USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 678 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 NoAdj-H: A 109 HIS HD1 : A 109 HIS ND1 : A1001 ZNZN :(H bumps) USER MOD Set 1.1: A 84 SER OG : rot -58:sc= 1.75 USER MOD Set 1.2: A 415 SER OG : rot 180:sc= 1.12 USER MOD Set 2.1: A 108 TYR OH : rot 30:sc= 0.94 USER MOD Set 2.2: A 130 TYR OH : rot 23:sc= 1.09 USER MOD Set 3.1: A 92 GLN : amide:sc= 1.73 K(o=1.5,f=-5.8!) USER MOD Set 3.2: A 93 SER OG : rot 59:sc= -0.185! USER MOD Set 4.1: A 77 TYR OH : rot 180:sc= -0.253 USER MOD Set 4.2: A 88 SER OG : rot 110:sc= 0.653 USER MOD Set 4.3: A 106 ASN : amide:sc= 0.733 K(o=1.1,f=-5.8!) USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.0223 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.129 USER MOD Single : A 83 ASN : amide:sc= -0.129 K(o=-0.13,f=-1.7!) USER MOD Single : A 97 SER OG : rot 180:sc= 0.0198 USER MOD Single : A 101 MET CE :methyl 159:sc= 0 (180deg=-0.945) USER MOD Single : A 104 GLN : amide:sc= 0.613 K(o=0.61,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 74:sc= 1.19 USER MOD Single : A 117 THR OG1 : rot 149:sc= 1.2 USER MOD Single : A 120 ASN :FLIP amide:sc= -0.0343 F(o=-3.1!,f=-0.034) USER MOD Single : A 129 HIS : no HD1:sc= -0.965 X(o=-0.96,f=-1.2) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0899 USER MOD Single : A 147 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 203 SER OG : rot 180:sc= 0.0773 USER MOD Single : A 206 SER OG : rot -120:sc= -0.452 USER MOD Single : A 208 SER OG : rot 58:sc= 1.27 USER MOD Single : A 414 THR OG1 : rot -26:sc= 0.593 USER MOD Single : A 416 HIS : no HD1:sc= 0.237 K(o=0.24,f=-2.5!) USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.100 11.068 8.379 1.00 0.00 N ATOM 2 CA GLY A 1 -14.409 12.335 7.691 1.00 0.00 C ATOM 3 C GLY A 1 -14.802 12.119 6.249 1.00 0.00 C ATOM 4 O GLY A 1 -15.419 11.107 5.909 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.556 11.060 9.314 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.455 10.270 7.814 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.070 10.978 8.495 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.219 12.843 8.215 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.540 12.992 7.735 1.00 0.00 H new ATOM 10 N SER A 2 -14.434 13.061 5.400 1.00 0.00 N ATOM 11 CA SER A 2 -14.784 13.018 3.992 1.00 0.00 C ATOM 12 C SER A 2 -13.935 11.993 3.233 1.00 0.00 C ATOM 13 O SER A 2 -12.857 12.313 2.727 1.00 0.00 O ATOM 14 CB SER A 2 -14.592 14.414 3.406 1.00 0.00 C ATOM 15 OG SER A 2 -13.950 15.257 4.353 1.00 0.00 O ATOM 0 H SER A 2 -13.884 13.877 5.667 1.00 0.00 H new ATOM 0 HA SER A 2 -15.824 12.707 3.890 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.995 14.356 2.496 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.558 14.836 3.128 1.00 0.00 H new ATOM 0 HG SER A 2 -13.830 16.150 3.967 1.00 0.00 H new ATOM 21 N TYR A 77 -14.415 10.756 3.177 1.00 0.00 N ATOM 22 CA TYR A 77 -13.720 9.695 2.458 1.00 0.00 C ATOM 23 C TYR A 77 -14.717 8.768 1.776 1.00 0.00 C ATOM 24 O TYR A 77 -14.433 7.594 1.531 1.00 0.00 O ATOM 25 CB TYR A 77 -12.836 8.895 3.418 1.00 0.00 C ATOM 26 CG TYR A 77 -11.529 8.436 2.809 1.00 0.00 C ATOM 27 CD1 TYR A 77 -10.758 9.298 2.038 1.00 0.00 C ATOM 28 CD2 TYR A 77 -11.066 7.143 3.009 1.00 0.00 C ATOM 29 CE1 TYR A 77 -9.563 8.884 1.488 1.00 0.00 C ATOM 30 CE2 TYR A 77 -9.872 6.722 2.460 1.00 0.00 C ATOM 31 CZ TYR A 77 -9.124 7.596 1.701 1.00 0.00 C ATOM 32 OH TYR A 77 -7.930 7.183 1.152 1.00 0.00 O ATOM 0 H TYR A 77 -15.285 10.463 3.622 1.00 0.00 H new ATOM 0 HA TYR A 77 -13.091 10.153 1.695 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -12.622 9.507 4.295 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -13.390 8.023 3.765 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -11.100 10.308 1.867 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -11.649 6.456 3.604 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -8.974 9.566 0.893 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -9.525 5.712 2.624 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.763 6.249 1.397 1.00 0.00 H new ATOM 42 N ILE A 78 -15.886 9.305 1.458 1.00 0.00 N ATOM 43 CA ILE A 78 -16.956 8.509 0.869 1.00 0.00 C ATOM 44 C ILE A 78 -16.770 8.387 -0.639 1.00 0.00 C ATOM 45 O ILE A 78 -17.429 9.071 -1.422 1.00 0.00 O ATOM 46 CB ILE A 78 -18.350 9.105 1.169 1.00 0.00 C ATOM 47 CG1 ILE A 78 -18.387 9.700 2.580 1.00 0.00 C ATOM 48 CG2 ILE A 78 -19.423 8.037 1.010 1.00 0.00 C ATOM 49 CD1 ILE A 78 -19.208 10.973 2.685 1.00 0.00 C ATOM 0 H ILE A 78 -16.119 10.288 1.597 1.00 0.00 H new ATOM 0 HA ILE A 78 -16.903 7.520 1.323 1.00 0.00 H new ATOM 0 HB ILE A 78 -18.548 9.905 0.456 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -18.794 8.958 3.267 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -17.367 9.908 2.904 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -20.401 8.469 1.224 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -19.410 7.657 -0.012 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -19.228 7.219 1.704 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -19.188 11.335 3.713 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -18.789 11.732 2.024 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -20.238 10.767 2.393 1.00 0.00 H new ATOM 61 N ARG A 79 -15.843 7.528 -1.042 1.00 0.00 N ATOM 62 CA ARG A 79 -15.608 7.264 -2.456 1.00 0.00 C ATOM 63 C ARG A 79 -15.529 5.764 -2.716 1.00 0.00 C ATOM 64 O ARG A 79 -15.013 5.325 -3.745 1.00 0.00 O ATOM 65 CB ARG A 79 -14.328 7.960 -2.936 1.00 0.00 C ATOM 66 CG ARG A 79 -13.074 7.575 -2.164 1.00 0.00 C ATOM 67 CD ARG A 79 -11.876 8.393 -2.619 1.00 0.00 C ATOM 68 NE ARG A 79 -10.610 7.672 -2.447 1.00 0.00 N ATOM 69 CZ ARG A 79 -9.403 8.210 -2.668 1.00 0.00 C ATOM 70 NH1 ARG A 79 -9.289 9.469 -3.076 1.00 0.00 N ATOM 71 NH2 ARG A 79 -8.305 7.488 -2.477 1.00 0.00 N ATOM 0 H ARG A 79 -15.241 7.001 -0.409 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.448 7.669 -3.020 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -14.176 7.728 -3.990 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -14.467 9.039 -2.864 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -13.239 7.729 -1.098 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -12.868 6.514 -2.305 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -11.999 8.660 -3.668 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -11.840 9.325 -2.055 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.651 6.700 -2.140 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -10.125 10.035 -3.224 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.366 9.870 -3.242 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -8.379 6.521 -2.161 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -7.388 7.900 -2.646 1.00 0.00 H new ATOM 85 N LEU A 80 -16.058 4.985 -1.783 1.00 0.00 N ATOM 86 CA LEU A 80 -16.050 3.535 -1.902 1.00 0.00 C ATOM 87 C LEU A 80 -17.477 3.020 -2.073 1.00 0.00 C ATOM 88 O LEU A 80 -18.410 3.810 -2.196 1.00 0.00 O ATOM 89 CB LEU A 80 -15.379 2.903 -0.674 1.00 0.00 C ATOM 90 CG LEU A 80 -16.133 3.061 0.650 1.00 0.00 C ATOM 91 CD1 LEU A 80 -15.956 1.820 1.507 1.00 0.00 C ATOM 92 CD2 LEU A 80 -15.655 4.297 1.394 1.00 0.00 C ATOM 0 H LEU A 80 -16.499 5.335 -0.933 1.00 0.00 H new ATOM 0 HA LEU A 80 -15.474 3.251 -2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -15.239 1.839 -0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.387 3.340 -0.560 1.00 0.00 H new ATOM 0 HG LEU A 80 -17.194 3.184 0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -16.497 1.945 2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -16.347 0.952 0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -14.897 1.670 1.716 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.203 4.392 2.332 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -14.589 4.206 1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -15.830 5.181 0.781 1.00 0.00 H new ATOM 104 N PHE A 81 -17.643 1.702 -2.087 1.00 0.00 N ATOM 105 CA PHE A 81 -18.958 1.097 -2.295 1.00 0.00 C ATOM 106 C PHE A 81 -19.796 1.161 -1.019 1.00 0.00 C ATOM 107 O PHE A 81 -21.011 1.334 -1.069 1.00 0.00 O ATOM 108 CB PHE A 81 -18.807 -0.358 -2.748 1.00 0.00 C ATOM 109 CG PHE A 81 -19.902 -0.821 -3.673 1.00 0.00 C ATOM 110 CD1 PHE A 81 -19.959 -0.376 -4.985 1.00 0.00 C ATOM 111 CD2 PHE A 81 -20.877 -1.700 -3.224 1.00 0.00 C ATOM 112 CE1 PHE A 81 -20.967 -0.799 -5.831 1.00 0.00 C ATOM 113 CE2 PHE A 81 -21.888 -2.127 -4.066 1.00 0.00 C ATOM 114 CZ PHE A 81 -21.933 -1.676 -5.371 1.00 0.00 C ATOM 0 H PHE A 81 -16.886 1.031 -1.957 1.00 0.00 H new ATOM 0 HA PHE A 81 -19.471 1.662 -3.073 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -17.846 -0.475 -3.249 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -18.789 -1.003 -1.869 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -19.208 0.309 -5.350 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -20.846 -2.055 -2.205 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -21.000 -0.445 -6.851 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -22.641 -2.812 -3.704 1.00 0.00 H new ATOM 0 HZ PHE A 81 -22.721 -2.008 -6.031 1.00 0.00 H new ATOM 124 N GLY A 82 -19.136 1.007 0.119 1.00 0.00 N ATOM 125 CA GLY A 82 -19.821 1.111 1.389 1.00 0.00 C ATOM 126 C GLY A 82 -19.297 2.281 2.192 1.00 0.00 C ATOM 127 O GLY A 82 -19.199 3.394 1.678 1.00 0.00 O ATOM 0 H GLY A 82 -18.137 0.812 0.185 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -20.891 1.231 1.220 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -19.689 0.189 1.954 1.00 0.00 H new ATOM 131 N ASN A 83 -18.946 2.038 3.443 1.00 0.00 N ATOM 132 CA ASN A 83 -18.329 3.073 4.268 1.00 0.00 C ATOM 133 C ASN A 83 -17.335 2.452 5.242 1.00 0.00 C ATOM 134 O ASN A 83 -17.004 3.035 6.273 1.00 0.00 O ATOM 135 CB ASN A 83 -19.389 3.882 5.033 1.00 0.00 C ATOM 136 CG ASN A 83 -20.381 3.011 5.781 1.00 0.00 C ATOM 137 OD1 ASN A 83 -20.004 2.118 6.537 1.00 0.00 O ATOM 138 ND2 ASN A 83 -21.660 3.273 5.578 1.00 0.00 N ATOM 0 H ASN A 83 -19.075 1.141 3.911 1.00 0.00 H new ATOM 0 HA ASN A 83 -17.797 3.756 3.606 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -18.890 4.544 5.741 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -19.930 4.516 4.330 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -22.375 2.725 6.057 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -21.932 4.023 4.942 1.00 0.00 H new ATOM 145 N SER A 84 -16.858 1.266 4.894 1.00 0.00 N ATOM 146 CA SER A 84 -15.918 0.533 5.733 1.00 0.00 C ATOM 147 C SER A 84 -14.510 1.113 5.618 1.00 0.00 C ATOM 148 O SER A 84 -13.916 1.537 6.610 1.00 0.00 O ATOM 149 CB SER A 84 -15.916 -0.933 5.312 1.00 0.00 C ATOM 150 OG SER A 84 -16.904 -1.159 4.315 1.00 0.00 O ATOM 0 H SER A 84 -17.108 0.787 4.029 1.00 0.00 H new ATOM 0 HA SER A 84 -16.231 0.621 6.773 1.00 0.00 H new ATOM 0 HB2 SER A 84 -14.933 -1.208 4.929 1.00 0.00 H new ATOM 0 HB3 SER A 84 -16.110 -1.568 6.177 1.00 0.00 H new ATOM 0 HG SER A 84 -17.783 -0.895 4.659 1.00 0.00 H new ATOM 156 N GLY A 85 -13.985 1.124 4.401 1.00 0.00 N ATOM 157 CA GLY A 85 -12.660 1.654 4.161 1.00 0.00 C ATOM 158 C GLY A 85 -12.373 1.781 2.682 1.00 0.00 C ATOM 159 O GLY A 85 -12.854 0.973 1.883 1.00 0.00 O ATOM 0 H GLY A 85 -14.459 0.772 3.569 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -12.566 2.631 4.636 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -11.918 1.003 4.622 1.00 0.00 H new ATOM 163 N ALA A 86 -11.601 2.789 2.314 1.00 0.00 N ATOM 164 CA ALA A 86 -11.288 3.044 0.919 1.00 0.00 C ATOM 165 C ALA A 86 -9.788 3.195 0.716 1.00 0.00 C ATOM 166 O ALA A 86 -9.094 3.780 1.551 1.00 0.00 O ATOM 167 CB ALA A 86 -12.016 4.292 0.444 1.00 0.00 C ATOM 0 H ALA A 86 -11.177 3.448 2.967 1.00 0.00 H new ATOM 0 HA ALA A 86 -11.623 2.191 0.329 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.776 4.477 -0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -13.091 4.149 0.550 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.703 5.146 1.044 1.00 0.00 H new ATOM 173 N CYS A 87 -9.307 2.666 -0.399 1.00 0.00 N ATOM 174 CA CYS A 87 -7.898 2.721 -0.754 1.00 0.00 C ATOM 175 C CYS A 87 -7.433 4.158 -0.932 1.00 0.00 C ATOM 176 O CYS A 87 -8.194 5.021 -1.385 1.00 0.00 O ATOM 177 CB CYS A 87 -7.675 1.940 -2.043 1.00 0.00 C ATOM 178 SG CYS A 87 -5.939 1.815 -2.586 1.00 0.00 S ATOM 0 H CYS A 87 -9.887 2.184 -1.086 1.00 0.00 H new ATOM 0 HA CYS A 87 -7.317 2.277 0.054 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -8.071 0.933 -1.912 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -8.255 2.409 -2.838 1.00 0.00 H new ATOM 183 N SER A 88 -6.191 4.415 -0.567 1.00 0.00 N ATOM 184 CA SER A 88 -5.600 5.727 -0.748 1.00 0.00 C ATOM 185 C SER A 88 -5.152 5.920 -2.196 1.00 0.00 C ATOM 186 O SER A 88 -5.087 7.045 -2.691 1.00 0.00 O ATOM 187 CB SER A 88 -4.413 5.893 0.195 1.00 0.00 C ATOM 188 OG SER A 88 -4.080 4.654 0.798 1.00 0.00 O ATOM 0 H SER A 88 -5.569 3.728 -0.141 1.00 0.00 H new ATOM 0 HA SER A 88 -6.350 6.483 -0.517 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.555 6.278 -0.356 1.00 0.00 H new ATOM 0 HB3 SER A 88 -4.653 6.626 0.965 1.00 0.00 H new ATOM 0 HG SER A 88 -3.223 4.338 0.444 1.00 0.00 H new ATOM 194 N ALA A 89 -4.871 4.808 -2.871 1.00 0.00 N ATOM 195 CA ALA A 89 -4.374 4.850 -4.237 1.00 0.00 C ATOM 196 C ALA A 89 -5.508 4.676 -5.240 1.00 0.00 C ATOM 197 O ALA A 89 -5.618 5.441 -6.200 1.00 0.00 O ATOM 198 CB ALA A 89 -3.313 3.781 -4.443 1.00 0.00 C ATOM 0 H ALA A 89 -4.980 3.868 -2.491 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.925 5.829 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.949 3.823 -5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.484 3.954 -3.757 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.744 2.799 -4.251 1.00 0.00 H new ATOM 204 N CYS A 90 -6.351 3.675 -5.016 1.00 0.00 N ATOM 205 CA CYS A 90 -7.479 3.430 -5.901 1.00 0.00 C ATOM 206 C CYS A 90 -8.643 4.329 -5.529 1.00 0.00 C ATOM 207 O CYS A 90 -9.076 5.171 -6.315 1.00 0.00 O ATOM 208 CB CYS A 90 -7.938 1.976 -5.815 1.00 0.00 C ATOM 209 SG CYS A 90 -6.625 0.742 -6.096 1.00 0.00 S ATOM 0 H CYS A 90 -6.274 3.025 -4.234 1.00 0.00 H new ATOM 0 HA CYS A 90 -7.152 3.644 -6.919 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -8.373 1.805 -4.831 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.730 1.816 -6.546 1.00 0.00 H new ATOM 214 N GLY A 91 -9.137 4.137 -4.319 1.00 0.00 N ATOM 215 CA GLY A 91 -10.303 4.858 -3.869 1.00 0.00 C ATOM 216 C GLY A 91 -11.442 3.921 -3.552 1.00 0.00 C ATOM 217 O GLY A 91 -12.366 4.280 -2.827 1.00 0.00 O ATOM 0 H GLY A 91 -8.747 3.488 -3.635 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -10.052 5.441 -2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -10.615 5.565 -4.638 1.00 0.00 H new ATOM 221 N GLN A 92 -11.360 2.707 -4.092 1.00 0.00 N ATOM 222 CA GLN A 92 -12.397 1.704 -3.892 1.00 0.00 C ATOM 223 C GLN A 92 -12.272 1.059 -2.518 1.00 0.00 C ATOM 224 O GLN A 92 -11.344 1.352 -1.763 1.00 0.00 O ATOM 225 CB GLN A 92 -12.323 0.634 -4.984 1.00 0.00 C ATOM 226 CG GLN A 92 -13.554 0.594 -5.877 1.00 0.00 C ATOM 227 CD GLN A 92 -14.852 0.436 -5.103 1.00 0.00 C ATOM 228 OE1 GLN A 92 -14.973 -0.421 -4.225 1.00 0.00 O ATOM 229 NE2 GLN A 92 -15.828 1.267 -5.420 1.00 0.00 N ATOM 0 H GLN A 92 -10.582 2.396 -4.673 1.00 0.00 H new ATOM 0 HA GLN A 92 -13.365 2.202 -3.951 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.442 0.815 -5.600 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -12.190 -0.342 -4.517 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -13.598 1.511 -6.464 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -13.456 -0.232 -6.582 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -15.688 1.962 -6.153 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -16.722 1.214 -4.932 1.00 0.00 H new ATOM 238 N SER A 93 -13.202 0.169 -2.214 1.00 0.00 N ATOM 239 CA SER A 93 -13.280 -0.444 -0.902 1.00 0.00 C ATOM 240 C SER A 93 -12.355 -1.653 -0.788 1.00 0.00 C ATOM 241 O SER A 93 -11.737 -2.080 -1.767 1.00 0.00 O ATOM 242 CB SER A 93 -14.723 -0.859 -0.623 1.00 0.00 C ATOM 243 OG SER A 93 -15.620 -0.241 -1.539 1.00 0.00 O ATOM 0 H SER A 93 -13.920 -0.146 -2.867 1.00 0.00 H new ATOM 0 HA SER A 93 -12.954 0.288 -0.163 1.00 0.00 H new ATOM 0 HB2 SER A 93 -14.814 -1.943 -0.696 1.00 0.00 H new ATOM 0 HB3 SER A 93 -14.993 -0.584 0.397 1.00 0.00 H new ATOM 0 HG SER A 93 -15.382 -0.499 -2.454 1.00 0.00 H new ATOM 249 N ILE A 94 -12.268 -2.197 0.419 1.00 0.00 N ATOM 250 CA ILE A 94 -11.468 -3.380 0.685 1.00 0.00 C ATOM 251 C ILE A 94 -12.381 -4.567 0.986 1.00 0.00 C ATOM 252 O ILE A 94 -13.073 -4.585 2.006 1.00 0.00 O ATOM 253 CB ILE A 94 -10.508 -3.138 1.870 1.00 0.00 C ATOM 254 CG1 ILE A 94 -9.345 -2.249 1.430 1.00 0.00 C ATOM 255 CG2 ILE A 94 -9.989 -4.453 2.427 1.00 0.00 C ATOM 256 CD1 ILE A 94 -9.515 -0.793 1.798 1.00 0.00 C ATOM 0 H ILE A 94 -12.751 -1.829 1.239 1.00 0.00 H new ATOM 0 HA ILE A 94 -10.871 -3.600 -0.200 1.00 0.00 H new ATOM 0 HB ILE A 94 -11.060 -2.632 2.662 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.425 -2.622 1.879 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -9.227 -2.329 0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -9.315 -4.254 3.260 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -10.827 -5.057 2.774 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.452 -4.992 1.647 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -8.650 -0.227 1.453 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.417 -0.401 1.327 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.601 -0.699 2.881 1.00 0.00 H new ATOM 268 N PRO A 95 -12.436 -5.543 0.072 1.00 0.00 N ATOM 269 CA PRO A 95 -13.225 -6.759 0.250 1.00 0.00 C ATOM 270 C PRO A 95 -12.538 -7.759 1.171 1.00 0.00 C ATOM 271 O PRO A 95 -11.330 -7.685 1.394 1.00 0.00 O ATOM 272 CB PRO A 95 -13.335 -7.335 -1.174 1.00 0.00 C ATOM 273 CG PRO A 95 -12.702 -6.324 -2.075 1.00 0.00 C ATOM 274 CD PRO A 95 -11.754 -5.542 -1.223 1.00 0.00 C ATOM 0 HA PRO A 95 -14.190 -6.551 0.713 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -12.826 -8.296 -1.247 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -14.376 -7.504 -1.448 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -12.176 -6.810 -2.897 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -13.455 -5.672 -2.519 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.772 -6.013 -1.167 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -11.602 -4.532 -1.603 1.00 0.00 H new ATOM 282 N ALA A 96 -13.306 -8.703 1.697 1.00 0.00 N ATOM 283 CA ALA A 96 -12.753 -9.733 2.567 1.00 0.00 C ATOM 284 C ALA A 96 -12.045 -10.811 1.755 1.00 0.00 C ATOM 285 O ALA A 96 -11.269 -11.605 2.288 1.00 0.00 O ATOM 286 CB ALA A 96 -13.848 -10.350 3.417 1.00 0.00 C ATOM 0 H ALA A 96 -14.311 -8.778 1.538 1.00 0.00 H new ATOM 0 HA ALA A 96 -12.020 -9.264 3.223 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -13.419 -11.118 4.061 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -14.311 -9.577 4.031 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -14.602 -10.799 2.770 1.00 0.00 H new ATOM 292 N SER A 97 -12.329 -10.841 0.462 1.00 0.00 N ATOM 293 CA SER A 97 -11.742 -11.831 -0.425 1.00 0.00 C ATOM 294 C SER A 97 -10.478 -11.292 -1.094 1.00 0.00 C ATOM 295 O SER A 97 -9.633 -12.060 -1.556 1.00 0.00 O ATOM 296 CB SER A 97 -12.763 -12.235 -1.480 1.00 0.00 C ATOM 297 OG SER A 97 -14.037 -11.681 -1.181 1.00 0.00 O ATOM 0 H SER A 97 -12.965 -10.188 0.003 1.00 0.00 H new ATOM 0 HA SER A 97 -11.461 -12.703 0.165 1.00 0.00 H new ATOM 0 HB2 SER A 97 -12.434 -11.895 -2.462 1.00 0.00 H new ATOM 0 HB3 SER A 97 -12.835 -13.322 -1.527 1.00 0.00 H new ATOM 0 HG SER A 97 -14.680 -11.949 -1.870 1.00 0.00 H new ATOM 303 N GLU A 98 -10.352 -9.973 -1.145 1.00 0.00 N ATOM 304 CA GLU A 98 -9.198 -9.344 -1.766 1.00 0.00 C ATOM 305 C GLU A 98 -8.217 -8.889 -0.701 1.00 0.00 C ATOM 306 O GLU A 98 -8.479 -7.948 0.047 1.00 0.00 O ATOM 307 CB GLU A 98 -9.631 -8.168 -2.645 1.00 0.00 C ATOM 308 CG GLU A 98 -10.072 -8.593 -4.036 1.00 0.00 C ATOM 309 CD GLU A 98 -9.137 -8.112 -5.130 1.00 0.00 C ATOM 310 OE1 GLU A 98 -8.756 -6.925 -5.123 1.00 0.00 O ATOM 311 OE2 GLU A 98 -8.784 -8.922 -6.014 1.00 0.00 O ATOM 0 H GLU A 98 -11.036 -9.319 -0.763 1.00 0.00 H new ATOM 0 HA GLU A 98 -8.703 -10.075 -2.405 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.450 -7.639 -2.157 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -8.804 -7.464 -2.732 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -10.137 -9.680 -4.074 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.074 -8.207 -4.227 1.00 0.00 H new ATOM 318 N LEU A 99 -7.098 -9.590 -0.625 1.00 0.00 N ATOM 319 CA LEU A 99 -6.066 -9.285 0.356 1.00 0.00 C ATOM 320 C LEU A 99 -5.433 -7.936 0.052 1.00 0.00 C ATOM 321 O LEU A 99 -5.050 -7.655 -1.084 1.00 0.00 O ATOM 322 CB LEU A 99 -4.991 -10.374 0.361 1.00 0.00 C ATOM 323 CG LEU A 99 -5.508 -11.795 0.582 1.00 0.00 C ATOM 324 CD1 LEU A 99 -4.507 -12.815 0.055 1.00 0.00 C ATOM 325 CD2 LEU A 99 -5.792 -12.032 2.060 1.00 0.00 C ATOM 0 H LEU A 99 -6.879 -10.379 -1.234 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.530 -9.246 1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.459 -10.342 -0.590 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.265 -10.143 1.141 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.440 -11.916 0.030 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.892 -13.821 0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.354 -12.656 -1.012 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.558 -12.698 0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.160 -13.048 2.201 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.875 -11.895 2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.545 -11.323 2.404 1.00 0.00 H new ATOM 337 N VAL A 100 -5.328 -7.113 1.074 1.00 0.00 N ATOM 338 CA VAL A 100 -4.826 -5.764 0.922 1.00 0.00 C ATOM 339 C VAL A 100 -3.544 -5.567 1.716 1.00 0.00 C ATOM 340 O VAL A 100 -3.193 -6.391 2.560 1.00 0.00 O ATOM 341 CB VAL A 100 -5.873 -4.734 1.386 1.00 0.00 C ATOM 342 CG1 VAL A 100 -7.057 -4.720 0.435 1.00 0.00 C ATOM 343 CG2 VAL A 100 -6.330 -5.015 2.812 1.00 0.00 C ATOM 0 H VAL A 100 -5.587 -7.359 2.029 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.617 -5.611 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.406 -3.749 1.376 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -7.789 -3.987 0.776 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.717 -4.455 -0.566 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -7.517 -5.708 0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -7.069 -4.271 3.111 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -6.775 -6.009 2.862 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.474 -4.966 3.485 1.00 0.00 H new ATOM 353 N MET A 101 -2.853 -4.473 1.447 1.00 0.00 N ATOM 354 CA MET A 101 -1.623 -4.155 2.150 1.00 0.00 C ATOM 355 C MET A 101 -1.804 -2.861 2.928 1.00 0.00 C ATOM 356 O MET A 101 -1.948 -1.788 2.345 1.00 0.00 O ATOM 357 CB MET A 101 -0.457 -4.030 1.164 1.00 0.00 C ATOM 358 CG MET A 101 0.437 -5.261 1.123 1.00 0.00 C ATOM 359 SD MET A 101 -0.158 -6.517 -0.029 1.00 0.00 S ATOM 360 CE MET A 101 1.277 -6.739 -1.073 1.00 0.00 C ATOM 0 H MET A 101 -3.125 -3.787 0.743 1.00 0.00 H new ATOM 0 HA MET A 101 -1.391 -4.961 2.846 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.854 -3.845 0.166 1.00 0.00 H new ATOM 0 HB3 MET A 101 0.145 -3.162 1.433 1.00 0.00 H new ATOM 0 HG2 MET A 101 1.446 -4.963 0.839 1.00 0.00 H new ATOM 0 HG3 MET A 101 0.501 -5.692 2.122 1.00 0.00 H new ATOM 0 HE1 MET A 101 1.217 -7.705 -1.574 1.00 0.00 H new ATOM 0 HE2 MET A 101 1.310 -5.945 -1.819 1.00 0.00 H new ATOM 0 HE3 MET A 101 2.180 -6.702 -0.463 1.00 0.00 H new ATOM 370 N ARG A 102 -1.806 -2.969 4.246 1.00 0.00 N ATOM 371 CA ARG A 102 -2.058 -1.820 5.105 1.00 0.00 C ATOM 372 C ARG A 102 -0.796 -1.422 5.850 1.00 0.00 C ATOM 373 O ARG A 102 -0.045 -2.280 6.313 1.00 0.00 O ATOM 374 CB ARG A 102 -3.176 -2.131 6.106 1.00 0.00 C ATOM 375 CG ARG A 102 -3.301 -3.610 6.446 1.00 0.00 C ATOM 376 CD ARG A 102 -3.220 -3.849 7.943 1.00 0.00 C ATOM 377 NE ARG A 102 -4.226 -4.810 8.389 1.00 0.00 N ATOM 378 CZ ARG A 102 -3.966 -6.089 8.642 1.00 0.00 C ATOM 379 NH1 ARG A 102 -2.716 -6.537 8.587 1.00 0.00 N ATOM 380 NH2 ARG A 102 -4.951 -6.917 8.973 1.00 0.00 N ATOM 0 H ARG A 102 -1.636 -3.841 4.747 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.371 -0.988 4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.996 -1.571 7.023 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -4.124 -1.780 5.699 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -4.249 -3.992 6.067 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -2.509 -4.167 5.945 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -2.226 -4.216 8.200 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -3.358 -2.905 8.471 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.183 -4.481 8.513 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -1.956 -5.899 8.351 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.517 -7.518 8.781 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -5.909 -6.572 9.033 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.749 -7.898 9.167 1.00 0.00 H new ATOM 394 N ALA A 103 -0.576 -0.125 5.965 1.00 0.00 N ATOM 395 CA ALA A 103 0.584 0.394 6.671 1.00 0.00 C ATOM 396 C ALA A 103 0.140 1.262 7.843 1.00 0.00 C ATOM 397 O ALA A 103 -1.025 1.227 8.249 1.00 0.00 O ATOM 398 CB ALA A 103 1.483 1.176 5.722 1.00 0.00 C ATOM 0 H ALA A 103 -1.188 0.593 5.577 1.00 0.00 H new ATOM 0 HA ALA A 103 1.160 -0.444 7.063 1.00 0.00 H new ATOM 0 HB1 ALA A 103 2.346 1.557 6.269 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.822 0.521 4.919 1.00 0.00 H new ATOM 0 HB3 ALA A 103 0.925 2.011 5.298 1.00 0.00 H new ATOM 404 N GLN A 104 1.065 2.040 8.386 1.00 0.00 N ATOM 405 CA GLN A 104 0.771 2.888 9.532 1.00 0.00 C ATOM 406 C GLN A 104 0.195 4.225 9.075 1.00 0.00 C ATOM 407 O GLN A 104 0.931 5.193 8.862 1.00 0.00 O ATOM 408 CB GLN A 104 2.032 3.113 10.376 1.00 0.00 C ATOM 409 CG GLN A 104 3.313 3.177 9.562 1.00 0.00 C ATOM 410 CD GLN A 104 4.152 4.392 9.897 1.00 0.00 C ATOM 411 OE1 GLN A 104 5.175 4.286 10.566 1.00 0.00 O ATOM 412 NE2 GLN A 104 3.717 5.557 9.443 1.00 0.00 N ATOM 0 H GLN A 104 2.026 2.102 8.051 1.00 0.00 H new ATOM 0 HA GLN A 104 0.028 2.382 10.149 1.00 0.00 H new ATOM 0 HB2 GLN A 104 1.922 4.042 10.936 1.00 0.00 H new ATOM 0 HB3 GLN A 104 2.117 2.309 11.107 1.00 0.00 H new ATOM 0 HG2 GLN A 104 3.898 2.275 9.740 1.00 0.00 H new ATOM 0 HG3 GLN A 104 3.065 3.192 8.501 1.00 0.00 H new ATOM 0 HE21 GLN A 104 2.861 5.601 8.890 1.00 0.00 H new ATOM 0 HE22 GLN A 104 4.238 6.410 9.646 1.00 0.00 H new ATOM 421 N GLY A 105 -1.119 4.262 8.900 1.00 0.00 N ATOM 422 CA GLY A 105 -1.786 5.496 8.534 1.00 0.00 C ATOM 423 C GLY A 105 -2.898 5.277 7.529 1.00 0.00 C ATOM 424 O GLY A 105 -4.007 5.777 7.704 1.00 0.00 O ATOM 0 H GLY A 105 -1.737 3.457 9.005 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.196 5.963 9.429 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.056 6.191 8.118 1.00 0.00 H new ATOM 428 N ASN A 106 -2.600 4.527 6.477 1.00 0.00 N ATOM 429 CA ASN A 106 -3.578 4.256 5.434 1.00 0.00 C ATOM 430 C ASN A 106 -3.430 2.827 4.926 1.00 0.00 C ATOM 431 O ASN A 106 -2.513 2.107 5.333 1.00 0.00 O ATOM 432 CB ASN A 106 -3.435 5.252 4.280 1.00 0.00 C ATOM 433 CG ASN A 106 -4.775 5.651 3.688 1.00 0.00 C ATOM 434 OD1 ASN A 106 -5.520 4.812 3.182 1.00 0.00 O ATOM 435 ND2 ASN A 106 -5.092 6.932 3.749 1.00 0.00 N ATOM 0 H ASN A 106 -1.689 4.096 6.324 1.00 0.00 H new ATOM 0 HA ASN A 106 -4.574 4.373 5.862 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -2.918 6.144 4.636 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -2.813 4.813 3.500 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -5.981 7.256 3.369 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -4.448 7.597 4.177 1.00 0.00 H new ATOM 442 N VAL A 107 -4.323 2.428 4.033 1.00 0.00 N ATOM 443 CA VAL A 107 -4.351 1.065 3.529 1.00 0.00 C ATOM 444 C VAL A 107 -4.464 1.050 2.006 1.00 0.00 C ATOM 445 O VAL A 107 -5.163 1.875 1.414 1.00 0.00 O ATOM 446 CB VAL A 107 -5.529 0.272 4.155 1.00 0.00 C ATOM 447 CG1 VAL A 107 -6.846 1.004 3.947 1.00 0.00 C ATOM 448 CG2 VAL A 107 -5.600 -1.145 3.598 1.00 0.00 C ATOM 0 H VAL A 107 -5.043 3.035 3.640 1.00 0.00 H new ATOM 0 HA VAL A 107 -3.415 0.585 3.813 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.347 0.198 5.227 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -7.657 0.429 4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -6.795 1.986 4.418 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -7.032 1.123 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -6.435 -1.675 4.056 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.744 -1.105 2.518 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.671 -1.670 3.821 1.00 0.00 H new ATOM 458 N TYR A 108 -3.750 0.121 1.385 1.00 0.00 N ATOM 459 CA TYR A 108 -3.827 -0.081 -0.053 1.00 0.00 C ATOM 460 C TYR A 108 -4.292 -1.506 -0.335 1.00 0.00 C ATOM 461 O TYR A 108 -4.628 -2.248 0.583 1.00 0.00 O ATOM 462 CB TYR A 108 -2.468 0.154 -0.731 1.00 0.00 C ATOM 463 CG TYR A 108 -1.606 1.218 -0.083 1.00 0.00 C ATOM 464 CD1 TYR A 108 -1.741 2.554 -0.434 1.00 0.00 C ATOM 465 CD2 TYR A 108 -0.651 0.885 0.871 1.00 0.00 C ATOM 466 CE1 TYR A 108 -0.952 3.529 0.147 1.00 0.00 C ATOM 467 CE2 TYR A 108 0.143 1.853 1.457 1.00 0.00 C ATOM 468 CZ TYR A 108 -0.011 3.174 1.094 1.00 0.00 C ATOM 469 OH TYR A 108 0.782 4.142 1.675 1.00 0.00 O ATOM 0 H TYR A 108 -3.105 -0.510 1.861 1.00 0.00 H new ATOM 0 HA TYR A 108 -4.536 0.640 -0.460 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -1.915 -0.785 -0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -2.641 0.431 -1.771 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -2.475 2.837 -1.174 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -0.527 -0.148 1.159 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -1.071 4.564 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 108 0.880 1.576 2.196 1.00 0.00 H new ATOM 0 HH TYR A 108 0.292 4.990 1.707 1.00 0.00 H new ATOM 479 N HIS A 109 -4.293 -1.887 -1.601 1.00 0.00 N ATOM 480 CA HIS A 109 -4.653 -3.241 -2.006 1.00 0.00 C ATOM 481 C HIS A 109 -3.384 -4.014 -2.361 1.00 0.00 C ATOM 482 O HIS A 109 -2.290 -3.665 -1.920 1.00 0.00 O ATOM 483 CB HIS A 109 -5.589 -3.233 -3.231 1.00 0.00 C ATOM 484 CG HIS A 109 -6.938 -2.608 -3.018 1.00 0.00 C ATOM 485 ND1 HIS A 109 -7.192 -1.289 -3.330 1.00 0.00 N ATOM 486 CD2 HIS A 109 -8.084 -3.174 -2.559 1.00 0.00 C ATOM 487 CE1 HIS A 109 -8.471 -1.088 -3.070 1.00 0.00 C ATOM 488 NE2 HIS A 109 -9.054 -2.202 -2.604 1.00 0.00 N ATOM 0 H HIS A 109 -4.046 -1.272 -2.376 1.00 0.00 H new ATOM 0 HA HIS A 109 -5.175 -3.715 -1.175 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -5.089 -2.705 -4.043 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -5.734 -4.262 -3.561 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -8.209 -4.193 -2.223 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -8.982 -0.147 -3.214 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -10.032 -2.308 -2.334 1.00 0.00 H new ATOM 496 N LEU A 110 -3.547 -5.058 -3.160 1.00 0.00 N ATOM 497 CA LEU A 110 -2.426 -5.847 -3.653 1.00 0.00 C ATOM 498 C LEU A 110 -1.847 -5.238 -4.934 1.00 0.00 C ATOM 499 O LEU A 110 -0.698 -5.490 -5.293 1.00 0.00 O ATOM 500 CB LEU A 110 -2.878 -7.283 -3.922 1.00 0.00 C ATOM 501 CG LEU A 110 -1.778 -8.340 -3.813 1.00 0.00 C ATOM 502 CD1 LEU A 110 -2.172 -9.422 -2.826 1.00 0.00 C ATOM 503 CD2 LEU A 110 -1.478 -8.945 -5.177 1.00 0.00 C ATOM 0 H LEU A 110 -4.458 -5.382 -3.485 1.00 0.00 H new ATOM 0 HA LEU A 110 -1.648 -5.847 -2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.673 -7.535 -3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -3.309 -7.331 -4.922 1.00 0.00 H new ATOM 0 HG LEU A 110 -0.874 -7.854 -3.447 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -1.376 -10.164 -2.763 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -2.332 -8.978 -1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.091 -9.903 -3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -0.693 -9.695 -5.078 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -2.379 -9.413 -5.573 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -1.147 -8.161 -5.858 1.00 0.00 H new ATOM 515 N LYS A 111 -2.662 -4.447 -5.623 1.00 0.00 N ATOM 516 CA LYS A 111 -2.294 -3.897 -6.929 1.00 0.00 C ATOM 517 C LYS A 111 -1.585 -2.551 -6.793 1.00 0.00 C ATOM 518 O LYS A 111 -0.667 -2.237 -7.550 1.00 0.00 O ATOM 519 CB LYS A 111 -3.547 -3.738 -7.802 1.00 0.00 C ATOM 520 CG LYS A 111 -4.709 -3.041 -7.097 1.00 0.00 C ATOM 521 CD LYS A 111 -5.900 -3.972 -6.926 1.00 0.00 C ATOM 522 CE LYS A 111 -7.211 -3.272 -7.250 1.00 0.00 C ATOM 523 NZ LYS A 111 -7.586 -3.431 -8.678 1.00 0.00 N ATOM 0 H LYS A 111 -3.588 -4.169 -5.299 1.00 0.00 H new ATOM 0 HA LYS A 111 -1.603 -4.595 -7.402 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.285 -3.172 -8.696 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.874 -4.724 -8.133 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -4.382 -2.685 -6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -5.011 -2.165 -7.671 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.780 -4.839 -7.575 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -5.929 -4.342 -5.901 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -8.003 -3.676 -6.620 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.124 -2.212 -7.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.485 -2.940 -8.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -6.842 -3.023 -9.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -7.694 -4.442 -8.898 1.00 0.00 H new ATOM 537 N CYS A 112 -2.023 -1.775 -5.819 1.00 0.00 N ATOM 538 CA CYS A 112 -1.543 -0.419 -5.604 1.00 0.00 C ATOM 539 C CYS A 112 -0.160 -0.410 -4.946 1.00 0.00 C ATOM 540 O CYS A 112 0.551 0.595 -4.985 1.00 0.00 O ATOM 541 CB CYS A 112 -2.577 0.260 -4.723 1.00 0.00 C ATOM 542 SG CYS A 112 -3.835 -0.932 -4.177 1.00 0.00 S ATOM 0 H CYS A 112 -2.730 -2.070 -5.146 1.00 0.00 H new ATOM 0 HA CYS A 112 -1.424 0.108 -6.551 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -2.088 0.704 -3.856 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -3.053 1.073 -5.272 1.00 0.00 H new ATOM 547 N PHE A 113 0.216 -1.539 -4.354 1.00 0.00 N ATOM 548 CA PHE A 113 1.511 -1.674 -3.701 1.00 0.00 C ATOM 549 C PHE A 113 2.638 -1.686 -4.731 1.00 0.00 C ATOM 550 O PHE A 113 3.089 -2.747 -5.165 1.00 0.00 O ATOM 551 CB PHE A 113 1.554 -2.950 -2.857 1.00 0.00 C ATOM 552 CG PHE A 113 2.184 -2.756 -1.506 1.00 0.00 C ATOM 553 CD1 PHE A 113 1.935 -1.610 -0.771 1.00 0.00 C ATOM 554 CD2 PHE A 113 3.020 -3.723 -0.968 1.00 0.00 C ATOM 555 CE1 PHE A 113 2.509 -1.430 0.475 1.00 0.00 C ATOM 556 CE2 PHE A 113 3.596 -3.549 0.274 1.00 0.00 C ATOM 557 CZ PHE A 113 3.340 -2.400 0.998 1.00 0.00 C ATOM 0 H PHE A 113 -0.363 -2.378 -4.314 1.00 0.00 H new ATOM 0 HA PHE A 113 1.652 -0.815 -3.045 1.00 0.00 H new ATOM 0 HB2 PHE A 113 0.538 -3.323 -2.725 1.00 0.00 H new ATOM 0 HB3 PHE A 113 2.107 -3.717 -3.400 1.00 0.00 H new ATOM 0 HD1 PHE A 113 1.285 -0.848 -1.175 1.00 0.00 H new ATOM 0 HD2 PHE A 113 3.223 -4.624 -1.528 1.00 0.00 H new ATOM 0 HE1 PHE A 113 2.307 -0.531 1.038 1.00 0.00 H new ATOM 0 HE2 PHE A 113 4.246 -4.310 0.680 1.00 0.00 H new ATOM 0 HZ PHE A 113 3.789 -2.261 1.970 1.00 0.00 H new ATOM 567 N THR A 114 3.087 -0.501 -5.117 1.00 0.00 N ATOM 568 CA THR A 114 4.133 -0.364 -6.116 1.00 0.00 C ATOM 569 C THR A 114 5.057 0.798 -5.771 1.00 0.00 C ATOM 570 O THR A 114 4.672 1.694 -5.019 1.00 0.00 O ATOM 571 CB THR A 114 3.524 -0.114 -7.509 1.00 0.00 C ATOM 572 OG1 THR A 114 2.247 0.531 -7.378 1.00 0.00 O ATOM 573 CG2 THR A 114 3.359 -1.410 -8.280 1.00 0.00 C ATOM 0 H THR A 114 2.739 0.385 -4.750 1.00 0.00 H new ATOM 0 HA THR A 114 4.703 -1.293 -6.127 1.00 0.00 H new ATOM 0 HB THR A 114 4.208 0.530 -8.062 1.00 0.00 H new ATOM 0 HG1 THR A 114 1.867 0.688 -8.268 1.00 0.00 H new ATOM 0 HG21 THR A 114 2.927 -1.199 -9.258 1.00 0.00 H new ATOM 0 HG22 THR A 114 4.332 -1.884 -8.408 1.00 0.00 H new ATOM 0 HG23 THR A 114 2.699 -2.080 -7.729 1.00 0.00 H new ATOM 581 N CYS A 115 6.271 0.776 -6.313 1.00 0.00 N ATOM 582 CA CYS A 115 7.205 1.876 -6.145 1.00 0.00 C ATOM 583 C CYS A 115 6.633 3.152 -6.761 1.00 0.00 C ATOM 584 O CYS A 115 5.873 3.101 -7.735 1.00 0.00 O ATOM 585 CB CYS A 115 8.555 1.536 -6.794 1.00 0.00 C ATOM 586 SG CYS A 115 9.768 2.890 -6.709 1.00 0.00 S ATOM 0 H CYS A 115 6.629 0.003 -6.874 1.00 0.00 H new ATOM 0 HA CYS A 115 7.362 2.039 -5.079 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.972 0.655 -6.305 1.00 0.00 H new ATOM 0 HB3 CYS A 115 8.390 1.273 -7.839 1.00 0.00 H new ATOM 591 N SER A 116 7.001 4.288 -6.197 1.00 0.00 N ATOM 592 CA SER A 116 6.547 5.575 -6.702 1.00 0.00 C ATOM 593 C SER A 116 7.551 6.143 -7.706 1.00 0.00 C ATOM 594 O SER A 116 7.250 7.081 -8.445 1.00 0.00 O ATOM 595 CB SER A 116 6.343 6.557 -5.546 1.00 0.00 C ATOM 596 OG SER A 116 5.694 5.926 -4.451 1.00 0.00 O ATOM 0 H SER A 116 7.616 4.347 -5.385 1.00 0.00 H new ATOM 0 HA SER A 116 5.594 5.428 -7.211 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.307 6.951 -5.224 1.00 0.00 H new ATOM 0 HB3 SER A 116 5.749 7.406 -5.885 1.00 0.00 H new ATOM 0 HG SER A 116 6.325 5.330 -3.996 1.00 0.00 H new ATOM 602 N THR A 117 8.743 5.566 -7.732 1.00 0.00 N ATOM 603 CA THR A 117 9.791 6.037 -8.616 1.00 0.00 C ATOM 604 C THR A 117 9.888 5.165 -9.863 1.00 0.00 C ATOM 605 O THR A 117 9.887 5.677 -10.988 1.00 0.00 O ATOM 606 CB THR A 117 11.153 6.059 -7.899 1.00 0.00 C ATOM 607 OG1 THR A 117 10.962 6.328 -6.503 1.00 0.00 O ATOM 608 CG2 THR A 117 12.065 7.116 -8.505 1.00 0.00 C ATOM 0 H THR A 117 9.006 4.771 -7.150 1.00 0.00 H new ATOM 0 HA THR A 117 9.531 7.053 -8.913 1.00 0.00 H new ATOM 0 HB THR A 117 11.624 5.084 -8.022 1.00 0.00 H new ATOM 0 HG1 THR A 117 11.660 5.876 -5.984 1.00 0.00 H new ATOM 0 HG21 THR A 117 13.022 7.114 -7.983 1.00 0.00 H new ATOM 0 HG22 THR A 117 12.227 6.895 -9.560 1.00 0.00 H new ATOM 0 HG23 THR A 117 11.600 8.097 -8.407 1.00 0.00 H new ATOM 616 N CYS A 118 9.944 3.853 -9.669 1.00 0.00 N ATOM 617 CA CYS A 118 10.147 2.932 -10.777 1.00 0.00 C ATOM 618 C CYS A 118 8.943 2.009 -10.983 1.00 0.00 C ATOM 619 O CYS A 118 8.992 1.101 -11.812 1.00 0.00 O ATOM 620 CB CYS A 118 11.415 2.114 -10.545 1.00 0.00 C ATOM 621 SG CYS A 118 12.537 2.837 -9.304 1.00 0.00 S ATOM 0 H CYS A 118 9.852 3.405 -8.757 1.00 0.00 H new ATOM 0 HA CYS A 118 10.258 3.522 -11.686 1.00 0.00 H new ATOM 0 HB2 CYS A 118 11.136 1.109 -10.228 1.00 0.00 H new ATOM 0 HB3 CYS A 118 11.949 2.013 -11.490 1.00 0.00 H new ATOM 626 N ARG A 119 7.883 2.244 -10.205 1.00 0.00 N ATOM 627 CA ARG A 119 6.603 1.526 -10.337 1.00 0.00 C ATOM 628 C ARG A 119 6.732 0.023 -10.039 1.00 0.00 C ATOM 629 O ARG A 119 5.812 -0.756 -10.304 1.00 0.00 O ATOM 630 CB ARG A 119 5.988 1.768 -11.730 1.00 0.00 C ATOM 631 CG ARG A 119 6.231 0.653 -12.745 1.00 0.00 C ATOM 632 CD ARG A 119 4.972 0.322 -13.524 1.00 0.00 C ATOM 633 NE ARG A 119 4.932 -1.079 -13.956 1.00 0.00 N ATOM 634 CZ ARG A 119 5.627 -1.576 -14.981 1.00 0.00 C ATOM 635 NH1 ARG A 119 6.455 -0.811 -15.682 1.00 0.00 N ATOM 636 NH2 ARG A 119 5.494 -2.854 -15.300 1.00 0.00 N ATOM 0 H ARG A 119 7.884 2.941 -9.460 1.00 0.00 H new ATOM 0 HA ARG A 119 5.929 1.932 -9.582 1.00 0.00 H new ATOM 0 HB2 ARG A 119 4.913 1.908 -11.617 1.00 0.00 H new ATOM 0 HB3 ARG A 119 6.390 2.698 -12.131 1.00 0.00 H new ATOM 0 HG2 ARG A 119 7.018 0.955 -13.436 1.00 0.00 H new ATOM 0 HG3 ARG A 119 6.585 -0.239 -12.228 1.00 0.00 H new ATOM 0 HD2 ARG A 119 4.100 0.533 -12.906 1.00 0.00 H new ATOM 0 HD3 ARG A 119 4.908 0.970 -14.398 1.00 0.00 H new ATOM 0 HE ARG A 119 4.331 -1.718 -13.436 1.00 0.00 H new ATOM 0 HH11 ARG A 119 6.568 0.173 -15.440 1.00 0.00 H new ATOM 0 HH12 ARG A 119 6.978 -1.208 -16.462 1.00 0.00 H new ATOM 0 HH21 ARG A 119 4.864 -3.451 -14.764 1.00 0.00 H new ATOM 0 HH22 ARG A 119 6.021 -3.242 -16.082 1.00 0.00 H new ATOM 650 N ASN A 120 7.856 -0.372 -9.457 1.00 0.00 N ATOM 651 CA ASN A 120 8.110 -1.778 -9.154 1.00 0.00 C ATOM 652 C ASN A 120 7.098 -2.306 -8.137 1.00 0.00 C ATOM 653 O ASN A 120 6.946 -1.745 -7.056 1.00 0.00 O ATOM 654 CB ASN A 120 9.533 -1.959 -8.616 1.00 0.00 C ATOM 655 CG ASN A 120 9.762 -3.339 -8.021 1.00 0.00 C ATOM 656 OD1 ASN A 120 10.274 -3.376 -6.800 1.00 0.00 O flip ATOM 657 ND2 ASN A 120 9.493 -4.360 -8.657 1.00 0.00 N flip ATOM 0 H ASN A 120 8.608 0.260 -9.184 1.00 0.00 H new ATOM 0 HA ASN A 120 8.004 -2.348 -10.077 1.00 0.00 H new ATOM 0 HB2 ASN A 120 10.246 -1.792 -9.423 1.00 0.00 H new ATOM 0 HB3 ASN A 120 9.729 -1.203 -7.856 1.00 0.00 H new ATOM 0 HD21 ASN A 120 9.100 -4.288 -9.595 1.00 0.00 H new ATOM 0 HD22 ASN A 120 9.664 -5.277 -8.245 1.00 0.00 H new ATOM 664 N ARG A 121 6.395 -3.372 -8.498 1.00 0.00 N ATOM 665 CA ARG A 121 5.410 -3.973 -7.601 1.00 0.00 C ATOM 666 C ARG A 121 6.097 -4.728 -6.465 1.00 0.00 C ATOM 667 O ARG A 121 6.812 -5.705 -6.694 1.00 0.00 O ATOM 668 CB ARG A 121 4.475 -4.912 -8.376 1.00 0.00 C ATOM 669 CG ARG A 121 3.290 -5.415 -7.558 1.00 0.00 C ATOM 670 CD ARG A 121 2.010 -4.672 -7.906 1.00 0.00 C ATOM 671 NE ARG A 121 0.818 -5.464 -7.608 1.00 0.00 N ATOM 672 CZ ARG A 121 0.059 -6.063 -8.531 1.00 0.00 C ATOM 673 NH1 ARG A 121 0.355 -5.947 -9.822 1.00 0.00 N ATOM 674 NH2 ARG A 121 -1.009 -6.757 -8.158 1.00 0.00 N ATOM 0 H ARG A 121 6.486 -3.838 -9.401 1.00 0.00 H new ATOM 0 HA ARG A 121 4.815 -3.169 -7.168 1.00 0.00 H new ATOM 0 HB2 ARG A 121 4.101 -4.391 -9.257 1.00 0.00 H new ATOM 0 HB3 ARG A 121 5.048 -5.768 -8.732 1.00 0.00 H new ATOM 0 HG2 ARG A 121 3.152 -6.481 -7.736 1.00 0.00 H new ATOM 0 HG3 ARG A 121 3.504 -5.294 -6.496 1.00 0.00 H new ATOM 0 HD2 ARG A 121 1.972 -3.736 -7.349 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.018 -4.413 -8.965 1.00 0.00 H new ATOM 0 HE ARG A 121 0.547 -5.566 -6.630 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.165 -5.399 -10.112 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -0.228 -6.406 -10.522 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -1.249 -6.832 -7.169 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -1.590 -7.215 -8.860 1.00 0.00 H new ATOM 688 N LEU A 122 5.881 -4.256 -5.247 1.00 0.00 N ATOM 689 CA LEU A 122 6.478 -4.865 -4.064 1.00 0.00 C ATOM 690 C LEU A 122 5.758 -6.170 -3.724 1.00 0.00 C ATOM 691 O LEU A 122 4.585 -6.343 -4.060 1.00 0.00 O ATOM 692 CB LEU A 122 6.419 -3.882 -2.892 1.00 0.00 C ATOM 693 CG LEU A 122 6.570 -2.406 -3.285 1.00 0.00 C ATOM 694 CD1 LEU A 122 5.857 -1.510 -2.285 1.00 0.00 C ATOM 695 CD2 LEU A 122 8.041 -2.030 -3.389 1.00 0.00 C ATOM 0 H LEU A 122 5.292 -3.447 -5.049 1.00 0.00 H new ATOM 0 HA LEU A 122 7.523 -5.099 -4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 122 5.468 -4.011 -2.375 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.205 -4.137 -2.182 1.00 0.00 H new ATOM 0 HG LEU A 122 6.109 -2.261 -4.262 1.00 0.00 H new ATOM 0 HD11 LEU A 122 5.976 -0.468 -2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 122 4.797 -1.762 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.287 -1.657 -1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.129 -0.980 -3.669 1.00 0.00 H new ATOM 0 HD22 LEU A 122 8.527 -2.191 -2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.522 -2.649 -4.146 1.00 0.00 H new ATOM 707 N VAL A 123 6.445 -7.084 -3.051 1.00 0.00 N ATOM 708 CA VAL A 123 5.917 -8.430 -2.874 1.00 0.00 C ATOM 709 C VAL A 123 6.243 -8.990 -1.498 1.00 0.00 C ATOM 710 O VAL A 123 7.294 -8.696 -0.929 1.00 0.00 O ATOM 711 CB VAL A 123 6.462 -9.399 -3.946 1.00 0.00 C ATOM 712 CG1 VAL A 123 5.429 -9.622 -5.041 1.00 0.00 C ATOM 713 CG2 VAL A 123 7.767 -8.881 -4.537 1.00 0.00 C ATOM 0 H VAL A 123 7.357 -6.921 -2.624 1.00 0.00 H new ATOM 0 HA VAL A 123 4.835 -8.347 -2.978 1.00 0.00 H new ATOM 0 HB VAL A 123 6.666 -10.355 -3.464 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.832 -10.307 -5.787 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.525 -10.049 -4.607 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.190 -8.670 -5.515 1.00 0.00 H new ATOM 0 HG21 VAL A 123 8.129 -9.582 -5.289 1.00 0.00 H new ATOM 0 HG22 VAL A 123 7.596 -7.909 -4.999 1.00 0.00 H new ATOM 0 HG23 VAL A 123 8.510 -8.781 -3.746 1.00 0.00 H new ATOM 723 N PRO A 124 5.333 -9.812 -0.951 1.00 0.00 N ATOM 724 CA PRO A 124 5.550 -10.501 0.321 1.00 0.00 C ATOM 725 C PRO A 124 6.644 -11.559 0.212 1.00 0.00 C ATOM 726 O PRO A 124 6.481 -12.572 -0.468 1.00 0.00 O ATOM 727 CB PRO A 124 4.195 -11.149 0.613 1.00 0.00 C ATOM 728 CG PRO A 124 3.555 -11.309 -0.722 1.00 0.00 C ATOM 729 CD PRO A 124 4.015 -10.134 -1.537 1.00 0.00 C ATOM 0 HA PRO A 124 5.882 -9.824 1.108 1.00 0.00 H new ATOM 0 HB2 PRO A 124 4.316 -12.111 1.112 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.590 -10.523 1.269 1.00 0.00 H new ATOM 0 HG2 PRO A 124 3.851 -12.249 -1.188 1.00 0.00 H new ATOM 0 HG3 PRO A 124 2.469 -11.324 -0.636 1.00 0.00 H new ATOM 0 HD2 PRO A 124 4.095 -10.384 -2.595 1.00 0.00 H new ATOM 0 HD3 PRO A 124 3.324 -9.295 -1.459 1.00 0.00 H new ATOM 737 N GLY A 125 7.760 -11.311 0.875 1.00 0.00 N ATOM 738 CA GLY A 125 8.886 -12.218 0.795 1.00 0.00 C ATOM 739 C GLY A 125 10.063 -11.566 0.103 1.00 0.00 C ATOM 740 O GLY A 125 11.165 -12.116 0.062 1.00 0.00 O ATOM 0 H GLY A 125 7.908 -10.496 1.469 1.00 0.00 H new ATOM 0 HA2 GLY A 125 9.177 -12.530 1.798 1.00 0.00 H new ATOM 0 HA3 GLY A 125 8.594 -13.118 0.253 1.00 0.00 H new ATOM 744 N ASP A 126 9.811 -10.399 -0.466 1.00 0.00 N ATOM 745 CA ASP A 126 10.862 -9.590 -1.055 1.00 0.00 C ATOM 746 C ASP A 126 11.157 -8.412 -0.136 1.00 0.00 C ATOM 747 O ASP A 126 11.086 -8.554 1.082 1.00 0.00 O ATOM 748 CB ASP A 126 10.453 -9.111 -2.449 1.00 0.00 C ATOM 749 CG ASP A 126 11.646 -8.719 -3.296 1.00 0.00 C ATOM 750 OD1 ASP A 126 12.280 -9.610 -3.895 1.00 0.00 O ATOM 751 OD2 ASP A 126 11.971 -7.520 -3.337 1.00 0.00 O ATOM 0 H ASP A 126 8.879 -9.989 -0.532 1.00 0.00 H new ATOM 0 HA ASP A 126 11.766 -10.189 -1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 126 9.896 -9.901 -2.953 1.00 0.00 H new ATOM 0 HB3 ASP A 126 9.781 -8.258 -2.355 1.00 0.00 H new ATOM 756 N ARG A 127 11.487 -7.262 -0.699 1.00 0.00 N ATOM 757 CA ARG A 127 11.765 -6.086 0.108 1.00 0.00 C ATOM 758 C ARG A 127 11.048 -4.865 -0.444 1.00 0.00 C ATOM 759 O ARG A 127 10.866 -4.729 -1.654 1.00 0.00 O ATOM 760 CB ARG A 127 13.271 -5.826 0.196 1.00 0.00 C ATOM 761 CG ARG A 127 13.913 -5.446 -1.128 1.00 0.00 C ATOM 762 CD ARG A 127 14.958 -6.460 -1.555 1.00 0.00 C ATOM 763 NE ARG A 127 14.507 -7.254 -2.694 1.00 0.00 N ATOM 764 CZ ARG A 127 15.308 -7.737 -3.639 1.00 0.00 C ATOM 765 NH1 ARG A 127 16.595 -7.398 -3.671 1.00 0.00 N ATOM 766 NH2 ARG A 127 14.802 -8.534 -4.574 1.00 0.00 N ATOM 0 H ARG A 127 11.569 -7.118 -1.705 1.00 0.00 H new ATOM 0 HA ARG A 127 11.391 -6.277 1.114 1.00 0.00 H new ATOM 0 HB2 ARG A 127 13.450 -5.028 0.917 1.00 0.00 H new ATOM 0 HB3 ARG A 127 13.761 -6.720 0.582 1.00 0.00 H new ATOM 0 HG2 ARG A 127 13.144 -5.370 -1.897 1.00 0.00 H new ATOM 0 HG3 ARG A 127 14.375 -4.462 -1.040 1.00 0.00 H new ATOM 0 HD2 ARG A 127 15.882 -5.943 -1.815 1.00 0.00 H new ATOM 0 HD3 ARG A 127 15.187 -7.121 -0.719 1.00 0.00 H new ATOM 0 HE ARG A 127 13.509 -7.452 -2.770 1.00 0.00 H new ATOM 0 HH11 ARG A 127 16.973 -6.764 -2.967 1.00 0.00 H new ATOM 0 HH12 ARG A 127 17.203 -7.773 -4.399 1.00 0.00 H new ATOM 0 HH21 ARG A 127 13.809 -8.769 -4.561 1.00 0.00 H new ATOM 0 HH22 ARG A 127 15.406 -8.911 -5.304 1.00 0.00 H new ATOM 780 N PHE A 128 10.643 -3.983 0.452 1.00 0.00 N ATOM 781 CA PHE A 128 9.980 -2.750 0.074 1.00 0.00 C ATOM 782 C PHE A 128 10.426 -1.628 1.004 1.00 0.00 C ATOM 783 O PHE A 128 10.697 -1.858 2.189 1.00 0.00 O ATOM 784 CB PHE A 128 8.446 -2.933 0.083 1.00 0.00 C ATOM 785 CG PHE A 128 7.730 -2.373 1.284 1.00 0.00 C ATOM 786 CD1 PHE A 128 7.754 -3.038 2.501 1.00 0.00 C ATOM 787 CD2 PHE A 128 7.025 -1.184 1.191 1.00 0.00 C ATOM 788 CE1 PHE A 128 7.092 -2.527 3.602 1.00 0.00 C ATOM 789 CE2 PHE A 128 6.361 -0.668 2.286 1.00 0.00 C ATOM 790 CZ PHE A 128 6.394 -1.339 3.494 1.00 0.00 C ATOM 0 H PHE A 128 10.764 -4.101 1.458 1.00 0.00 H new ATOM 0 HA PHE A 128 10.262 -2.480 -0.944 1.00 0.00 H new ATOM 0 HB2 PHE A 128 8.037 -2.465 -0.812 1.00 0.00 H new ATOM 0 HB3 PHE A 128 8.225 -3.998 0.015 1.00 0.00 H new ATOM 0 HD1 PHE A 128 8.297 -3.967 2.590 1.00 0.00 H new ATOM 0 HD2 PHE A 128 6.994 -0.654 0.250 1.00 0.00 H new ATOM 0 HE1 PHE A 128 7.120 -3.055 4.544 1.00 0.00 H new ATOM 0 HE2 PHE A 128 5.816 0.260 2.199 1.00 0.00 H new ATOM 0 HZ PHE A 128 5.876 -0.936 4.351 1.00 0.00 H new ATOM 800 N HIS A 129 10.531 -0.426 0.464 1.00 0.00 N ATOM 801 CA HIS A 129 10.985 0.719 1.239 1.00 0.00 C ATOM 802 C HIS A 129 9.833 1.684 1.491 1.00 0.00 C ATOM 803 O HIS A 129 9.142 2.105 0.564 1.00 0.00 O ATOM 804 CB HIS A 129 12.137 1.432 0.519 1.00 0.00 C ATOM 805 CG HIS A 129 13.362 0.572 0.335 1.00 0.00 C ATOM 806 ND1 HIS A 129 14.156 0.211 1.400 1.00 0.00 N ATOM 807 CD2 HIS A 129 13.876 0.030 -0.796 1.00 0.00 C ATOM 808 CE1 HIS A 129 15.128 -0.535 0.897 1.00 0.00 C ATOM 809 NE2 HIS A 129 15.000 -0.671 -0.428 1.00 0.00 N ATOM 0 H HIS A 129 10.308 -0.216 -0.509 1.00 0.00 H new ATOM 0 HA HIS A 129 11.350 0.361 2.202 1.00 0.00 H new ATOM 0 HB2 HIS A 129 11.790 1.768 -0.458 1.00 0.00 H new ATOM 0 HB3 HIS A 129 12.411 2.323 1.084 1.00 0.00 H new ATOM 0 HD2 HIS A 129 13.479 0.130 -1.795 1.00 0.00 H new ATOM 0 HE1 HIS A 129 15.922 -0.977 1.481 1.00 0.00 H new ATOM 0 HE2 HIS A 129 15.619 -1.195 -1.047 1.00 0.00 H new ATOM 817 N TYR A 130 9.619 2.011 2.753 1.00 0.00 N ATOM 818 CA TYR A 130 8.566 2.928 3.140 1.00 0.00 C ATOM 819 C TYR A 130 9.171 4.074 3.941 1.00 0.00 C ATOM 820 O TYR A 130 9.457 3.928 5.129 1.00 0.00 O ATOM 821 CB TYR A 130 7.521 2.190 3.984 1.00 0.00 C ATOM 822 CG TYR A 130 6.143 2.814 3.971 1.00 0.00 C ATOM 823 CD1 TYR A 130 5.497 3.096 2.777 1.00 0.00 C ATOM 824 CD2 TYR A 130 5.482 3.108 5.159 1.00 0.00 C ATOM 825 CE1 TYR A 130 4.230 3.650 2.764 1.00 0.00 C ATOM 826 CE2 TYR A 130 4.218 3.662 5.153 1.00 0.00 C ATOM 827 CZ TYR A 130 3.597 3.931 3.956 1.00 0.00 C ATOM 828 OH TYR A 130 2.341 4.485 3.955 1.00 0.00 O ATOM 0 H TYR A 130 10.168 1.650 3.533 1.00 0.00 H new ATOM 0 HA TYR A 130 8.080 3.326 2.250 1.00 0.00 H new ATOM 0 HB2 TYR A 130 7.444 1.163 3.626 1.00 0.00 H new ATOM 0 HB3 TYR A 130 7.874 2.142 5.014 1.00 0.00 H new ATOM 0 HD1 TYR A 130 5.992 2.879 1.842 1.00 0.00 H new ATOM 0 HD2 TYR A 130 5.966 2.899 6.102 1.00 0.00 H new ATOM 0 HE1 TYR A 130 3.739 3.861 1.825 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.719 3.883 6.085 1.00 0.00 H new ATOM 0 HH TYR A 130 1.894 4.281 3.107 1.00 0.00 H new ATOM 838 N ILE A 131 9.352 5.212 3.293 1.00 0.00 N ATOM 839 CA ILE A 131 9.948 6.365 3.950 1.00 0.00 C ATOM 840 C ILE A 131 9.006 7.552 3.884 1.00 0.00 C ATOM 841 O ILE A 131 8.688 8.037 2.800 1.00 0.00 O ATOM 842 CB ILE A 131 11.313 6.767 3.336 1.00 0.00 C ATOM 843 CG1 ILE A 131 11.961 5.588 2.605 1.00 0.00 C ATOM 844 CG2 ILE A 131 12.240 7.292 4.423 1.00 0.00 C ATOM 845 CD1 ILE A 131 13.065 6.001 1.661 1.00 0.00 C ATOM 0 H ILE A 131 9.097 5.363 2.317 1.00 0.00 H new ATOM 0 HA ILE A 131 10.122 6.075 4.986 1.00 0.00 H new ATOM 0 HB ILE A 131 11.138 7.557 2.606 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.364 4.891 3.340 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.195 5.052 2.044 1.00 0.00 H new ATOM 0 HG21 ILE A 131 13.197 7.572 3.982 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.789 8.165 4.895 1.00 0.00 H new ATOM 0 HG23 ILE A 131 12.399 6.516 5.172 1.00 0.00 H new ATOM 0 HD11 ILE A 131 13.480 5.117 1.177 1.00 0.00 H new ATOM 0 HD12 ILE A 131 12.663 6.674 0.904 1.00 0.00 H new ATOM 0 HD13 ILE A 131 13.850 6.510 2.220 1.00 0.00 H new ATOM 857 N ASN A 132 8.545 7.988 5.054 1.00 0.00 N ATOM 858 CA ASN A 132 7.627 9.120 5.163 1.00 0.00 C ATOM 859 C ASN A 132 6.337 8.846 4.395 1.00 0.00 C ATOM 860 O ASN A 132 5.823 9.710 3.687 1.00 0.00 O ATOM 861 CB ASN A 132 8.288 10.412 4.662 1.00 0.00 C ATOM 862 CG ASN A 132 7.696 11.652 5.310 1.00 0.00 C ATOM 863 OD1 ASN A 132 7.736 11.805 6.533 1.00 0.00 O ATOM 864 ND2 ASN A 132 7.143 12.544 4.499 1.00 0.00 N ATOM 0 H ASN A 132 8.796 7.569 5.950 1.00 0.00 H new ATOM 0 HA ASN A 132 7.378 9.251 6.216 1.00 0.00 H new ATOM 0 HB2 ASN A 132 9.358 10.373 4.867 1.00 0.00 H new ATOM 0 HB3 ASN A 132 8.173 10.480 3.580 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.730 13.395 4.882 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.131 12.379 3.492 1.00 0.00 H new ATOM 871 N GLY A 133 5.827 7.625 4.528 1.00 0.00 N ATOM 872 CA GLY A 133 4.580 7.262 3.881 1.00 0.00 C ATOM 873 C GLY A 133 4.693 7.220 2.369 1.00 0.00 C ATOM 874 O GLY A 133 3.760 7.588 1.662 1.00 0.00 O ATOM 0 H GLY A 133 6.257 6.879 5.074 1.00 0.00 H new ATOM 0 HA2 GLY A 133 4.258 6.286 4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 133 3.808 7.977 4.163 1.00 0.00 H new ATOM 878 N SER A 134 5.840 6.784 1.868 1.00 0.00 N ATOM 879 CA SER A 134 6.056 6.713 0.435 1.00 0.00 C ATOM 880 C SER A 134 6.669 5.371 0.064 1.00 0.00 C ATOM 881 O SER A 134 7.576 4.887 0.747 1.00 0.00 O ATOM 882 CB SER A 134 6.951 7.866 -0.027 1.00 0.00 C ATOM 883 OG SER A 134 6.464 9.115 0.449 1.00 0.00 O ATOM 0 H SER A 134 6.631 6.476 2.433 1.00 0.00 H new ATOM 0 HA SER A 134 5.095 6.805 -0.071 1.00 0.00 H new ATOM 0 HB2 SER A 134 7.968 7.708 0.333 1.00 0.00 H new ATOM 0 HB3 SER A 134 6.997 7.881 -1.116 1.00 0.00 H new ATOM 0 HG SER A 134 7.054 9.835 0.142 1.00 0.00 H new ATOM 889 N LEU A 135 6.155 4.771 -0.998 1.00 0.00 N ATOM 890 CA LEU A 135 6.611 3.464 -1.439 1.00 0.00 C ATOM 891 C LEU A 135 7.769 3.594 -2.418 1.00 0.00 C ATOM 892 O LEU A 135 7.642 4.235 -3.461 1.00 0.00 O ATOM 893 CB LEU A 135 5.466 2.690 -2.093 1.00 0.00 C ATOM 894 CG LEU A 135 4.226 2.491 -1.218 1.00 0.00 C ATOM 895 CD1 LEU A 135 3.022 2.136 -2.077 1.00 0.00 C ATOM 896 CD2 LEU A 135 4.475 1.412 -0.180 1.00 0.00 C ATOM 0 H LEU A 135 5.416 5.173 -1.574 1.00 0.00 H new ATOM 0 HA LEU A 135 6.956 2.917 -0.562 1.00 0.00 H new ATOM 0 HB2 LEU A 135 5.169 3.213 -3.002 1.00 0.00 H new ATOM 0 HB3 LEU A 135 5.838 1.711 -2.396 1.00 0.00 H new ATOM 0 HG LEU A 135 4.016 3.426 -0.698 1.00 0.00 H new ATOM 0 HD11 LEU A 135 2.149 1.998 -1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 135 2.830 2.942 -2.786 1.00 0.00 H new ATOM 0 HD13 LEU A 135 3.223 1.214 -2.622 1.00 0.00 H new ATOM 0 HD21 LEU A 135 3.583 1.284 0.433 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.709 0.473 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 135 5.312 1.703 0.454 1.00 0.00 H new ATOM 908 N PHE A 136 8.897 3.002 -2.060 1.00 0.00 N ATOM 909 CA PHE A 136 10.075 2.986 -2.913 1.00 0.00 C ATOM 910 C PHE A 136 10.598 1.561 -3.028 1.00 0.00 C ATOM 911 O PHE A 136 10.186 0.682 -2.262 1.00 0.00 O ATOM 912 CB PHE A 136 11.159 3.898 -2.338 1.00 0.00 C ATOM 913 CG PHE A 136 10.739 5.335 -2.209 1.00 0.00 C ATOM 914 CD1 PHE A 136 10.465 6.093 -3.337 1.00 0.00 C ATOM 915 CD2 PHE A 136 10.623 5.925 -0.964 1.00 0.00 C ATOM 916 CE1 PHE A 136 10.083 7.414 -3.222 1.00 0.00 C ATOM 917 CE2 PHE A 136 10.243 7.248 -0.842 1.00 0.00 C ATOM 918 CZ PHE A 136 9.973 7.993 -1.974 1.00 0.00 C ATOM 0 H PHE A 136 9.022 2.519 -1.170 1.00 0.00 H new ATOM 0 HA PHE A 136 9.804 3.353 -3.903 1.00 0.00 H new ATOM 0 HB2 PHE A 136 11.451 3.525 -1.356 1.00 0.00 H new ATOM 0 HB3 PHE A 136 12.042 3.843 -2.975 1.00 0.00 H new ATOM 0 HD1 PHE A 136 10.551 5.645 -4.316 1.00 0.00 H new ATOM 0 HD2 PHE A 136 10.832 5.345 -0.077 1.00 0.00 H new ATOM 0 HE1 PHE A 136 9.870 7.994 -4.108 1.00 0.00 H new ATOM 0 HE2 PHE A 136 10.157 7.699 0.136 1.00 0.00 H new ATOM 0 HZ PHE A 136 9.676 9.027 -1.882 1.00 0.00 H new ATOM 928 N CYS A 137 11.511 1.326 -3.958 1.00 0.00 N ATOM 929 CA CYS A 137 12.027 -0.009 -4.166 1.00 0.00 C ATOM 930 C CYS A 137 13.551 -0.009 -4.249 1.00 0.00 C ATOM 931 O CYS A 137 14.205 0.998 -3.961 1.00 0.00 O ATOM 932 CB CYS A 137 11.396 -0.639 -5.413 1.00 0.00 C ATOM 933 SG CYS A 137 12.167 -0.160 -6.991 1.00 0.00 S ATOM 0 H CYS A 137 11.904 2.038 -4.573 1.00 0.00 H new ATOM 0 HA CYS A 137 11.753 -0.618 -3.305 1.00 0.00 H new ATOM 0 HB2 CYS A 137 11.444 -1.724 -5.317 1.00 0.00 H new ATOM 0 HB3 CYS A 137 10.341 -0.368 -5.444 1.00 0.00 H new ATOM 938 N GLU A 138 14.102 -1.140 -4.652 1.00 0.00 N ATOM 939 CA GLU A 138 15.543 -1.351 -4.649 1.00 0.00 C ATOM 940 C GLU A 138 16.226 -0.560 -5.753 1.00 0.00 C ATOM 941 O GLU A 138 17.376 -0.140 -5.608 1.00 0.00 O ATOM 942 CB GLU A 138 15.853 -2.834 -4.831 1.00 0.00 C ATOM 943 CG GLU A 138 15.610 -3.659 -3.584 1.00 0.00 C ATOM 944 CD GLU A 138 16.786 -3.639 -2.628 1.00 0.00 C ATOM 945 OE1 GLU A 138 17.103 -2.554 -2.095 1.00 0.00 O ATOM 946 OE2 GLU A 138 17.389 -4.711 -2.404 1.00 0.00 O ATOM 0 H GLU A 138 13.566 -1.939 -4.991 1.00 0.00 H new ATOM 0 HA GLU A 138 15.925 -1.004 -3.689 1.00 0.00 H new ATOM 0 HB2 GLU A 138 15.241 -3.228 -5.643 1.00 0.00 H new ATOM 0 HB3 GLU A 138 16.894 -2.945 -5.133 1.00 0.00 H new ATOM 0 HG2 GLU A 138 14.725 -3.282 -3.072 1.00 0.00 H new ATOM 0 HG3 GLU A 138 15.398 -4.689 -3.871 1.00 0.00 H new ATOM 953 N HIS A 139 15.518 -0.360 -6.856 1.00 0.00 N ATOM 954 CA HIS A 139 16.111 0.260 -8.031 1.00 0.00 C ATOM 955 C HIS A 139 16.482 1.713 -7.764 1.00 0.00 C ATOM 956 O HIS A 139 17.571 2.162 -8.133 1.00 0.00 O ATOM 957 CB HIS A 139 15.166 0.176 -9.229 1.00 0.00 C ATOM 958 CG HIS A 139 15.885 0.199 -10.540 1.00 0.00 C ATOM 959 ND1 HIS A 139 15.989 1.350 -11.280 1.00 0.00 N ATOM 960 CD2 HIS A 139 16.522 -0.804 -11.188 1.00 0.00 C ATOM 961 CE1 HIS A 139 16.678 1.024 -12.358 1.00 0.00 C ATOM 962 NE2 HIS A 139 17.025 -0.271 -12.345 1.00 0.00 N ATOM 0 H HIS A 139 14.537 -0.617 -6.961 1.00 0.00 H new ATOM 0 HA HIS A 139 17.023 -0.291 -8.263 1.00 0.00 H new ATOM 0 HB2 HIS A 139 14.579 -0.739 -9.159 1.00 0.00 H new ATOM 0 HB3 HIS A 139 14.464 1.009 -9.191 1.00 0.00 H new ATOM 0 HD2 HIS A 139 16.616 -1.828 -10.857 1.00 0.00 H new ATOM 0 HE1 HIS A 139 16.930 1.713 -13.150 1.00 0.00 H new ATOM 0 HE2 HIS A 139 17.561 -0.764 -13.059 1.00 0.00 H new ATOM 970 N ASP A 140 15.587 2.435 -7.110 1.00 0.00 N ATOM 971 CA ASP A 140 15.814 3.840 -6.821 1.00 0.00 C ATOM 972 C ASP A 140 16.485 4.010 -5.463 1.00 0.00 C ATOM 973 O ASP A 140 17.503 4.695 -5.368 1.00 0.00 O ATOM 974 CB ASP A 140 14.501 4.640 -6.903 1.00 0.00 C ATOM 975 CG ASP A 140 13.426 4.162 -5.943 1.00 0.00 C ATOM 976 OD1 ASP A 140 13.095 2.955 -5.955 1.00 0.00 O ATOM 977 OD2 ASP A 140 12.912 5.003 -5.172 1.00 0.00 O ATOM 0 H ASP A 140 14.697 2.071 -6.770 1.00 0.00 H new ATOM 0 HA ASP A 140 16.489 4.239 -7.578 1.00 0.00 H new ATOM 0 HB2 ASP A 140 14.714 5.690 -6.701 1.00 0.00 H new ATOM 0 HB3 ASP A 140 14.116 4.583 -7.921 1.00 0.00 H new ATOM 982 N ARG A 141 15.928 3.362 -4.432 1.00 0.00 N ATOM 983 CA ARG A 141 16.480 3.406 -3.070 1.00 0.00 C ATOM 984 C ARG A 141 16.945 4.822 -2.695 1.00 0.00 C ATOM 985 O ARG A 141 18.146 5.073 -2.561 1.00 0.00 O ATOM 986 CB ARG A 141 17.644 2.413 -2.936 1.00 0.00 C ATOM 987 CG ARG A 141 17.794 1.825 -1.541 1.00 0.00 C ATOM 988 CD ARG A 141 18.219 0.365 -1.591 1.00 0.00 C ATOM 989 NE ARG A 141 19.652 0.196 -1.335 1.00 0.00 N ATOM 990 CZ ARG A 141 20.338 -0.919 -1.601 1.00 0.00 C ATOM 991 NH1 ARG A 141 19.717 -2.008 -2.040 1.00 0.00 N ATOM 992 NH2 ARG A 141 21.650 -0.948 -1.399 1.00 0.00 N ATOM 0 H ARG A 141 15.085 2.794 -4.517 1.00 0.00 H new ATOM 0 HA ARG A 141 15.686 3.122 -2.380 1.00 0.00 H new ATOM 0 HB2 ARG A 141 17.500 1.601 -3.649 1.00 0.00 H new ATOM 0 HB3 ARG A 141 18.571 2.916 -3.209 1.00 0.00 H new ATOM 0 HG2 ARG A 141 18.531 2.400 -0.981 1.00 0.00 H new ATOM 0 HG3 ARG A 141 16.848 1.911 -1.006 1.00 0.00 H new ATOM 0 HD2 ARG A 141 17.651 -0.202 -0.854 1.00 0.00 H new ATOM 0 HD3 ARG A 141 17.975 -0.049 -2.569 1.00 0.00 H new ATOM 0 HE ARG A 141 20.159 0.981 -0.927 1.00 0.00 H new ATOM 0 HH11 ARG A 141 18.706 -1.998 -2.177 1.00 0.00 H new ATOM 0 HH12 ARG A 141 20.251 -2.854 -2.240 1.00 0.00 H new ATOM 0 HH21 ARG A 141 22.129 -0.121 -1.042 1.00 0.00 H new ATOM 0 HH22 ARG A 141 22.178 -1.797 -1.601 1.00 0.00 H new ATOM 1006 N PRO A 142 15.993 5.758 -2.514 1.00 0.00 N ATOM 1007 CA PRO A 142 16.296 7.177 -2.276 1.00 0.00 C ATOM 1008 C PRO A 142 17.077 7.405 -0.987 1.00 0.00 C ATOM 1009 O PRO A 142 16.501 7.585 0.089 1.00 0.00 O ATOM 1010 CB PRO A 142 14.917 7.838 -2.198 1.00 0.00 C ATOM 1011 CG PRO A 142 13.982 6.732 -1.860 1.00 0.00 C ATOM 1012 CD PRO A 142 14.545 5.500 -2.505 1.00 0.00 C ATOM 0 HA PRO A 142 16.931 7.587 -3.061 1.00 0.00 H new ATOM 0 HB2 PRO A 142 14.896 8.620 -1.438 1.00 0.00 H new ATOM 0 HB3 PRO A 142 14.649 8.306 -3.145 1.00 0.00 H new ATOM 0 HG2 PRO A 142 13.902 6.605 -0.780 1.00 0.00 H new ATOM 0 HG3 PRO A 142 12.979 6.942 -2.231 1.00 0.00 H new ATOM 0 HD2 PRO A 142 14.300 4.601 -1.939 1.00 0.00 H new ATOM 0 HD3 PRO A 142 14.155 5.359 -3.513 1.00 0.00 H new ATOM 1020 N THR A 143 18.396 7.427 -1.114 1.00 0.00 N ATOM 1021 CA THR A 143 19.292 7.533 0.026 1.00 0.00 C ATOM 1022 C THR A 143 19.356 8.961 0.564 1.00 0.00 C ATOM 1023 O THR A 143 20.158 9.277 1.443 1.00 0.00 O ATOM 1024 CB THR A 143 20.696 7.049 -0.367 1.00 0.00 C ATOM 1025 OG1 THR A 143 20.643 6.455 -1.676 1.00 0.00 O ATOM 1026 CG2 THR A 143 21.205 6.032 0.638 1.00 0.00 C ATOM 0 H THR A 143 18.875 7.372 -2.013 1.00 0.00 H new ATOM 0 HA THR A 143 18.899 6.900 0.822 1.00 0.00 H new ATOM 0 HB THR A 143 21.378 7.900 -0.376 1.00 0.00 H new ATOM 0 HG1 THR A 143 21.537 6.146 -1.931 1.00 0.00 H new ATOM 0 HG21 THR A 143 22.201 5.699 0.346 1.00 0.00 H new ATOM 0 HG22 THR A 143 21.251 6.489 1.627 1.00 0.00 H new ATOM 0 HG23 THR A 143 20.529 5.177 0.664 1.00 0.00 H new ATOM 1034 N ALA A 144 18.506 9.820 0.022 1.00 0.00 N ATOM 1035 CA ALA A 144 18.355 11.166 0.542 1.00 0.00 C ATOM 1036 C ALA A 144 17.324 11.176 1.667 1.00 0.00 C ATOM 1037 O ALA A 144 17.191 12.157 2.398 1.00 0.00 O ATOM 1038 CB ALA A 144 17.949 12.132 -0.563 1.00 0.00 C ATOM 0 H ALA A 144 17.911 9.607 -0.778 1.00 0.00 H new ATOM 0 HA ALA A 144 19.315 11.495 0.939 1.00 0.00 H new ATOM 0 HB1 ALA A 144 17.842 13.134 -0.149 1.00 0.00 H new ATOM 0 HB2 ALA A 144 18.715 12.140 -1.339 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.999 11.814 -0.993 1.00 0.00 H new ATOM 1044 N LEU A 145 16.596 10.066 1.791 1.00 0.00 N ATOM 1045 CA LEU A 145 15.592 9.912 2.836 1.00 0.00 C ATOM 1046 C LEU A 145 16.048 8.876 3.861 1.00 0.00 C ATOM 1047 O LEU A 145 16.036 9.133 5.063 1.00 0.00 O ATOM 1048 CB LEU A 145 14.247 9.501 2.231 1.00 0.00 C ATOM 1049 CG LEU A 145 13.439 10.642 1.609 1.00 0.00 C ATOM 1050 CD1 LEU A 145 13.240 10.405 0.122 1.00 0.00 C ATOM 1051 CD2 LEU A 145 12.099 10.789 2.312 1.00 0.00 C ATOM 0 H LEU A 145 16.686 9.258 1.175 1.00 0.00 H new ATOM 0 HA LEU A 145 15.468 10.871 3.339 1.00 0.00 H new ATOM 0 HB2 LEU A 145 14.426 8.745 1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 145 13.645 9.032 3.009 1.00 0.00 H new ATOM 0 HG LEU A 145 13.997 11.570 1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 145 12.663 11.226 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 145 14.211 10.350 -0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 145 12.703 9.469 -0.029 1.00 0.00 H new ATOM 0 HD21 LEU A 145 11.537 11.605 1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 145 11.534 9.862 2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 145 12.264 11.006 3.367 1.00 0.00 H new ATOM 1063 N ILE A 146 16.455 7.705 3.376 1.00 0.00 N ATOM 1064 CA ILE A 146 16.988 6.670 4.256 1.00 0.00 C ATOM 1065 C ILE A 146 18.456 6.961 4.562 1.00 0.00 C ATOM 1066 O ILE A 146 19.248 7.213 3.653 1.00 0.00 O ATOM 1067 CB ILE A 146 16.864 5.248 3.658 1.00 0.00 C ATOM 1068 CG1 ILE A 146 16.767 5.297 2.131 1.00 0.00 C ATOM 1069 CG2 ILE A 146 15.655 4.535 4.243 1.00 0.00 C ATOM 1070 CD1 ILE A 146 17.492 4.164 1.442 1.00 0.00 C ATOM 0 H ILE A 146 16.426 7.451 2.388 1.00 0.00 H new ATOM 0 HA ILE A 146 16.392 6.692 5.168 1.00 0.00 H new ATOM 0 HB ILE A 146 17.764 4.691 3.920 1.00 0.00 H new ATOM 0 HG12 ILE A 146 15.716 5.275 1.841 1.00 0.00 H new ATOM 0 HG13 ILE A 146 17.174 6.245 1.780 1.00 0.00 H new ATOM 0 HG21 ILE A 146 15.579 3.536 3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 146 15.766 4.458 5.325 1.00 0.00 H new ATOM 0 HG23 ILE A 146 14.752 5.099 4.010 1.00 0.00 H new ATOM 0 HD11 ILE A 146 17.380 4.264 0.362 1.00 0.00 H new ATOM 0 HD12 ILE A 146 18.550 4.198 1.702 1.00 0.00 H new ATOM 0 HD13 ILE A 146 17.069 3.212 1.764 1.00 0.00 H new ATOM 1082 N ASN A 147 18.801 6.941 5.842 1.00 0.00 N ATOM 1083 CA ASN A 147 20.134 7.336 6.295 1.00 0.00 C ATOM 1084 C ASN A 147 21.226 6.356 5.866 1.00 0.00 C ATOM 1085 O ASN A 147 21.495 5.366 6.552 1.00 0.00 O ATOM 1086 CB ASN A 147 20.154 7.474 7.817 1.00 0.00 C ATOM 1087 CG ASN A 147 21.022 8.628 8.284 1.00 0.00 C ATOM 1088 OD1 ASN A 147 20.530 9.727 8.541 1.00 0.00 O ATOM 1089 ND2 ASN A 147 22.319 8.390 8.409 1.00 0.00 N ATOM 0 H ASN A 147 18.173 6.654 6.593 1.00 0.00 H new ATOM 0 HA ASN A 147 20.349 8.294 5.822 1.00 0.00 H new ATOM 0 HB2 ASN A 147 19.136 7.619 8.179 1.00 0.00 H new ATOM 0 HB3 ASN A 147 20.520 6.547 8.258 1.00 0.00 H new ATOM 0 HD21 ASN A 147 22.945 9.130 8.727 1.00 0.00 H new ATOM 0 HD22 ASN A 147 22.692 7.467 8.187 1.00 0.00 H new ATOM 1096 N GLY A 201 21.844 6.638 4.724 1.00 0.00 N ATOM 1097 CA GLY A 201 23.061 5.944 4.330 1.00 0.00 C ATOM 1098 C GLY A 201 22.826 4.580 3.702 1.00 0.00 C ATOM 1099 O GLY A 201 23.158 4.365 2.536 1.00 0.00 O ATOM 0 H GLY A 201 21.522 7.340 4.058 1.00 0.00 H new ATOM 0 HA2 GLY A 201 23.608 6.567 3.623 1.00 0.00 H new ATOM 0 HA3 GLY A 201 23.697 5.823 5.207 1.00 0.00 H new ATOM 1103 N GLY A 202 22.269 3.657 4.468 1.00 0.00 N ATOM 1104 CA GLY A 202 22.147 2.290 4.006 1.00 0.00 C ATOM 1105 C GLY A 202 23.252 1.426 4.579 1.00 0.00 C ATOM 1106 O GLY A 202 24.288 1.225 3.942 1.00 0.00 O ATOM 0 H GLY A 202 21.898 3.829 5.403 1.00 0.00 H new ATOM 0 HA2 GLY A 202 21.177 1.888 4.298 1.00 0.00 H new ATOM 0 HA3 GLY A 202 22.188 2.265 2.917 1.00 0.00 H new ATOM 1110 N SER A 203 23.040 0.938 5.792 1.00 0.00 N ATOM 1111 CA SER A 203 24.060 0.196 6.521 1.00 0.00 C ATOM 1112 C SER A 203 24.145 -1.260 6.050 1.00 0.00 C ATOM 1113 O SER A 203 23.850 -2.189 6.806 1.00 0.00 O ATOM 1114 CB SER A 203 23.748 0.261 8.020 1.00 0.00 C ATOM 1115 OG SER A 203 22.670 1.156 8.274 1.00 0.00 O ATOM 0 H SER A 203 22.161 1.044 6.298 1.00 0.00 H new ATOM 0 HA SER A 203 25.031 0.652 6.326 1.00 0.00 H new ATOM 0 HB2 SER A 203 23.495 -0.734 8.387 1.00 0.00 H new ATOM 0 HB3 SER A 203 24.633 0.586 8.566 1.00 0.00 H new ATOM 0 HG SER A 203 22.486 1.182 9.236 1.00 0.00 H new ATOM 1121 N GLY A 204 24.553 -1.452 4.798 1.00 0.00 N ATOM 1122 CA GLY A 204 24.668 -2.792 4.244 1.00 0.00 C ATOM 1123 C GLY A 204 23.318 -3.338 3.839 1.00 0.00 C ATOM 1124 O GLY A 204 23.020 -3.472 2.653 1.00 0.00 O ATOM 0 H GLY A 204 24.807 -0.702 4.155 1.00 0.00 H new ATOM 0 HA2 GLY A 204 25.330 -2.774 3.378 1.00 0.00 H new ATOM 0 HA3 GLY A 204 25.124 -3.454 4.980 1.00 0.00 H new ATOM 1128 N GLY A 205 22.499 -3.641 4.832 1.00 0.00 N ATOM 1129 CA GLY A 205 21.147 -4.073 4.574 1.00 0.00 C ATOM 1130 C GLY A 205 20.155 -3.085 5.146 1.00 0.00 C ATOM 1131 O GLY A 205 20.269 -2.690 6.305 1.00 0.00 O ATOM 0 H GLY A 205 22.751 -3.594 5.819 1.00 0.00 H new ATOM 0 HA2 GLY A 205 20.990 -4.174 3.500 1.00 0.00 H new ATOM 0 HA3 GLY A 205 20.984 -5.057 5.014 1.00 0.00 H new ATOM 1135 N SER A 206 19.202 -2.656 4.336 1.00 0.00 N ATOM 1136 CA SER A 206 18.230 -1.668 4.768 1.00 0.00 C ATOM 1137 C SER A 206 16.880 -1.925 4.113 1.00 0.00 C ATOM 1138 O SER A 206 16.796 -2.616 3.099 1.00 0.00 O ATOM 1139 CB SER A 206 18.727 -0.263 4.428 1.00 0.00 C ATOM 1140 OG SER A 206 20.009 -0.030 4.990 1.00 0.00 O ATOM 0 H SER A 206 19.081 -2.977 3.375 1.00 0.00 H new ATOM 0 HA SER A 206 18.107 -1.747 5.848 1.00 0.00 H new ATOM 0 HB2 SER A 206 18.772 -0.141 3.346 1.00 0.00 H new ATOM 0 HB3 SER A 206 18.021 0.478 4.803 1.00 0.00 H new ATOM 0 HG SER A 206 19.963 0.732 5.604 1.00 0.00 H new ATOM 1146 N GLY A 207 15.832 -1.377 4.707 1.00 0.00 N ATOM 1147 CA GLY A 207 14.501 -1.526 4.153 1.00 0.00 C ATOM 1148 C GLY A 207 13.658 -2.499 4.941 1.00 0.00 C ATOM 1149 O GLY A 207 14.014 -2.868 6.059 1.00 0.00 O ATOM 0 H GLY A 207 15.879 -0.829 5.566 1.00 0.00 H new ATOM 0 HA2 GLY A 207 14.007 -0.554 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 207 14.576 -1.867 3.120 1.00 0.00 H new ATOM 1153 N SER A 208 12.545 -2.910 4.360 1.00 0.00 N ATOM 1154 CA SER A 208 11.625 -3.824 5.018 1.00 0.00 C ATOM 1155 C SER A 208 11.217 -4.933 4.057 1.00 0.00 C ATOM 1156 O SER A 208 11.549 -4.879 2.877 1.00 0.00 O ATOM 1157 CB SER A 208 10.391 -3.054 5.488 1.00 0.00 C ATOM 1158 OG SER A 208 10.322 -1.777 4.867 1.00 0.00 O ATOM 0 H SER A 208 12.254 -2.623 3.426 1.00 0.00 H new ATOM 0 HA SER A 208 12.117 -4.273 5.881 1.00 0.00 H new ATOM 0 HB2 SER A 208 9.492 -3.624 5.256 1.00 0.00 H new ATOM 0 HB3 SER A 208 10.423 -2.935 6.571 1.00 0.00 H new ATOM 0 HG SER A 208 10.307 -1.887 3.893 1.00 0.00 H new ATOM 1164 N ILE A 404 10.508 -5.933 4.557 1.00 0.00 N ATOM 1165 CA ILE A 404 9.996 -6.998 3.706 1.00 0.00 C ATOM 1166 C ILE A 404 8.675 -6.561 3.088 1.00 0.00 C ATOM 1167 O ILE A 404 8.619 -6.178 1.922 1.00 0.00 O ATOM 1168 CB ILE A 404 9.795 -8.316 4.500 1.00 0.00 C ATOM 1169 CG1 ILE A 404 11.136 -8.826 5.047 1.00 0.00 C ATOM 1170 CG2 ILE A 404 9.121 -9.381 3.640 1.00 0.00 C ATOM 1171 CD1 ILE A 404 12.076 -9.359 3.982 1.00 0.00 C ATOM 0 H ILE A 404 10.274 -6.030 5.545 1.00 0.00 H new ATOM 0 HA ILE A 404 10.729 -7.190 2.922 1.00 0.00 H new ATOM 0 HB ILE A 404 9.137 -8.104 5.343 1.00 0.00 H new ATOM 0 HG12 ILE A 404 11.631 -8.014 5.580 1.00 0.00 H new ATOM 0 HG13 ILE A 404 10.943 -9.615 5.774 1.00 0.00 H new ATOM 0 HG21 ILE A 404 8.994 -10.293 4.223 1.00 0.00 H new ATOM 0 HG22 ILE A 404 8.146 -9.021 3.312 1.00 0.00 H new ATOM 0 HG23 ILE A 404 9.741 -9.591 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 404 13.000 -9.699 4.450 1.00 0.00 H new ATOM 0 HD12 ILE A 404 11.603 -10.193 3.464 1.00 0.00 H new ATOM 0 HD13 ILE A 404 12.301 -8.568 3.267 1.00 0.00 H new ATOM 1183 N ALA A 405 7.624 -6.592 3.900 1.00 0.00 N ATOM 1184 CA ALA A 405 6.290 -6.202 3.474 1.00 0.00 C ATOM 1185 C ALA A 405 5.318 -6.367 4.628 1.00 0.00 C ATOM 1186 O ALA A 405 5.539 -7.196 5.511 1.00 0.00 O ATOM 1187 CB ALA A 405 5.828 -7.040 2.287 1.00 0.00 C ATOM 0 H ALA A 405 7.676 -6.889 4.874 1.00 0.00 H new ATOM 0 HA ALA A 405 6.319 -5.157 3.164 1.00 0.00 H new ATOM 0 HB1 ALA A 405 4.827 -6.728 1.989 1.00 0.00 H new ATOM 0 HB2 ALA A 405 6.516 -6.900 1.453 1.00 0.00 H new ATOM 0 HB3 ALA A 405 5.810 -8.093 2.570 1.00 0.00 H new ATOM 1193 N PRO A 406 4.242 -5.567 4.656 1.00 0.00 N ATOM 1194 CA PRO A 406 3.161 -5.748 5.624 1.00 0.00 C ATOM 1195 C PRO A 406 2.388 -7.024 5.332 1.00 0.00 C ATOM 1196 O PRO A 406 1.645 -7.522 6.179 1.00 0.00 O ATOM 1197 CB PRO A 406 2.264 -4.517 5.426 1.00 0.00 C ATOM 1198 CG PRO A 406 3.064 -3.569 4.599 1.00 0.00 C ATOM 1199 CD PRO A 406 4.001 -4.414 3.782 1.00 0.00 C ATOM 0 HA PRO A 406 3.528 -5.837 6.646 1.00 0.00 H new ATOM 0 HB2 PRO A 406 1.334 -4.786 4.925 1.00 0.00 H new ATOM 0 HB3 PRO A 406 1.993 -4.071 6.383 1.00 0.00 H new ATOM 0 HG2 PRO A 406 2.417 -2.972 3.956 1.00 0.00 H new ATOM 0 HG3 PRO A 406 3.617 -2.873 5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 406 3.555 -4.712 2.833 1.00 0.00 H new ATOM 0 HD3 PRO A 406 4.924 -3.884 3.548 1.00 0.00 H new ATOM 1207 N PHE A 407 2.595 -7.530 4.109 1.00 0.00 N ATOM 1208 CA PHE A 407 1.993 -8.772 3.631 1.00 0.00 C ATOM 1209 C PHE A 407 0.510 -8.583 3.319 1.00 0.00 C ATOM 1210 O PHE A 407 -0.181 -7.805 3.975 1.00 0.00 O ATOM 1211 CB PHE A 407 2.183 -9.909 4.644 1.00 0.00 C ATOM 1212 CG PHE A 407 3.330 -10.827 4.321 1.00 0.00 C ATOM 1213 CD1 PHE A 407 4.634 -10.360 4.332 1.00 0.00 C ATOM 1214 CD2 PHE A 407 3.102 -12.159 4.009 1.00 0.00 C ATOM 1215 CE1 PHE A 407 5.689 -11.203 4.037 1.00 0.00 C ATOM 1216 CE2 PHE A 407 4.154 -13.007 3.714 1.00 0.00 C ATOM 1217 CZ PHE A 407 5.449 -12.528 3.728 1.00 0.00 C ATOM 0 H PHE A 407 3.194 -7.079 3.418 1.00 0.00 H new ATOM 0 HA PHE A 407 2.505 -9.047 2.709 1.00 0.00 H new ATOM 0 HB2 PHE A 407 2.342 -9.479 5.633 1.00 0.00 H new ATOM 0 HB3 PHE A 407 1.265 -10.494 4.695 1.00 0.00 H new ATOM 0 HD1 PHE A 407 4.829 -9.326 4.574 1.00 0.00 H new ATOM 0 HD2 PHE A 407 2.091 -12.539 3.996 1.00 0.00 H new ATOM 0 HE1 PHE A 407 6.701 -10.826 4.048 1.00 0.00 H new ATOM 0 HE2 PHE A 407 3.963 -14.042 3.473 1.00 0.00 H new ATOM 0 HZ PHE A 407 6.273 -13.188 3.498 1.00 0.00 H new ATOM 1227 N PRO A 408 0.007 -9.288 2.294 1.00 0.00 N ATOM 1228 CA PRO A 408 -1.407 -9.235 1.929 1.00 0.00 C ATOM 1229 C PRO A 408 -2.291 -9.858 3.002 1.00 0.00 C ATOM 1230 O PRO A 408 -2.215 -11.060 3.276 1.00 0.00 O ATOM 1231 CB PRO A 408 -1.483 -10.040 0.636 1.00 0.00 C ATOM 1232 CG PRO A 408 -0.297 -10.938 0.673 1.00 0.00 C ATOM 1233 CD PRO A 408 0.771 -10.185 1.414 1.00 0.00 C ATOM 0 HA PRO A 408 -1.762 -8.211 1.817 1.00 0.00 H new ATOM 0 HB2 PRO A 408 -2.410 -10.611 0.580 1.00 0.00 H new ATOM 0 HB3 PRO A 408 -1.458 -9.388 -0.237 1.00 0.00 H new ATOM 0 HG2 PRO A 408 -0.533 -11.876 1.176 1.00 0.00 H new ATOM 0 HG3 PRO A 408 0.032 -11.191 -0.335 1.00 0.00 H new ATOM 0 HD2 PRO A 408 1.414 -10.856 1.984 1.00 0.00 H new ATOM 0 HD3 PRO A 408 1.415 -9.628 0.734 1.00 0.00 H new ATOM 1241 N GLU A 409 -3.120 -9.033 3.604 1.00 0.00 N ATOM 1242 CA GLU A 409 -3.990 -9.471 4.678 1.00 0.00 C ATOM 1243 C GLU A 409 -5.392 -8.930 4.454 1.00 0.00 C ATOM 1244 O GLU A 409 -5.624 -8.160 3.528 1.00 0.00 O ATOM 1245 CB GLU A 409 -3.450 -8.984 6.021 1.00 0.00 C ATOM 1246 CG GLU A 409 -3.220 -10.093 7.031 1.00 0.00 C ATOM 1247 CD GLU A 409 -3.187 -9.567 8.449 1.00 0.00 C ATOM 1248 OE1 GLU A 409 -2.100 -9.153 8.910 1.00 0.00 O ATOM 1249 OE2 GLU A 409 -4.246 -9.527 9.102 1.00 0.00 O ATOM 0 H GLU A 409 -3.211 -8.045 3.366 1.00 0.00 H new ATOM 0 HA GLU A 409 -4.024 -10.560 4.688 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -2.510 -8.458 5.854 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -4.149 -8.262 6.442 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -4.010 -10.838 6.938 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -2.279 -10.597 6.809 1.00 0.00 H new ATOM 1256 N ALA A 410 -6.319 -9.328 5.298 1.00 0.00 N ATOM 1257 CA ALA A 410 -7.678 -8.847 5.189 1.00 0.00 C ATOM 1258 C ALA A 410 -7.914 -7.741 6.205 1.00 0.00 C ATOM 1259 O ALA A 410 -7.485 -7.842 7.354 1.00 0.00 O ATOM 1260 CB ALA A 410 -8.661 -9.984 5.395 1.00 0.00 C ATOM 0 H ALA A 410 -6.157 -9.981 6.065 1.00 0.00 H new ATOM 0 HA ALA A 410 -7.834 -8.444 4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 410 -9.679 -9.605 5.310 1.00 0.00 H new ATOM 0 HB2 ALA A 410 -8.495 -10.750 4.638 1.00 0.00 H new ATOM 0 HB3 ALA A 410 -8.516 -10.415 6.386 1.00 0.00 H new ATOM 1266 N ALA A 411 -8.559 -6.672 5.769 1.00 0.00 N ATOM 1267 CA ALA A 411 -8.933 -5.601 6.673 1.00 0.00 C ATOM 1268 C ALA A 411 -10.274 -5.926 7.322 1.00 0.00 C ATOM 1269 O ALA A 411 -10.351 -6.747 8.235 1.00 0.00 O ATOM 1270 CB ALA A 411 -8.985 -4.275 5.929 1.00 0.00 C ATOM 0 H ALA A 411 -8.833 -6.524 4.798 1.00 0.00 H new ATOM 0 HA ALA A 411 -8.183 -5.510 7.458 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -9.267 -3.481 6.620 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -8.005 -4.057 5.506 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -9.721 -4.336 5.127 1.00 0.00 H new ATOM 1276 N LEU A 412 -11.328 -5.287 6.847 1.00 0.00 N ATOM 1277 CA LEU A 412 -12.674 -5.599 7.289 1.00 0.00 C ATOM 1278 C LEU A 412 -13.571 -5.747 6.070 1.00 0.00 C ATOM 1279 O LEU A 412 -13.424 -4.996 5.108 1.00 0.00 O ATOM 1280 CB LEU A 412 -13.208 -4.517 8.234 1.00 0.00 C ATOM 1281 CG LEU A 412 -12.773 -4.667 9.693 1.00 0.00 C ATOM 1282 CD1 LEU A 412 -13.346 -3.538 10.527 1.00 0.00 C ATOM 1283 CD2 LEU A 412 -13.213 -6.014 10.247 1.00 0.00 C ATOM 0 H LEU A 412 -11.276 -4.544 6.150 1.00 0.00 H new ATOM 0 HA LEU A 412 -12.662 -6.536 7.846 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -12.880 -3.543 7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -14.297 -4.523 8.192 1.00 0.00 H new ATOM 0 HG LEU A 412 -11.685 -4.618 9.738 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -13.030 -3.655 11.564 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -12.986 -2.583 10.143 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -14.434 -3.563 10.474 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -12.894 -6.102 11.286 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -14.299 -6.093 10.193 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -12.761 -6.814 9.660 1.00 0.00 H new ATOM 1295 N PRO A 413 -14.485 -6.733 6.082 1.00 0.00 N ATOM 1296 CA PRO A 413 -15.414 -6.970 4.969 1.00 0.00 C ATOM 1297 C PRO A 413 -16.199 -5.715 4.595 1.00 0.00 C ATOM 1298 O PRO A 413 -16.729 -5.018 5.467 1.00 0.00 O ATOM 1299 CB PRO A 413 -16.353 -8.051 5.510 1.00 0.00 C ATOM 1300 CG PRO A 413 -15.557 -8.751 6.554 1.00 0.00 C ATOM 1301 CD PRO A 413 -14.686 -7.697 7.178 1.00 0.00 C ATOM 0 HA PRO A 413 -14.893 -7.262 4.057 1.00 0.00 H new ATOM 0 HB2 PRO A 413 -17.260 -7.615 5.929 1.00 0.00 H new ATOM 0 HB3 PRO A 413 -16.664 -8.737 4.722 1.00 0.00 H new ATOM 0 HG2 PRO A 413 -16.207 -9.212 7.298 1.00 0.00 H new ATOM 0 HG3 PRO A 413 -14.955 -9.548 6.118 1.00 0.00 H new ATOM 0 HD2 PRO A 413 -15.169 -7.233 8.038 1.00 0.00 H new ATOM 0 HD3 PRO A 413 -13.741 -8.111 7.528 1.00 0.00 H new ATOM 1309 N THR A 414 -16.266 -5.437 3.299 1.00 0.00 N ATOM 1310 CA THR A 414 -16.953 -4.258 2.798 1.00 0.00 C ATOM 1311 C THR A 414 -18.419 -4.243 3.220 1.00 0.00 C ATOM 1312 O THR A 414 -19.071 -5.290 3.259 1.00 0.00 O ATOM 1313 CB THR A 414 -16.888 -4.209 1.264 1.00 0.00 C ATOM 1314 OG1 THR A 414 -15.566 -4.539 0.813 1.00 0.00 O ATOM 1315 CG2 THR A 414 -17.286 -2.833 0.748 1.00 0.00 C ATOM 0 H THR A 414 -15.849 -6.019 2.572 1.00 0.00 H new ATOM 0 HA THR A 414 -16.450 -3.390 3.224 1.00 0.00 H new ATOM 0 HB THR A 414 -17.592 -4.941 0.870 1.00 0.00 H new ATOM 0 HG1 THR A 414 -14.917 -4.321 1.514 1.00 0.00 H new ATOM 0 HG21 THR A 414 -17.232 -2.823 -0.341 1.00 0.00 H new ATOM 0 HG22 THR A 414 -18.305 -2.607 1.063 1.00 0.00 H new ATOM 0 HG23 THR A 414 -16.606 -2.082 1.152 1.00 0.00 H new ATOM 1323 N SER A 415 -18.921 -3.060 3.555 1.00 0.00 N ATOM 1324 CA SER A 415 -20.340 -2.874 3.809 1.00 0.00 C ATOM 1325 C SER A 415 -21.104 -2.929 2.490 1.00 0.00 C ATOM 1326 O SER A 415 -21.499 -1.897 1.944 1.00 0.00 O ATOM 1327 CB SER A 415 -20.591 -1.533 4.505 1.00 0.00 C ATOM 1328 OG SER A 415 -19.410 -1.043 5.127 1.00 0.00 O ATOM 0 H SER A 415 -18.361 -2.213 3.657 1.00 0.00 H new ATOM 0 HA SER A 415 -20.689 -3.672 4.465 1.00 0.00 H new ATOM 0 HB2 SER A 415 -20.950 -0.805 3.777 1.00 0.00 H new ATOM 0 HB3 SER A 415 -21.376 -1.650 5.252 1.00 0.00 H new ATOM 0 HG SER A 415 -19.601 -0.185 5.561 1.00 0.00 H new ATOM 1334 N HIS A 416 -21.280 -4.135 1.971 1.00 0.00 N ATOM 1335 CA HIS A 416 -21.933 -4.336 0.689 1.00 0.00 C ATOM 1336 C HIS A 416 -23.449 -4.334 0.862 1.00 0.00 C ATOM 1337 O HIS A 416 -24.014 -5.260 1.446 1.00 0.00 O ATOM 1338 CB HIS A 416 -21.457 -5.656 0.068 1.00 0.00 C ATOM 1339 CG HIS A 416 -21.963 -5.897 -1.321 1.00 0.00 C ATOM 1340 ND1 HIS A 416 -21.427 -5.254 -2.411 1.00 0.00 N ATOM 1341 CD2 HIS A 416 -22.951 -6.715 -1.735 1.00 0.00 C ATOM 1342 CE1 HIS A 416 -22.107 -5.693 -3.457 1.00 0.00 C ATOM 1343 NE2 HIS A 416 -23.046 -6.580 -3.095 1.00 0.00 N ATOM 0 H HIS A 416 -20.976 -4.996 2.425 1.00 0.00 H new ATOM 0 HA HIS A 416 -21.668 -3.519 0.018 1.00 0.00 H new ATOM 0 HB2 HIS A 416 -20.367 -5.665 0.053 1.00 0.00 H new ATOM 0 HB3 HIS A 416 -21.774 -6.480 0.707 1.00 0.00 H new ATOM 0 HD2 HIS A 416 -23.555 -7.357 -1.111 1.00 0.00 H new ATOM 0 HE1 HIS A 416 -21.929 -5.377 -4.474 1.00 0.00 H new ATOM 0 HE2 HIS A 416 -23.702 -7.060 -3.711 1.00 0.00 H new ATOM 1351 N PRO A 417 -24.121 -3.281 0.374 1.00 0.00 N ATOM 1352 CA PRO A 417 -25.565 -3.131 0.527 1.00 0.00 C ATOM 1353 C PRO A 417 -26.358 -3.920 -0.515 1.00 0.00 C ATOM 1354 O PRO A 417 -27.505 -4.307 -0.277 1.00 0.00 O ATOM 1355 CB PRO A 417 -25.767 -1.630 0.336 1.00 0.00 C ATOM 1356 CG PRO A 417 -24.682 -1.212 -0.600 1.00 0.00 C ATOM 1357 CD PRO A 417 -23.521 -2.142 -0.353 1.00 0.00 C ATOM 0 HA PRO A 417 -25.920 -3.514 1.484 1.00 0.00 H new ATOM 0 HB2 PRO A 417 -26.752 -1.414 -0.079 1.00 0.00 H new ATOM 0 HB3 PRO A 417 -25.697 -1.098 1.285 1.00 0.00 H new ATOM 0 HG2 PRO A 417 -25.017 -1.276 -1.635 1.00 0.00 H new ATOM 0 HG3 PRO A 417 -24.394 -0.176 -0.422 1.00 0.00 H new ATOM 0 HD2 PRO A 417 -23.061 -2.463 -1.288 1.00 0.00 H new ATOM 0 HD3 PRO A 417 -22.741 -1.659 0.236 1.00 0.00 H new ATOM 1365 N LYS A 418 -25.751 -4.118 -1.678 1.00 0.00 N ATOM 1366 CA LYS A 418 -26.384 -4.847 -2.772 1.00 0.00 C ATOM 1367 C LYS A 418 -26.202 -6.358 -2.613 1.00 0.00 C ATOM 1368 O LYS A 418 -26.565 -6.900 -1.548 1.00 0.00 O ATOM 1369 CB LYS A 418 -25.811 -4.381 -4.113 1.00 0.00 C ATOM 1370 CG LYS A 418 -26.878 -4.039 -5.142 1.00 0.00 C ATOM 1371 CD LYS A 418 -26.498 -4.544 -6.522 1.00 0.00 C ATOM 1372 CE LYS A 418 -26.476 -6.062 -6.578 1.00 0.00 C ATOM 1373 NZ LYS A 418 -25.929 -6.558 -7.865 1.00 0.00 N ATOM 1374 OXT LYS A 418 -25.685 -6.996 -3.560 1.00 0.00 O ATOM 0 H LYS A 418 -24.812 -3.781 -1.890 1.00 0.00 H new ATOM 0 HA LYS A 418 -27.453 -4.635 -2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -25.184 -3.505 -3.947 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -25.167 -5.163 -4.515 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -27.829 -4.478 -4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -27.021 -2.959 -5.175 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -27.207 -4.163 -7.257 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -25.517 -4.155 -6.794 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -25.874 -6.447 -5.755 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -27.487 -6.445 -6.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -25.930 -7.598 -7.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -26.518 -6.211 -8.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -24.955 -6.213 -7.984 1.00 0.00 H new TER 1388 LYS A 418 HETATM 1389 ZN ZN A1001 -5.892 0.079 -4.042 1.00 0.00 ZN HETATM 1390 ZN ZN A1002 11.837 2.086 -7.296 1.00 0.00 ZN