 0.00 H new ATOM 1008 N THR A 69 -3.814 9.056 -5.940 1.00 0.00 N ATOM 1009 CA THR A 69 -4.710 9.670 -4.967 1.00 0.00 C ATOM 1010 C THR A 69 -5.480 10.831 -5.585 1.00 0.00 C ATOM 1011 O THR A 69 -4.887 11.750 -6.151 1.00 0.00 O ATOM 1012 CB THR A 69 -3.938 10.177 -3.735 1.00 0.00 C ATOM 1013 OG1 THR A 69 -2.978 11.164 -4.130 1.00 0.00 O ATOM 1014 CG2 THR A 69 -3.233 9.030 -3.028 1.00 0.00 C ATOM 0 H THR A 69 -2.853 8.945 -5.617 1.00 0.00 H new ATOM 0 HA THR A 69 -5.413 8.898 -4.653 1.00 0.00 H new ATOM 0 HB THR A 69 -4.653 10.623 -3.044 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.328 12.058 -3.933 1.00 0.00 H new ATOM 0 HG21 THR A 69 -2.695 9.413 -2.161 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.970 8.296 -2.702 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.529 8.558 -3.713 1.00 0.00 H new ATOM 1022 N SER A 70 -6.803 10.785 -5.473 1.00 0.00 N ATOM 1023 CA SER A 70 -7.654 11.833 -6.024 1.00 0.00 C ATOM 1024 C SER A 70 -7.025 13.208 -5.818 1.00 0.00 C ATOM 1025 O SER A 70 -7.262 14.134 -6.594 1.00 0.00 O ATOM 1026 CB SER A 70 -9.038 11.790 -5.373 1.00 0.00 C ATOM 1027 OG SER A 70 -9.831 12.889 -5.787 1.00 0.00 O ATOM 0 H SER A 70 -7.309 10.033 -5.006 1.00 0.00 H new ATOM 0 HA SER A 70 -7.758 11.657 -7.095 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.538 10.858 -5.635 1.00 0.00 H new ATOM 0 HB3 SER A 70 -8.933 11.801 -4.288 1.00 0.00 H new ATOM 0 HG SER A 70 -10.711 12.838 -5.358 1.00 0.00 H new ATOM 1033 N HIS A 71 -6.222 13.333 -4.767 1.00 0.00 N ATOM 1034 CA HIS A 71 -5.557 14.594 -4.458 1.00 0.00 C ATOM 1035 C HIS A 71 -4.162 14.348 -3.893 1.00 0.00 C ATOM 1036 O HIS A 71 -3.919 13.381 -3.170 1.00 0.00 O ATOM 1037 CB HIS A 71 -6.389 15.402 -3.462 1.00 0.00 C ATOM 1038 CG HIS A 71 -7.799 15.635 -3.908 1.00 0.00 C ATOM 1039 ND1 HIS A 71 -8.198 16.769 -4.582 1.00 0.00 N ATOM 1040 CD2 HIS A 71 -8.908 14.869 -3.775 1.00 0.00 C ATOM 1041 CE1 HIS A 71 -9.491 16.693 -4.843 1.00 0.00 C ATOM 1042 NE2 HIS A 71 -9.945 15.549 -4.364 1.00 0.00 N ATOM 0 H HIS A 71 -6.016 12.577 -4.115 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.459 15.162 -5.383 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.401 14.881 -2.505 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.906 16.365 -3.295 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.966 13.903 -3.295 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.077 17.439 -5.360 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -10.910 15.223 -4.422 1.00 0.00 H new ATOM 1051 N PRO A 72 -3.220 15.243 -4.229 1.00 0.00 N ATOM 1052 CA PRO A 72 -1.833 15.144 -3.766 1.00 0.00 C ATOM 1053 C PRO A 72 -1.700 15.419 -2.272 1.00 0.00 C ATOM 1054 O PRO A 72 -2.285 16.367 -1.750 1.00 0.00 O ATOM 1055 CB PRO A 72 -1.111 16.225 -4.575 1.00 0.00 C ATOM 1056 CG PRO A 72 -2.172 17.213 -4.917 1.00 0.00 C ATOM 1057 CD PRO A 72 -3.438 16.420 -5.086 1.00 0.00 C ATOM 0 HA PRO A 72 -1.426 14.143 -3.908 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.312 16.687 -3.995 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.653 15.809 -5.472 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -2.280 17.958 -4.128 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.924 17.751 -5.832 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.313 16.989 -4.772 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -3.598 16.136 -6.126 1.00 0.00 H new ATOM 1065 N GLY A 73 -0.925 14.582 -1.587 1.00 0.00 N ATOM 1066 CA GLY A 73 -0.729 14.753 -0.160 1.00 0.00 C ATOM 1067 C GLY A 73 -1.638 13.860 0.661 1.00 0.00 C ATOM 1068 O GLY A 73 -1.392 13.634 1.845 1.00 0.00 O ATOM 0 H GLY A 73 -0.430 13.789 -1.996 1.00 0.00 H new ATOM 0 HA2 GLY A 73 0.310 14.537 0.089 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -0.910 15.794 0.106 1.00 0.00 H new ATOM 1072 N GLU A 74 -2.693 13.352 0.031 1.00 0.00 N ATOM 1073 CA GLU A 74 -3.643 12.481 0.713 1.00 0.00 C ATOM 1074 C GLU A 74 -2.930 11.295 1.356 1.00 0.00 C ATOM 1075 O GLU A 74 -2.385 10.436 0.664 1.00 0.00 O ATOM 1076 CB GLU A 74 -4.705 11.980 -0.269 1.00 0.00 C ATOM 1077 CG GLU A 74 -6.029 11.635 0.391 1.00 0.00 C ATOM 1078 CD GLU A 74 -7.054 11.110 -0.596 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -6.659 10.375 -1.525 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -8.249 11.434 -0.440 1.00 0.00 O ATOM 0 H GLU A 74 -2.911 13.529 -0.950 1.00 0.00 H new ATOM 0 HA GLU A 74 -4.128 13.060 1.499 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -4.875 12.744 -1.028 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -4.324 11.098 -0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -5.860 10.887 1.166 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.427 12.522 0.885 1.00 0.00 H new ATOM 1087 N MET A 75 -2.937 11.257 2.684 1.00 0.00 N ATOM 1088 CA MET A 75 -2.292 10.177 3.421 1.00 0.00 C ATOM 1089 C MET A 75 -3.164 8.926 3.428 1.00 0.00 C ATOM 1090 O MET A 75 -2.854 7.946 4.105 1.00 0.00 O ATOM 1091 CB MET A 75 -1.997 10.615 4.857 1.00 0.00 C ATOM 1092 CG MET A 75 -0.928 11.691 4.957 1.00 0.00 C ATOM 1093 SD MET A 75 0.732 11.007 5.125 1.00 0.00 S ATOM 1094 CE MET A 75 1.224 10.884 3.407 1.00 0.00 C ATOM 0 H MET A 75 -3.382 11.962 3.272 1.00 0.00 H new ATOM 0 HA MET A 75 -1.353 9.941 2.921 1.00 0.00 H new ATOM 0 HB2 MET A 75 -2.916 10.984 5.312 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.682 9.747 5.436 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.969 12.322 4.069 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.141 12.331 5.813 1.00 0.00 H new ATOM 0 HE1 MET A 75 2.258 10.543 3.348 1.00 0.00 H new ATOM 0 HE2 MET A 75 0.577 10.173 2.893 1.00 0.00 H new ATOM 0 HE3 MET A 75 1.137 11.862 2.933 1.00 0.00 H new ATOM 1104 N GLN A 76 -4.256 8.967 2.670 1.00 0.00 N ATOM 1105 CA GLN A 76 -5.173 7.836 2.591 1.00 0.00 C ATOM 1106 C GLN A 76 -5.788 7.731 1.199 1.00 0.00 C ATOM 1107 O GLN A 76 -5.984 8.738 0.518 1.00 0.00 O ATOM 1108 CB GLN A 76 -6.276 7.973 3.641 1.00 0.00 C ATOM 1109 CG GLN A 76 -5.825 8.677 4.910 1.00 0.00 C ATOM 1110 CD GLN A 76 -5.837 10.187 4.776 1.00 0.00 C ATOM 1111 OE1 GLN A 76 -5.871 10.723 3.668 1.00 0.00 O ATOM 1112 NE2 GLN A 76 -5.811 10.883 5.906 1.00 0.00 N ATOM 0 H GLN A 76 -4.527 9.770 2.103 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.606 6.926 2.787 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.112 8.523 3.208 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -6.646 6.981 3.898 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -6.476 8.384 5.734 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.818 8.347 5.166 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.783 10.398 6.803 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.819 11.903 5.877 1.00 0.00 H new ATOM 1121 N VAL A 77 -6.092 6.506 0.783 1.00 0.00 N ATOM 1122 CA VAL A 77 -6.687 6.269 -0.527 1.00 0.00 C ATOM 1123 C VAL A 77 -7.534 5.002 -0.526 1.00 0.00 C ATOM 1124 O VAL A 77 -7.309 4.092 0.274 1.00 0.00 O ATOM 1125 CB VAL A 77 -5.608 6.151 -1.620 1.00 0.00 C ATOM 1126 CG1 VAL A 77 -4.954 4.779 -1.579 1.00 0.00 C ATOM 1127 CG2 VAL A 77 -6.207 6.425 -2.992 1.00 0.00 C ATOM 0 H VAL A 77 -5.936 5.662 1.334 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.323 7.127 -0.745 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.839 6.899 -1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.195 4.714 -2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.489 4.627 -0.605 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.709 4.011 -1.744 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.431 6.337 -3.752 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.997 5.702 -3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.623 7.432 -3.013 1.00 0.00 H new ATOM 1137 N THR A 78 -8.509 4.947 -1.427 1.00 0.00 N ATOM 1138 CA THR A 78 -9.391 3.792 -1.530 1.00 0.00 C ATOM 1139 C THR A 78 -9.226 3.092 -2.874 1.00 0.00 C ATOM 1140 O THR A 78 -9.133 3.743 -3.916 1.00 0.00 O ATOM 1141 CB THR A 78 -10.867 4.194 -1.351 1.00 0.00 C ATOM 1142 OG1 THR A 78 -11.015 5.008 -0.182 1.00 0.00 O ATOM 1143 CG2 THR A 78 -11.753 2.963 -1.233 1.00 0.00 C ATOM 0 H THR A 78 -8.708 5.690 -2.097 1.00 0.00 H new ATOM 0 HA THR A 78 -9.109 3.107 -0.730 1.00 0.00 H new ATOM 0 HB THR A 78 -11.175 4.761 -2.230 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.956 5.261 -0.076 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.791 3.272 -1.107 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.661 2.360 -2.137 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.443 2.373 -0.370 1.00 0.00 H new ATOM 1151 N ILE A 79 -9.192 1.764 -2.844 1.00 0.00 N ATOM 1152 CA ILE A 79 -9.040 0.977 -4.062 1.00 0.00 C ATOM 1153 C ILE A 79 -10.292 0.154 -4.344 1.00 0.00 C ATOM 1154 O ILE A 79 -10.451 -0.950 -3.823 1.00 0.00 O ATOM 1155 CB ILE A 79 -7.827 0.032 -3.974 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -6.618 0.771 -3.397 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -7.501 -0.540 -5.345 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -6.157 1.932 -4.249 1.00 0.00 C ATOM 0 H ILE A 79 -9.268 1.211 -1.990 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.881 1.684 -4.877 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.076 -0.794 -3.308 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.868 1.138 -2.402 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.794 0.067 -3.280 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.642 -1.206 -5.266 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.359 -1.098 -5.720 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.268 0.273 -6.033 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.297 2.409 -3.779 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.875 1.569 -5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.966 2.656 -4.345 1.00 0.00 H new ATOM 1170 N GLN A 80 -11.178 0.698 -5.172 1.00 0.00 N ATOM 1171 CA GLN A 80 -12.416 0.013 -5.524 1.00 0.00 C ATOM 1172 C GLN A 80 -12.203 -0.921 -6.711 1.00 0.00 C ATOM 1173 O GLN A 80 -11.112 -0.983 -7.276 1.00 0.00 O ATOM 1174 CB GLN A 80 -13.511 1.029 -5.850 1.00 0.00 C ATOM 1175 CG GLN A 80 -13.805 1.993 -4.712 1.00 0.00 C ATOM 1176 CD GLN A 80 -14.814 3.058 -5.094 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -15.370 3.037 -6.193 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -15.057 3.997 -4.187 1.00 0.00 N ATOM 0 H GLN A 80 -11.061 1.611 -5.612 1.00 0.00 H new ATOM 0 HA GLN A 80 -12.728 -0.584 -4.667 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.215 1.599 -6.731 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.425 0.495 -6.108 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.180 1.434 -3.855 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -12.878 2.472 -4.399 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.574 3.976 -3.289 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.727 4.739 -4.388 1.00 0.00 H new ATOM 1187 N ASN A 81 -13.252 -1.646 -7.083 1.00 0.00 N ATOM 1188 CA ASN A 81 -13.179 -2.578 -8.203 1.00 0.00 C ATOM 1189 C ASN A 81 -12.289 -3.769 -7.863 1.00 0.00 C ATOM 1190 O ASN A 81 -11.490 -4.216 -8.687 1.00 0.00 O ATOM 1191 CB ASN A 81 -12.647 -1.868 -9.450 1.00 0.00 C ATOM 1192 CG ASN A 81 -13.144 -0.439 -9.559 1.00 0.00 C ATOM 1193 OD1 ASN A 81 -12.369 0.510 -9.436 1.00 0.00 O ATOM 1194 ND2 ASN A 81 -14.442 -0.280 -9.789 1.00 0.00 N ATOM 0 H ASN A 81 -14.163 -1.607 -6.626 1.00 0.00 H new ATOM 0 HA ASN A 81 -14.185 -2.946 -8.404 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.557 -1.870 -9.429 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -12.949 -2.424 -10.338 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -14.834 0.658 -9.871 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -15.047 -1.096 -9.884 1.00 0.00 H new ATOM 1201 N LEU A 82 -12.432 -4.278 -6.644 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.641 -5.418 -6.194 1.00 0.00 C ATOM 1203 C LEU A 82 -12.525 -6.642 -5.976 1.00 0.00 C ATOM 1204 O LEU A 82 -13.750 -6.536 -5.939 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.901 -5.072 -4.900 1.00 0.00 C ATOM 1206 CG LEU A 82 -9.922 -3.900 -4.980 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -9.251 -3.673 -3.634 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -8.882 -4.147 -6.062 1.00 0.00 C ATOM 0 H LEU A 82 -13.088 -3.919 -5.950 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.913 -5.652 -6.970 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.640 -4.850 -4.130 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.353 -5.955 -4.571 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.481 -3.001 -5.240 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.558 -2.835 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -10.009 -3.450 -2.883 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.705 -4.571 -3.344 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.194 -3.303 -6.105 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.327 -5.056 -5.832 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.379 -4.259 -7.026 1.00 0.00 H new ATOM 1220 N MET A 83 -11.894 -7.802 -5.829 1.00 0.00 N ATOM 1221 CA MET A 83 -12.624 -9.046 -5.611 1.00 0.00 C ATOM 1222 C MET A 83 -12.590 -9.445 -4.139 1.00 0.00 C ATOM 1223 O MET A 83 -11.556 -9.370 -3.474 1.00 0.00 O ATOM 1224 CB MET A 83 -12.033 -10.166 -6.468 1.00 0.00 C ATOM 1225 CG MET A 83 -12.683 -11.520 -6.232 1.00 0.00 C ATOM 1226 SD MET A 83 -11.834 -12.858 -7.093 1.00 0.00 S ATOM 1227 CE MET A 83 -12.406 -12.596 -8.770 1.00 0.00 C ATOM 0 H MET A 83 -10.880 -7.907 -5.857 1.00 0.00 H new ATOM 0 HA MET A 83 -13.662 -8.885 -5.902 1.00 0.00 H new ATOM 0 HB2 MET A 83 -12.137 -9.901 -7.520 1.00 0.00 H new ATOM 0 HB3 MET A 83 -10.965 -10.244 -6.263 1.00 0.00 H new ATOM 0 HG2 MET A 83 -12.695 -11.731 -5.163 1.00 0.00 H new ATOM 0 HG3 MET A 83 -13.721 -11.483 -6.561 1.00 0.00 H new ATOM 0 HE1 MET A 83 -11.967 -13.348 -9.426 1.00 0.00 H new ATOM 0 HE2 MET A 83 -13.492 -12.678 -8.801 1.00 0.00 H new ATOM 0 HE3 MET A 83 -12.107 -11.603 -9.105 1.00 0.00 H new ATOM 1237 N PRO A 84 -13.747 -9.878 -3.615 1.00 0.00 N ATOM 1238 CA PRO A 84 -13.875 -10.297 -2.217 1.00 0.00 C ATOM 1239 C PRO A 84 -13.144 -11.605 -1.934 1.00 0.00 C ATOM 1240 O PRO A 84 -12.936 -12.418 -2.835 1.00 0.00 O ATOM 1241 CB PRO A 84 -15.384 -10.479 -2.037 1.00 0.00 C ATOM 1242 CG PRO A 84 -15.896 -10.768 -3.406 1.00 0.00 C ATOM 1243 CD PRO A 84 -15.018 -9.993 -4.349 1.00 0.00 C ATOM 0 HA PRO A 84 -13.435 -9.571 -1.533 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -15.605 -11.296 -1.351 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.845 -9.582 -1.623 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -15.853 -11.836 -3.621 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -16.938 -10.465 -3.505 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -14.889 -10.514 -5.297 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.440 -9.014 -4.578 1.00 0.00 H new ATOM 1251 N ALA A 85 -12.756 -11.802 -0.678 1.00 0.00 N ATOM 1252 CA ALA A 85 -12.050 -13.013 -0.278 1.00 0.00 C ATOM 1253 C ALA A 85 -10.878 -13.299 -1.210 1.00 0.00 C ATOM 1254 O ALA A 85 -10.627 -14.448 -1.576 1.00 0.00 O ATOM 1255 CB ALA A 85 -13.006 -14.196 -0.250 1.00 0.00 C ATOM 0 H ALA A 85 -12.919 -11.139 0.080 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.652 -12.857 0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -12.465 -15.094 0.050 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.807 -14.000 0.462 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.431 -14.344 -1.243 1.00 0.00 H new ATOM 1261 N THR A 86 -10.161 -12.247 -1.592 1.00 0.00 N ATOM 1262 CA THR A 86 -9.016 -12.385 -2.483 1.00 0.00 C ATOM 1263 C THR A 86 -7.838 -11.546 -2.000 1.00 0.00 C ATOM 1264 O THR A 86 -7.966 -10.339 -1.794 1.00 0.00 O ATOM 1265 CB THR A 86 -9.371 -11.969 -3.923 1.00 0.00 C ATOM 1266 OG1 THR A 86 -10.547 -12.661 -4.357 1.00 0.00 O ATOM 1267 CG2 THR A 86 -8.221 -12.268 -4.872 1.00 0.00 C ATOM 0 H THR A 86 -10.353 -11.289 -1.298 1.00 0.00 H new ATOM 0 HA THR A 86 -8.736 -13.438 -2.475 1.00 0.00 H new ATOM 0 HB THR A 86 -9.558 -10.895 -3.932 1.00 0.00 H new ATOM 0 HG1 THR A 86 -10.544 -12.730 -5.335 1.00 0.00 H new ATOM 0 HG21 THR A 86 -8.495 -11.966 -5.883 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.336 -11.716 -4.556 1.00 0.00 H new ATOM 0 HG23 THR A 86 -8.007 -13.337 -4.859 1.00 0.00 H new ATOM 1275 N VAL A 87 -6.691 -12.192 -1.821 1.00 0.00 N ATOM 1276 CA VAL A 87 -5.489 -11.505 -1.363 1.00 0.00 C ATOM 1277 C VAL A 87 -4.976 -10.533 -2.420 1.00 0.00 C ATOM 1278 O VAL A 87 -5.004 -10.827 -3.615 1.00 0.00 O ATOM 1279 CB VAL A 87 -4.370 -12.503 -1.013 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -3.208 -11.789 -0.340 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -4.908 -13.617 -0.127 1.00 0.00 C ATOM 0 H VAL A 87 -6.568 -13.191 -1.986 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.764 -10.951 -0.466 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.003 -12.950 -1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.427 -12.511 -0.100 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.807 -11.031 -1.013 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.555 -11.313 0.577 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -4.104 -14.313 0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.303 -13.190 0.795 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.703 -14.147 -0.651 1.00 0.00 H new ATOM 1291 N TYR A 88 -4.507 -9.374 -1.972 1.00 0.00 N ATOM 1292 CA TYR A 88 -3.989 -8.357 -2.879 1.00 0.00 C ATOM 1293 C TYR A 88 -2.791 -7.639 -2.265 1.00 0.00 C ATOM 1294 O TYR A 88 -2.834 -7.210 -1.111 1.00 0.00 O ATOM 1295 CB TYR A 88 -5.083 -7.344 -3.222 1.00 0.00 C ATOM 1296 CG TYR A 88 -6.109 -7.870 -4.201 1.00 0.00 C ATOM 1297 CD1 TYR A 88 -5.787 -8.065 -5.538 1.00 0.00 C ATOM 1298 CD2 TYR A 88 -7.400 -8.173 -3.787 1.00 0.00 C ATOM 1299 CE1 TYR A 88 -6.721 -8.545 -6.435 1.00 0.00 C ATOM 1300 CE2 TYR A 88 -8.341 -8.654 -4.677 1.00 0.00 C ATOM 1301 CZ TYR A 88 -7.997 -8.838 -6.000 1.00 0.00 C ATOM 1302 OH TYR A 88 -8.930 -9.317 -6.891 1.00 0.00 O ATOM 0 H TYR A 88 -4.475 -9.115 -0.986 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.663 -8.854 -3.793 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.589 -7.043 -2.305 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -4.621 -6.449 -3.639 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -4.789 -7.837 -5.882 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -7.673 -8.030 -2.752 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -6.454 -8.690 -7.471 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.340 -8.885 -4.339 1.00 0.00 H new ATOM 0 HH TYR A 88 -8.478 -9.826 -7.596 1.00 0.00 H new ATOM 1312 N ILE A 89 -1.722 -7.512 -3.045 1.00 0.00 N ATOM 1313 CA ILE A 89 -0.513 -6.845 -2.579 1.00 0.00 C ATOM 1314 C ILE A 89 -0.541 -5.358 -2.915 1.00 0.00 C ATOM 1315 O ILE A 89 -0.357 -4.967 -4.068 1.00 0.00 O ATOM 1316 CB ILE A 89 0.750 -7.475 -3.196 1.00 0.00 C ATOM 1317 CG1 ILE A 89 0.561 -8.983 -3.371 1.00 0.00 C ATOM 1318 CG2 ILE A 89 1.965 -7.184 -2.328 1.00 0.00 C ATOM 1319 CD1 ILE A 89 0.164 -9.693 -2.096 1.00 0.00 C ATOM 0 H ILE A 89 -1.669 -7.862 -4.002 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.481 -6.970 -1.497 1.00 0.00 H new ATOM 0 HB ILE A 89 0.916 -7.033 -4.178 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.202 -9.160 -4.129 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.488 -9.416 -3.745 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.850 -7.636 -2.777 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.107 -6.106 -2.251 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.810 -7.601 -1.333 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.047 -10.758 -2.294 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.937 -9.547 -1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.779 -9.286 -1.732 1.00 0.00 H new ATOM 1331 N PHE A 90 -0.772 -4.532 -1.899 1.00 0.00 N ATOM 1332 CA PHE A 90 -0.824 -3.087 -2.086 1.00 0.00 C ATOM 1333 C PHE A 90 0.533 -2.452 -1.797 1.00 0.00 C ATOM 1334 O PHE A 90 1.142 -2.708 -0.758 1.00 0.00 O ATOM 1335 CB PHE A 90 -1.891 -2.472 -1.177 1.00 0.00 C ATOM 1336 CG PHE A 90 -3.291 -2.887 -1.531 1.00 0.00 C ATOM 1337 CD1 PHE A 90 -3.852 -4.025 -0.974 1.00 0.00 C ATOM 1338 CD2 PHE A 90 -4.045 -2.139 -2.420 1.00 0.00 C ATOM 1339 CE1 PHE A 90 -5.139 -4.409 -1.296 1.00 0.00 C ATOM 1340 CE2 PHE A 90 -5.334 -2.518 -2.746 1.00 0.00 C ATOM 1341 CZ PHE A 90 -5.881 -3.655 -2.184 1.00 0.00 C ATOM 0 H PHE A 90 -0.926 -4.839 -0.939 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.084 -2.889 -3.126 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.686 -2.757 -0.145 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.819 -1.386 -1.228 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.276 -4.619 -0.280 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.621 -1.250 -2.863 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.565 -5.298 -0.854 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.913 -1.926 -3.439 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.887 -3.954 -2.438 1.00 0.00 H new ATOM 1351 N ARG A 91 1.001 -1.623 -2.725 1.00 0.00 N ATOM 1352 CA ARG A 91 2.287 -0.953 -2.572 1.00 0.00 C ATOM 1353 C ARG A 91 2.144 0.552 -2.780 1.00 0.00 C ATOM 1354 O ARG A 91 1.756 1.006 -3.857 1.00 0.00 O ATOM 1355 CB ARG A 91 3.304 -1.522 -3.563 1.00 0.00 C ATOM 1356 CG ARG A 91 3.726 -2.948 -3.251 1.00 0.00 C ATOM 1357 CD ARG A 91 4.799 -3.434 -4.213 1.00 0.00 C ATOM 1358 NE ARG A 91 4.373 -3.328 -5.606 1.00 0.00 N ATOM 1359 CZ ARG A 91 5.171 -3.574 -6.639 1.00 0.00 C ATOM 1360 NH1 ARG A 91 6.430 -3.939 -6.437 1.00 0.00 N ATOM 1361 NH2 ARG A 91 4.710 -3.456 -7.878 1.00 0.00 N ATOM 0 H ARG A 91 0.509 -1.399 -3.590 1.00 0.00 H new ATOM 0 HA ARG A 91 2.642 -1.130 -1.557 1.00 0.00 H new ATOM 0 HB2 ARG A 91 2.879 -1.489 -4.566 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.188 -0.884 -3.570 1.00 0.00 H new ATOM 0 HG2 ARG A 91 4.100 -3.003 -2.229 1.00 0.00 H new ATOM 0 HG3 ARG A 91 2.859 -3.606 -3.308 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.708 -2.851 -4.067 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.046 -4.471 -3.987 1.00 0.00 H new ATOM 0 HE ARG A 91 3.410 -3.050 -5.796 1.00 0.00 H new ATOM 0 HH11 ARG A 91 6.788 -4.032 -5.486 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.040 -4.127 -7.232 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.742 -3.176 -8.038 1.00 0.00 H new ATOM 0 HH22 ARG A 91 5.324 -3.645 -8.671 1.00 0.00 H new ATOM 1375 N VAL A 92 2.458 1.321 -1.742 1.00 0.00 N ATOM 1376 CA VAL A 92 2.365 2.774 -1.811 1.00 0.00 C ATOM 1377 C VAL A 92 3.715 3.395 -2.153 1.00 0.00 C ATOM 1378 O VAL A 92 4.757 2.938 -1.683 1.00 0.00 O ATOM 1379 CB VAL A 92 1.860 3.368 -0.483 1.00 0.00 C ATOM 1380 CG1 VAL A 92 1.250 4.743 -0.710 1.00 0.00 C ATOM 1381 CG2 VAL A 92 0.856 2.431 0.171 1.00 0.00 C ATOM 0 H VAL A 92 2.779 0.961 -0.843 1.00 0.00 H new ATOM 0 HA VAL A 92 1.650 3.009 -2.600 1.00 0.00 H new ATOM 0 HB VAL A 92 2.709 3.481 0.191 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.899 5.147 0.240 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.002 5.410 -1.132 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.411 4.659 -1.401 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.509 2.866 1.108 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.007 2.284 -0.497 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.331 1.471 0.371 1.00 0.00 H new ATOM 1391 N MET A 93 3.689 4.441 -2.973 1.00 0.00 N ATOM 1392 CA MET A 93 4.911 5.126 -3.376 1.00 0.00 C ATOM 1393 C MET A 93 4.672 6.626 -3.516 1.00 0.00 C ATOM 1394 O MET A 93 3.566 7.060 -3.838 1.00 0.00 O ATOM 1395 CB MET A 93 5.430 4.555 -4.697 1.00 0.00 C ATOM 1396 CG MET A 93 6.692 5.237 -5.200 1.00 0.00 C ATOM 1397 SD MET A 93 7.554 4.266 -6.451 1.00 0.00 S ATOM 1398 CE MET A 93 6.228 3.958 -7.615 1.00 0.00 C ATOM 0 H MET A 93 2.835 4.832 -3.371 1.00 0.00 H new ATOM 0 HA MET A 93 5.660 4.966 -2.601 1.00 0.00 H new ATOM 0 HB2 MET A 93 5.628 3.491 -4.570 1.00 0.00 H new ATOM 0 HB3 MET A 93 4.651 4.647 -5.454 1.00 0.00 H new ATOM 0 HG2 MET A 93 6.433 6.211 -5.616 1.00 0.00 H new ATOM 0 HG3 MET A 93 7.363 5.417 -4.360 1.00 0.00 H new ATOM 0 HE1 MET A 93 6.630 3.939 -8.628 1.00 0.00 H new ATOM 0 HE2 MET A 93 5.763 2.998 -7.391 1.00 0.00 H new ATOM 0 HE3 MET A 93 5.483 4.749 -7.535 1.00 0.00 H new ATOM 1408 N ALA A 94 5.715 7.412 -3.273 1.00 0.00 N ATOM 1409 CA ALA A 94 5.618 8.863 -3.374 1.00 0.00 C ATOM 1410 C ALA A 94 6.123 9.355 -4.726 1.00 0.00 C ATOM 1411 O ALA A 94 6.953 8.705 -5.362 1.00 0.00 O ATOM 1412 CB ALA A 94 6.398 9.524 -2.246 1.00 0.00 C ATOM 0 H ALA A 94 6.637 7.069 -3.005 1.00 0.00 H new ATOM 0 HA ALA A 94 4.567 9.138 -3.286 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.317 10.607 -2.334 1.00 0.00 H new ATOM 0 HB2 ALA A 94 5.990 9.206 -1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.446 9.232 -2.309 1.00 0.00 H new ATOM 1418 N GLN A 95 5.615 10.504 -5.160 1.00 0.00 N ATOM 1419 CA GLN A 95 6.014 11.080 -6.439 1.00 0.00 C ATOM 1420 C GLN A 95 6.075 12.601 -6.355 1.00 0.00 C ATOM 1421 O GLN A 95 5.106 13.251 -5.966 1.00 0.00 O ATOM 1422 CB GLN A 95 5.038 10.658 -7.539 1.00 0.00 C ATOM 1423 CG GLN A 95 5.447 9.381 -8.257 1.00 0.00 C ATOM 1424 CD GLN A 95 4.256 8.586 -8.756 1.00 0.00 C ATOM 1425 OE1 GLN A 95 3.212 9.149 -9.084 1.00 0.00 O ATOM 1426 NE2 GLN A 95 4.408 7.268 -8.815 1.00 0.00 N ATOM 0 H GLN A 95 4.927 11.054 -4.645 1.00 0.00 H new ATOM 0 HA GLN A 95 7.009 10.707 -6.682 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.049 10.519 -7.102 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.954 11.464 -8.268 1.00 0.00 H new ATOM 0 HG2 GLN A 95 6.090 9.633 -9.100 1.00 0.00 H new ATOM 0 HG3 GLN A 95 6.036 8.761 -7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.291 6.843 -8.533 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.641 6.680 -9.142 1.00 0.00 H new ATOM 1435 N ASN A 96 7.223 13.163 -6.720 1.00 0.00 N ATOM 1436 CA ASN A 96 7.412 14.609 -6.685 1.00 0.00 C ATOM 1437 C ASN A 96 7.824 15.138 -8.055 1.00 0.00 C ATOM 1438 O ASN A 96 7.870 14.391 -9.034 1.00 0.00 O ATOM 1439 CB ASN A 96 8.469 14.981 -5.643 1.00 0.00 C ATOM 1440 CG ASN A 96 9.879 14.705 -6.126 1.00 0.00 C ATOM 1441 OD1 ASN A 96 10.621 15.626 -6.468 1.00 0.00 O ATOM 1442 ND2 ASN A 96 10.255 13.432 -6.157 1.00 0.00 N ATOM 0 H ASN A 96 8.036 12.639 -7.043 1.00 0.00 H new ATOM 0 HA ASN A 96 6.462 15.068 -6.409 1.00 0.00 H new ATOM 0 HB2 ASN A 96 8.374 16.038 -5.394 1.00 0.00 H new ATOM 0 HB3 ASN A 96 8.285 14.420 -4.727 1.00 0.00 H new ATOM 0 HD21 ASN A 96 11.193 13.185 -6.474 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.606 12.701 -5.864 1.00 0.00 H new ATOM 1449 N LYS A 97 8.125 16.430 -8.119 1.00 0.00 N ATOM 1450 CA LYS A 97 8.536 17.060 -9.368 1.00 0.00 C ATOM 1451 C LYS A 97 9.450 16.137 -10.168 1.00 0.00 C ATOM 1452 O LYS A 97 9.484 16.194 -11.398 1.00 0.00 O ATOM 1453 CB LYS A 97 9.252 18.383 -9.085 1.00 0.00 C ATOM 1454 CG LYS A 97 10.413 18.250 -8.114 1.00 0.00 C ATOM 1455 CD LYS A 97 11.010 19.605 -7.771 1.00 0.00 C ATOM 1456 CE LYS A 97 12.142 19.475 -6.763 1.00 0.00 C ATOM 1457 NZ LYS A 97 13.116 20.597 -6.876 1.00 0.00 N ATOM 0 H LYS A 97 8.092 17.062 -7.319 1.00 0.00 H new ATOM 0 HA LYS A 97 7.641 17.257 -9.958 1.00 0.00 H new ATOM 0 HB2 LYS A 97 9.620 18.796 -10.024 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.533 19.097 -8.683 1.00 0.00 H new ATOM 0 HG2 LYS A 97 10.072 17.760 -7.202 1.00 0.00 H new ATOM 0 HG3 LYS A 97 11.182 17.612 -8.550 1.00 0.00 H new ATOM 0 HD2 LYS A 97 11.382 20.080 -8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 97 10.234 20.254 -7.366 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.729 19.452 -5.754 1.00 0.00 H new ATOM 0 HE3 LYS A 97 12.659 18.528 -6.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.872 20.473 -6.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.529 20.604 -7.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 12.628 21.499 -6.704 1.00 0.00 H new ATOM 1471 N HIS A 98 10.187 15.285 -9.463 1.00 0.00 N ATOM 1472 CA HIS A 98 11.100 14.348 -10.108 1.00 0.00 C ATOM 1473 C HIS A 98 10.331 13.199 -10.753 1.00 0.00 C ATOM 1474 O HIS A 98 10.255 13.099 -11.977 1.00 0.00 O ATOM 1475 CB HIS A 98 12.103 13.799 -9.094 1.00 0.00 C ATOM 1476 CG HIS A 98 12.860 14.866 -8.363 1.00 0.00 C ATOM 1477 ND1 HIS A 98 13.384 15.978 -8.987 1.00 0.00 N ATOM 1478 CD2 HIS A 98 13.178 14.986 -7.053 1.00 0.00 C ATOM 1479 CE1 HIS A 98 13.993 16.735 -8.092 1.00 0.00 C ATOM 1480 NE2 HIS A 98 13.882 16.156 -6.910 1.00 0.00 N ATOM 0 H HIS A 98 10.170 15.224 -8.445 1.00 0.00 H new ATOM 0 HA HIS A 98 11.641 14.885 -10.888 1.00 0.00 H new ATOM 0 HB2 HIS A 98 11.573 13.180 -8.370 1.00 0.00 H new ATOM 0 HB3 HIS A 98 12.811 13.151 -9.610 1.00 0.00 H new ATOM 0 HD2 HIS A 98 12.925 14.291 -6.266 1.00 0.00 H new ATOM 0 HE1 HIS A 98 14.496 17.669 -8.293 1.00 0.00 H new ATOM 0 HE2 HIS A 98 14.258 16.519 -6.034 1.00 0.00 H new ATOM 1489 N GLY A 99 9.762 12.332 -9.921 1.00 0.00 N ATOM 1490 CA GLY A 99 9.008 11.201 -10.429 1.00 0.00 C ATOM 1491 C GLY A 99 8.769 10.141 -9.371 1.00 0.00 C ATOM 1492 O GLY A 99 8.562 10.459 -8.200 1.00 0.00 O ATOM 0 H GLY A 99 9.810 12.393 -8.904 1.00 0.00 H new ATOM 0 HA2 GLY A 99 8.049 11.550 -10.812 1.00 0.00 H new ATOM 0 HA3 GLY A 99 9.544 10.758 -11.268 1.00 0.00 H new ATOM 1496 N SER A 100 8.798 8.878 -9.785 1.00 0.00 N ATOM 1497 CA SER A 100 8.577 7.768 -8.865 1.00 0.00 C ATOM 1498 C SER A 100 9.860 7.420 -8.116 1.00 0.00 C ATOM 1499 O SER A 100 10.854 7.016 -8.718 1.00 0.00 O ATOM 1500 CB SER A 100 8.069 6.542 -9.626 1.00 0.00 C ATOM 1501 OG SER A 100 9.043 6.067 -10.538 1.00 0.00 O ATOM 0 H SER A 100 8.972 8.598 -10.750 1.00 0.00 H new ATOM 0 HA SER A 100 7.824 8.074 -8.138 1.00 0.00 H new ATOM 0 HB2 SER A 100 7.812 5.753 -8.920 1.00 0.00 H new ATOM 0 HB3 SER A 100 7.156 6.797 -10.164 1.00 0.00 H new ATOM 0 HG SER A 100 9.939 6.238 -10.179 1.00 0.00 H new ATOM 1507 N GLY A 101 9.830 7.581 -6.797 1.00 0.00 N ATOM 1508 CA GLY A 101 10.995 7.280 -5.986 1.00 0.00 C ATOM 1509 C GLY A 101 11.118 5.802 -5.673 1.00 0.00 C ATOM 1510 O GLY A 101 11.500 5.009 -6.533 1.00 0.00 O ATOM 0 H GLY A 101 9.019 7.915 -6.275 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.892 7.614 -6.507 1.00 0.00 H new ATOM 0 HA3 GLY A 101 10.940 7.842 -5.054 1.00 0.00 H new ATOM 1514 N GLU A 102 10.795 5.431 -4.438 1.00 0.00 N ATOM 1515 CA GLU A 102 10.874 4.038 -4.014 1.00 0.00 C ATOM 1516 C GLU A 102 9.493 3.502 -3.647 1.00 0.00 C ATOM 1517 O GLU A 102 8.698 4.190 -3.006 1.00 0.00 O ATOM 1518 CB GLU A 102 11.821 3.898 -2.821 1.00 0.00 C ATOM 1519 CG GLU A 102 11.992 2.465 -2.344 1.00 0.00 C ATOM 1520 CD GLU A 102 13.317 2.237 -1.644 1.00 0.00 C ATOM 1521 OE1 GLU A 102 13.504 2.781 -0.535 1.00 0.00 O ATOM 1522 OE2 GLU A 102 14.167 1.514 -2.205 1.00 0.00 O ATOM 0 H GLU A 102 10.476 6.075 -3.714 1.00 0.00 H new ATOM 0 HA GLU A 102 11.262 3.453 -4.847 1.00 0.00 H new ATOM 0 HB2 GLU A 102 12.797 4.300 -3.093 1.00 0.00 H new ATOM 0 HB3 GLU A 102 11.445 4.504 -1.997 1.00 0.00 H new ATOM 0 HG2 GLU A 102 11.178 2.213 -1.664 1.00 0.00 H new ATOM 0 HG3 GLU A 102 11.915 1.791 -3.197 1.00 0.00 H new ATOM 1529 N SER A 103 9.215 2.269 -4.058 1.00 0.00 N ATOM 1530 CA SER A 103 7.929 1.641 -3.777 1.00 0.00 C ATOM 1531 C SER A 103 7.916 1.033 -2.377 1.00 0.00 C ATOM 1532 O SER A 103 8.705 0.140 -2.069 1.00 0.00 O ATOM 1533 CB SER A 103 7.627 0.561 -4.817 1.00 0.00 C ATOM 1534 OG SER A 103 8.750 -0.278 -5.023 1.00 0.00 O ATOM 0 H SER A 103 9.863 1.685 -4.587 1.00 0.00 H new ATOM 0 HA SER A 103 7.158 2.410 -3.828 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.778 -0.038 -4.488 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.341 1.029 -5.759 1.00 0.00 H new ATOM 0 HG SER A 103 9.148 -0.511 -4.158 1.00 0.00 H new ATOM 1540 N SER A 104 7.014 1.525 -1.534 1.00 0.00 N ATOM 1541 CA SER A 104 6.899 1.034 -0.166 1.00 0.00 C ATOM 1542 C SER A 104 6.853 -0.491 -0.138 1.00 0.00 C ATOM 1543 O SER A 104 6.755 -1.139 -1.179 1.00 0.00 O ATOM 1544 CB SER A 104 5.646 1.606 0.500 1.00 0.00 C ATOM 1545 OG SER A 104 4.470 1.091 -0.099 1.00 0.00 O ATOM 0 H SER A 104 6.352 2.263 -1.774 1.00 0.00 H new ATOM 0 HA SER A 104 7.778 1.364 0.387 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.653 1.364 1.563 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.652 2.693 0.421 1.00 0.00 H new ATOM 0 HG SER A 104 4.491 1.264 -1.063 1.00 0.00 H new ATOM 1551 N ALA A 105 6.923 -1.056 1.063 1.00 0.00 N ATOM 1552 CA ALA A 105 6.887 -2.504 1.228 1.00 0.00 C ATOM 1553 C ALA A 105 5.533 -3.071 0.815 1.00 0.00 C ATOM 1554 O ALA A 105 4.494 -2.427 0.958 1.00 0.00 O ATOM 1555 CB ALA A 105 7.200 -2.879 2.669 1.00 0.00 C ATOM 0 H ALA A 105 7.005 -0.534 1.935 1.00 0.00 H new ATOM 0 HA ALA A 105 7.647 -2.937 0.577 1.00 0.00 H new ATOM 0 HB1 ALA A 105 7.170 -3.963 2.778 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.193 -2.516 2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.461 -2.427 3.331 1.00 0.00 H new ATOM 1561 N PRO A 106 5.543 -4.305 0.289 1.00 0.00 N ATOM 1562 CA PRO A 106 4.323 -4.985 -0.157 1.00 0.00 C ATOM 1563 C PRO A 106 3.423 -5.382 1.008 1.00 0.00 C ATOM 1564 O PRO A 106 3.800 -6.203 1.845 1.00 0.00 O ATOM 1565 CB PRO A 106 4.853 -6.230 -0.873 1.00 0.00 C ATOM 1566 CG PRO A 106 6.185 -6.483 -0.257 1.00 0.00 C ATOM 1567 CD PRO A 106 6.745 -5.131 0.089 1.00 0.00 C ATOM 0 HA PRO A 106 3.706 -4.345 -0.787 1.00 0.00 H new ATOM 0 HB2 PRO A 106 4.185 -7.080 -0.735 1.00 0.00 H new ATOM 0 HB3 PRO A 106 4.939 -6.063 -1.947 1.00 0.00 H new ATOM 0 HG2 PRO A 106 6.092 -7.106 0.633 1.00 0.00 H new ATOM 0 HG3 PRO A 106 6.841 -7.012 -0.949 1.00 0.00 H new ATOM 0 HD2 PRO A 106 7.361 -5.169 0.988 1.00 0.00 H new ATOM 0 HD3 PRO A 106 7.373 -4.739 -0.711 1.00 0.00 H new ATOM 1575 N LEU A 107 2.232 -4.796 1.055 1.00 0.00 N ATOM 1576 CA LEU A 107 1.276 -5.090 2.118 1.00 0.00 C ATOM 1577 C LEU A 107 0.269 -6.144 1.668 1.00 0.00 C ATOM 1578 O LEU A 107 -0.428 -5.964 0.669 1.00 0.00 O ATOM 1579 CB LEU A 107 0.544 -3.815 2.539 1.00 0.00 C ATOM 1580 CG LEU A 107 -0.551 -3.987 3.592 1.00 0.00 C ATOM 1581 CD1 LEU A 107 0.040 -4.490 4.900 1.00 0.00 C ATOM 1582 CD2 LEU A 107 -1.293 -2.676 3.809 1.00 0.00 C ATOM 0 H LEU A 107 1.905 -4.115 0.370 1.00 0.00 H new ATOM 0 HA LEU A 107 1.828 -5.483 2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.279 -3.107 2.921 1.00 0.00 H new ATOM 0 HB3 LEU A 107 0.099 -3.365 1.651 1.00 0.00 H new ATOM 0 HG LEU A 107 -1.263 -4.729 3.230 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -0.754 -4.606 5.637 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.525 -5.452 4.734 1.00 0.00 H new ATOM 0 HD13 LEU A 107 0.774 -3.773 5.267 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.069 -2.817 4.562 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.592 -1.913 4.149 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -1.750 -2.357 2.872 1.00 0.00 H new ATOM 1594 N ARG A 108 0.196 -7.242 2.414 1.00 0.00 N ATOM 1595 CA ARG A 108 -0.727 -8.323 2.092 1.00 0.00 C ATOM 1596 C ARG A 108 -2.097 -8.073 2.717 1.00 0.00 C ATOM 1597 O ARG A 108 -2.279 -8.232 3.924 1.00 0.00 O ATOM 1598 CB ARG A 108 -0.169 -9.661 2.581 1.00 0.00 C ATOM 1599 CG ARG A 108 -1.065 -10.847 2.266 1.00 0.00 C ATOM 1600 CD ARG A 108 -0.343 -12.166 2.491 1.00 0.00 C ATOM 1601 NE ARG A 108 -0.492 -12.645 3.863 1.00 0.00 N ATOM 1602 CZ ARG A 108 0.279 -12.246 4.868 1.00 0.00 C ATOM 1603 NH1 ARG A 108 1.249 -11.367 4.655 1.00 0.00 N ATOM 1604 NH2 ARG A 108 0.082 -12.727 6.089 1.00 0.00 N ATOM 0 H ARG A 108 0.765 -7.406 3.245 1.00 0.00 H new ATOM 0 HA ARG A 108 -0.842 -8.358 1.009 1.00 0.00 H new ATOM 0 HB2 ARG A 108 0.809 -9.825 2.127 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -0.016 -9.609 3.659 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -1.956 -10.807 2.892 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -1.400 -10.786 1.231 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -0.733 -12.915 1.801 1.00 0.00 H new ATOM 0 HD3 ARG A 108 0.716 -12.043 2.263 1.00 0.00 H new ATOM 0 HE ARG A 108 -1.228 -13.323 4.060 1.00 0.00 H new ATOM 0 HH11 ARG A 108 1.404 -10.996 3.718 1.00 0.00 H new ATOM 0 HH12 ARG A 108 1.840 -11.062 5.429 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -0.662 -13.404 6.256 1.00 0.00 H new ATOM 0 HH22 ARG A 108 0.675 -12.420 6.860 1.00 0.00 H new ATOM 1618 N VAL A 109 -3.057 -7.679 1.886 1.00 0.00 N ATOM 1619 CA VAL A 109 -4.410 -7.407 2.356 1.00 0.00 C ATOM 1620 C VAL A 109 -5.414 -8.366 1.726 1.00 0.00 C ATOM 1621 O VAL A 109 -5.461 -8.516 0.506 1.00 0.00 O ATOM 1622 CB VAL A 109 -4.833 -5.959 2.042 1.00 0.00 C ATOM 1623 CG1 VAL A 109 -6.226 -5.680 2.583 1.00 0.00 C ATOM 1624 CG2 VAL A 109 -3.823 -4.974 2.612 1.00 0.00 C ATOM 0 H VAL A 109 -2.923 -7.541 0.884 1.00 0.00 H new ATOM 0 HA VAL A 109 -4.404 -7.550 3.437 1.00 0.00 H new ATOM 0 HB VAL A 109 -4.858 -5.833 0.960 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -6.507 -4.653 2.352 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -6.939 -6.364 2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -6.232 -5.823 3.664 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.137 -3.956 2.381 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -3.763 -5.099 3.693 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -2.844 -5.160 2.171 1.00 0.00 H new ATOM 1634 N GLU A 110 -6.215 -9.012 2.567 1.00 0.00 N ATOM 1635 CA GLU A 110 -7.218 -9.957 2.092 1.00 0.00 C ATOM 1636 C GLU A 110 -8.627 -9.435 2.359 1.00 0.00 C ATOM 1637 O GLU A 110 -9.000 -9.178 3.505 1.00 0.00 O ATOM 1638 CB GLU A 110 -7.030 -11.317 2.767 1.00 0.00 C ATOM 1639 CG GLU A 110 -8.042 -12.361 2.325 1.00 0.00 C ATOM 1640 CD GLU A 110 -7.982 -13.623 3.164 1.00 0.00 C ATOM 1641 OE1 GLU A 110 -7.910 -13.508 4.405 1.00 0.00 O ATOM 1642 OE2 GLU A 110 -8.007 -14.726 2.578 1.00 0.00 O ATOM 0 H GLU A 110 -6.189 -8.898 3.580 1.00 0.00 H new ATOM 0 HA GLU A 110 -7.090 -10.073 1.016 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -6.026 -11.683 2.554 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -7.100 -11.190 3.847 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -9.045 -11.937 2.384 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -7.864 -12.615 1.280 1.00 0.00 H new ATOM 1649 N THR A 111 -9.407 -9.281 1.294 1.00 0.00 N ATOM 1650 CA THR A 111 -10.774 -8.789 1.412 1.00 0.00 C ATOM 1651 C THR A 111 -11.641 -9.759 2.207 1.00 0.00 C ATOM 1652 O THR A 111 -11.165 -10.797 2.666 1.00 0.00 O ATOM 1653 CB THR A 111 -11.412 -8.565 0.028 1.00 0.00 C ATOM 1654 OG1 THR A 111 -11.041 -9.626 -0.860 1.00 0.00 O ATOM 1655 CG2 THR A 111 -10.976 -7.231 -0.559 1.00 0.00 C ATOM 0 H THR A 111 -9.115 -9.490 0.339 1.00 0.00 H new ATOM 0 HA THR A 111 -10.722 -7.836 1.939 1.00 0.00 H new ATOM 0 HB THR A 111 -12.495 -8.555 0.149 1.00 0.00 H new ATOM 0 HG1 THR A 111 -11.083 -9.308 -1.786 1.00 0.00 H new ATOM 0 HG21 THR A 111 -11.439 -7.095 -1.536 1.00 0.00 H new ATOM 0 HG22 THR A 111 -11.285 -6.423 0.105 1.00 0.00 H new ATOM 0 HG23 THR A 111 -9.891 -7.218 -0.666 1.00 0.00 H new ATOM 1663 N GLN A 112 -12.914 -9.413 2.365 1.00 0.00 N ATOM 1664 CA GLN A 112 -13.847 -10.255 3.106 1.00 0.00 C ATOM 1665 C GLN A 112 -14.815 -10.957 2.160 1.00 0.00 C ATOM 1666 O GLN A 112 -15.193 -10.428 1.114 1.00 0.00 O ATOM 1667 CB GLN A 112 -14.626 -9.418 4.122 1.00 0.00 C ATOM 1668 CG GLN A 112 -13.870 -8.191 4.606 1.00 0.00 C ATOM 1669 CD GLN A 112 -14.247 -7.793 6.020 1.00 0.00 C ATOM 1670 OE1 GLN A 112 -15.063 -8.452 6.666 1.00 0.00 O ATOM 1671 NE2 GLN A 112 -13.654 -6.710 6.509 1.00 0.00 N ATOM 0 H GLN A 112 -13.323 -8.557 1.991 1.00 0.00 H new ATOM 0 HA GLN A 112 -13.271 -11.013 3.636 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -15.568 -9.101 3.674 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -14.876 -10.043 4.980 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -12.799 -8.388 4.561 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -14.069 -7.357 3.933 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -12.984 -6.194 5.939 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -13.869 -6.394 7.455 1.00 0.00 H new ATOM 1680 N PRO A 113 -15.227 -12.178 2.533 1.00 0.00 N ATOM 1681 CA PRO A 113 -16.157 -12.979 1.731 1.00 0.00 C ATOM 1682 C PRO A 113 -17.567 -12.398 1.725 1.00 0.00 C ATOM 1683 O PRO A 113 -18.336 -12.602 2.664 1.00 0.00 O ATOM 1684 CB PRO A 113 -16.143 -14.342 2.429 1.00 0.00 C ATOM 1685 CG PRO A 113 -15.755 -14.043 3.836 1.00 0.00 C ATOM 1686 CD PRO A 113 -14.818 -12.870 3.767 1.00 0.00 C ATOM 0 HA PRO A 113 -15.862 -13.018 0.682 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -17.121 -14.821 2.381 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -15.432 -15.021 1.958 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.631 -13.808 4.441 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.270 -14.903 4.298 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.916 -12.225 4.640 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.777 -13.190 3.722 1.00 0.00 H new ATOM 1694 N GLU A 114 -17.899 -11.673 0.662 1.00 0.00 N ATOM 1695 CA GLU A 114 -19.217 -11.062 0.535 1.00 0.00 C ATOM 1696 C GLU A 114 -20.304 -12.005 1.042 1.00 0.00 C ATOM 1697 O GLU A 114 -20.093 -13.213 1.149 1.00 0.00 O ATOM 1698 CB GLU A 114 -19.492 -10.686 -0.922 1.00 0.00 C ATOM 1699 CG GLU A 114 -18.869 -9.364 -1.337 1.00 0.00 C ATOM 1700 CD GLU A 114 -19.654 -8.668 -2.432 1.00 0.00 C ATOM 1701 OE1 GLU A 114 -20.673 -8.022 -2.112 1.00 0.00 O ATOM 1702 OE2 GLU A 114 -19.248 -8.769 -3.609 1.00 0.00 O ATOM 0 H GLU A 114 -17.274 -11.494 -0.124 1.00 0.00 H new ATOM 0 HA GLU A 114 -19.230 -10.158 1.144 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -19.113 -11.476 -1.570 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -20.570 -10.635 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -18.804 -8.708 -0.469 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -17.850 -9.539 -1.681 1.00 0.00 H new ATOM 1709 N SER A 115 -21.468 -11.444 1.353 1.00 0.00 N ATOM 1710 CA SER A 115 -22.588 -12.233 1.853 1.00 0.00 C ATOM 1711 C SER A 115 -23.081 -13.211 0.791 1.00 0.00 C ATOM 1712 O SER A 115 -23.534 -14.310 1.105 1.00 0.00 O ATOM 1713 CB SER A 115 -23.732 -11.315 2.288 1.00 0.00 C ATOM 1714 OG SER A 115 -24.929 -12.049 2.482 1.00 0.00 O ATOM 0 H SER A 115 -21.660 -10.446 1.268 1.00 0.00 H new ATOM 0 HA SER A 115 -22.242 -12.804 2.715 1.00 0.00 H new ATOM 0 HB2 SER A 115 -23.461 -10.804 3.212 1.00 0.00 H new ATOM 0 HB3 SER A 115 -23.892 -10.545 1.533 1.00 0.00 H new ATOM 0 HG SER A 115 -25.644 -11.440 2.761 1.00 0.00 H new ATOM 1720 N GLY A 116 -22.989 -12.800 -0.471 1.00 0.00 N ATOM 1721 CA GLY A 116 -23.429 -13.650 -1.561 1.00 0.00 C ATOM 1722 C GLY A 116 -24.643 -13.093 -2.277 1.00 0.00 C ATOM 1723 O GLY A 116 -24.991 -11.920 -2.134 1.00 0.00 O ATOM 0 H GLY A 116 -22.618 -11.894 -0.757 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -22.614 -13.771 -2.275 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -23.663 -14.641 -1.173 1.00 0.00 H new ATOM 1727 N PRO A 117 -25.310 -13.944 -3.070 1.00 0.00 N ATOM 1728 CA PRO A 117 -26.502 -13.552 -3.828 1.00 0.00 C ATOM 1729 C PRO A 117 -27.705 -13.297 -2.926 1.00 0.00 C ATOM 1730 O PRO A 117 -28.364 -12.263 -3.032 1.00 0.00 O ATOM 1731 CB PRO A 117 -26.760 -14.759 -4.734 1.00 0.00 C ATOM 1732 CG PRO A 117 -26.147 -15.910 -4.014 1.00 0.00 C ATOM 1733 CD PRO A 117 -24.953 -15.356 -3.288 1.00 0.00 C ATOM 0 HA PRO A 117 -26.351 -12.619 -4.371 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -27.827 -14.914 -4.893 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -26.308 -14.620 -5.716 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -26.856 -16.356 -3.316 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -25.851 -16.693 -4.711 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -24.779 -15.876 -2.346 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -24.043 -15.453 -3.879 1.00 0.00 H new ATOM 1741 N SER A 118 -27.984 -14.245 -2.037 1.00 0.00 N ATOM 1742 CA SER A 118 -29.110 -14.123 -1.118 1.00 0.00 C ATOM 1743 C SER A 118 -29.120 -12.752 -0.450 1.00 0.00 C ATOM 1744 O SER A 118 -28.326 -12.482 0.451 1.00 0.00 O ATOM 1745 CB SER A 118 -29.048 -15.221 -0.054 1.00 0.00 C ATOM 1746 OG SER A 118 -29.174 -16.506 -0.639 1.00 0.00 O ATOM 0 H SER A 118 -27.446 -15.106 -1.934 1.00 0.00 H new ATOM 0 HA SER A 118 -30.030 -14.235 -1.692 1.00 0.00 H new ATOM 0 HB2 SER A 118 -28.104 -15.155 0.486 1.00 0.00 H new ATOM 0 HB3 SER A 118 -29.844 -15.070 0.675 1.00 0.00 H new ATOM 0 HG SER A 118 -29.130 -17.190 0.061 1.00 0.00 H new ATOM 1752 N SER A 119 -30.026 -11.889 -0.898 1.00 0.00 N ATOM 1753 CA SER A 119 -30.138 -10.543 -0.347 1.00 0.00 C ATOM 1754 C SER A 119 -30.414 -10.592 1.153 1.00 0.00 C ATOM 1755 O SER A 119 -29.738 -9.932 1.941 1.00 0.00 O ATOM 1756 CB SER A 119 -31.251 -9.770 -1.057 1.00 0.00 C ATOM 1757 OG SER A 119 -30.834 -9.338 -2.341 1.00 0.00 O ATOM 0 H SER A 119 -30.693 -12.097 -1.641 1.00 0.00 H new ATOM 0 HA SER A 119 -29.190 -10.030 -0.508 1.00 0.00 H new ATOM 0 HB2 SER A 119 -32.134 -10.402 -1.152 1.00 0.00 H new ATOM 0 HB3 SER A 119 -31.540 -8.908 -0.456 1.00 0.00 H new ATOM 0 HG SER A 119 -31.564 -8.848 -2.774 1.00 0.00 H new ATOM 1763 N GLY A 120 -31.414 -11.379 1.539 1.00 0.00 N ATOM 1764 CA GLY A 120 -31.763 -11.500 2.943 1.00 0.00 C ATOM 1765 C GLY A 120 -32.029 -10.156 3.592 1.00 0.00 C ATOM 1766 O GLY A 120 -32.848 -9.376 3.105 1.00 0.00 O ATOM 0 H GLY A 120 -31.988 -11.935 0.905 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -32.648 -12.129 3.041 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -30.954 -12.002 3.473 1.00 0.00 H new TER 1770 GLY A 120