USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 780 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 87 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 91 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-0.71) USER MOD Single : A 1 GLY N :NH3+ -171:sc= -0.0121 (180deg=-0.0827) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0.0318 USER MOD Single : A 9 SER OG : rot 48:sc= 1.19 USER MOD Single : A 12 SER OG : rot 49:sc= 1.13 USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0576 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -158:sc= -0.345 (180deg=-0.64) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.027 USER MOD Single : A 29 GLN : amide:sc= 0.0257 K(o=0.026,f=-0.93) USER MOD Single : A 35 CYS SG : rot 170:sc= -2.69! USER MOD Single : A 38 GLN : amide:sc= -0.253 X(o=-0.25,f=-0.25) USER MOD Single : A 44 MET CE :methyl -119:sc= -3.22! (180deg=-3.82!) USER MOD Single : A 46 HIS : no HD1:sc= -0.149 X(o=-0.15,f=-0.0079) USER MOD Single : A 49 ASN : amide:sc= -4.87 K(o=-4.9,f=-11!) USER MOD Single : A 61 GLN : amide:sc= -0.0892 X(o=-0.089,f=-0.36) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 152:sc= 0.275 (180deg=0.0423) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot -140:sc= -0.125 USER MOD Single : A 82 GLN : amide:sc= -1.02 X(o=-1,f=-0.54) USER MOD Single : A 83 THR OG1 : rot 86:sc= 1.14 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 40:sc= 0.413 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0755 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.553 13.603 25.345 1.00 0.00 N ATOM 2 CA GLY A 1 -2.603 14.011 26.776 1.00 0.00 C ATOM 3 C GLY A 1 -2.384 15.499 26.964 1.00 0.00 C ATOM 4 O GLY A 1 -2.974 16.113 27.853 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.857 12.613 25.256 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.186 14.212 24.788 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.580 13.699 24.990 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.570 13.734 27.196 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.844 13.462 27.334 1.00 0.00 H new ATOM 10 N SER A 2 -1.533 16.079 26.125 1.00 0.00 N ATOM 11 CA SER A 2 -1.236 17.506 26.202 1.00 0.00 C ATOM 12 C SER A 2 -2.495 18.335 25.969 1.00 0.00 C ATOM 13 O SER A 2 -2.655 19.413 26.542 1.00 0.00 O ATOM 14 CB SER A 2 -0.166 17.881 25.176 1.00 0.00 C ATOM 15 OG SER A 2 -0.547 17.482 23.871 1.00 0.00 O ATOM 0 H SER A 2 -1.037 15.584 25.384 1.00 0.00 H new ATOM 0 HA SER A 2 -0.860 17.722 27.202 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.000 18.958 25.196 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.779 17.408 25.443 1.00 0.00 H new ATOM 0 HG SER A 2 0.153 17.735 23.234 1.00 0.00 H new ATOM 21 N SER A 3 -3.385 17.826 25.125 1.00 0.00 N ATOM 22 CA SER A 3 -4.631 18.519 24.816 1.00 0.00 C ATOM 23 C SER A 3 -4.354 19.876 24.177 1.00 0.00 C ATOM 24 O SER A 3 -3.288 20.460 24.372 1.00 0.00 O ATOM 25 CB SER A 3 -5.467 18.701 26.084 1.00 0.00 C ATOM 26 OG SER A 3 -6.842 18.849 25.774 1.00 0.00 O ATOM 0 H SER A 3 -3.267 16.935 24.642 1.00 0.00 H new ATOM 0 HA SER A 3 -5.190 17.910 24.106 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.330 17.841 26.740 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.118 19.577 26.630 1.00 0.00 H new ATOM 0 HG SER A 3 -7.354 18.962 26.602 1.00 0.00 H new ATOM 32 N GLY A 4 -5.322 20.373 23.414 1.00 0.00 N ATOM 33 CA GLY A 4 -5.164 21.658 22.759 1.00 0.00 C ATOM 34 C GLY A 4 -4.413 21.552 21.446 1.00 0.00 C ATOM 35 O GLY A 4 -3.610 22.423 21.110 1.00 0.00 O ATOM 0 H GLY A 4 -6.213 19.909 23.238 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.147 22.093 22.578 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.632 22.338 23.424 1.00 0.00 H new ATOM 39 N SER A 5 -4.676 20.483 20.701 1.00 0.00 N ATOM 40 CA SER A 5 -4.020 20.268 19.416 1.00 0.00 C ATOM 41 C SER A 5 -4.586 21.202 18.353 1.00 0.00 C ATOM 42 O SER A 5 -5.678 20.976 17.831 1.00 0.00 O ATOM 43 CB SER A 5 -4.185 18.812 18.974 1.00 0.00 C ATOM 44 OG SER A 5 -3.196 18.452 18.025 1.00 0.00 O ATOM 0 H SER A 5 -5.338 19.753 20.965 1.00 0.00 H new ATOM 0 HA SER A 5 -2.959 20.486 19.536 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.117 18.155 19.841 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.176 18.670 18.543 1.00 0.00 H new ATOM 0 HG SER A 5 -3.322 17.517 17.760 1.00 0.00 H new ATOM 50 N SER A 6 -3.837 22.254 18.037 1.00 0.00 N ATOM 51 CA SER A 6 -4.265 23.223 17.035 1.00 0.00 C ATOM 52 C SER A 6 -3.235 23.341 15.916 1.00 0.00 C ATOM 53 O SER A 6 -3.074 24.403 15.318 1.00 0.00 O ATOM 54 CB SER A 6 -4.490 24.591 17.683 1.00 0.00 C ATOM 55 OG SER A 6 -5.529 25.301 17.031 1.00 0.00 O ATOM 0 H SER A 6 -2.931 22.457 18.460 1.00 0.00 H new ATOM 0 HA SER A 6 -5.203 22.873 16.605 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.740 24.461 18.736 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.568 25.172 17.643 1.00 0.00 H new ATOM 0 HG SER A 6 -5.653 26.171 17.465 1.00 0.00 H new ATOM 61 N GLY A 7 -2.540 22.242 15.641 1.00 0.00 N ATOM 62 CA GLY A 7 -1.535 22.244 14.595 1.00 0.00 C ATOM 63 C GLY A 7 -2.070 21.725 13.274 1.00 0.00 C ATOM 64 O GLY A 7 -2.277 22.494 12.335 1.00 0.00 O ATOM 0 H GLY A 7 -2.655 21.351 16.124 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.160 23.258 14.458 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.689 21.631 14.907 1.00 0.00 H new ATOM 68 N SER A 8 -2.294 20.417 13.201 1.00 0.00 N ATOM 69 CA SER A 8 -2.808 19.797 11.986 1.00 0.00 C ATOM 70 C SER A 8 -4.328 19.684 12.032 1.00 0.00 C ATOM 71 O SER A 8 -4.965 20.133 12.986 1.00 0.00 O ATOM 72 CB SER A 8 -2.188 18.412 11.793 1.00 0.00 C ATOM 73 OG SER A 8 -1.938 17.787 13.040 1.00 0.00 O ATOM 0 H SER A 8 -2.128 19.766 13.969 1.00 0.00 H new ATOM 0 HA SER A 8 -2.535 20.431 11.142 1.00 0.00 H new ATOM 0 HB2 SER A 8 -2.857 17.790 11.199 1.00 0.00 H new ATOM 0 HB3 SER A 8 -1.256 18.502 11.234 1.00 0.00 H new ATOM 0 HG SER A 8 -1.543 16.903 12.889 1.00 0.00 H new ATOM 79 N SER A 9 -4.904 19.082 10.998 1.00 0.00 N ATOM 80 CA SER A 9 -6.351 18.910 10.921 1.00 0.00 C ATOM 81 C SER A 9 -6.734 18.055 9.717 1.00 0.00 C ATOM 82 O SER A 9 -7.609 17.195 9.809 1.00 0.00 O ATOM 83 CB SER A 9 -7.044 20.272 10.835 1.00 0.00 C ATOM 84 OG SER A 9 -7.426 20.732 12.120 1.00 0.00 O ATOM 0 H SER A 9 -4.392 18.705 10.201 1.00 0.00 H new ATOM 0 HA SER A 9 -6.680 18.399 11.826 1.00 0.00 H new ATOM 0 HB2 SER A 9 -6.374 20.996 10.371 1.00 0.00 H new ATOM 0 HB3 SER A 9 -7.924 20.196 10.196 1.00 0.00 H new ATOM 0 HG SER A 9 -6.672 20.638 12.739 1.00 0.00 H new ATOM 90 N ALA A 10 -6.072 18.297 8.590 1.00 0.00 N ATOM 91 CA ALA A 10 -6.344 17.550 7.369 1.00 0.00 C ATOM 92 C ALA A 10 -5.137 16.713 6.957 1.00 0.00 C ATOM 93 O ALA A 10 -4.000 17.180 7.009 1.00 0.00 O ATOM 94 CB ALA A 10 -6.739 18.498 6.247 1.00 0.00 C ATOM 0 H ALA A 10 -5.343 19.005 8.498 1.00 0.00 H new ATOM 0 HA ALA A 10 -7.174 16.871 7.565 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.939 17.926 5.341 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -7.635 19.048 6.534 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -5.926 19.200 6.061 1.00 0.00 H new ATOM 100 N LEU A 11 -5.395 15.476 6.547 1.00 0.00 N ATOM 101 CA LEU A 11 -4.331 14.573 6.126 1.00 0.00 C ATOM 102 C LEU A 11 -3.336 14.336 7.259 1.00 0.00 C ATOM 103 O LEU A 11 -2.126 14.292 7.036 1.00 0.00 O ATOM 104 CB LEU A 11 -3.606 15.141 4.904 1.00 0.00 C ATOM 105 CG LEU A 11 -4.330 14.943 3.571 1.00 0.00 C ATOM 106 CD1 LEU A 11 -5.444 15.966 3.412 1.00 0.00 C ATOM 107 CD2 LEU A 11 -3.347 15.037 2.413 1.00 0.00 C ATOM 0 H LEU A 11 -6.332 15.076 6.497 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.784 13.618 5.860 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.447 16.208 5.059 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.621 14.678 4.837 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.775 13.948 3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.948 15.810 2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -6.162 15.852 4.224 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.022 16.971 3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.878 14.894 1.472 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.873 16.019 2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.584 14.266 2.520 1.00 0.00 H new ATOM 119 N SER A 12 -3.855 14.184 8.473 1.00 0.00 N ATOM 120 CA SER A 12 -3.012 13.950 9.640 1.00 0.00 C ATOM 121 C SER A 12 -3.860 13.721 10.886 1.00 0.00 C ATOM 122 O SER A 12 -3.549 12.863 11.711 1.00 0.00 O ATOM 123 CB SER A 12 -2.070 15.134 9.859 1.00 0.00 C ATOM 124 OG SER A 12 -0.855 14.959 9.150 1.00 0.00 O ATOM 0 H SER A 12 -4.854 14.219 8.674 1.00 0.00 H new ATOM 0 HA SER A 12 -2.420 13.053 9.457 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.555 16.054 9.533 1.00 0.00 H new ATOM 0 HB3 SER A 12 -1.861 15.244 10.923 1.00 0.00 H new ATOM 0 HG SER A 12 -1.050 14.709 8.223 1.00 0.00 H new ATOM 130 N ARG A 13 -4.933 14.496 11.017 1.00 0.00 N ATOM 131 CA ARG A 13 -5.826 14.377 12.164 1.00 0.00 C ATOM 132 C ARG A 13 -6.549 13.034 12.153 1.00 0.00 C ATOM 133 O ARG A 13 -6.331 12.193 13.025 1.00 0.00 O ATOM 134 CB ARG A 13 -6.844 15.518 12.165 1.00 0.00 C ATOM 135 CG ARG A 13 -7.575 15.680 13.488 1.00 0.00 C ATOM 136 CD ARG A 13 -6.625 16.078 14.606 1.00 0.00 C ATOM 137 NE ARG A 13 -7.280 16.911 15.611 1.00 0.00 N ATOM 138 CZ ARG A 13 -6.797 17.116 16.834 1.00 0.00 C ATOM 139 NH1 ARG A 13 -5.655 16.550 17.207 1.00 0.00 N ATOM 140 NH2 ARG A 13 -7.456 17.887 17.687 1.00 0.00 N ATOM 0 H ARG A 13 -5.204 15.212 10.343 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.223 14.437 13.070 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -6.333 16.450 11.925 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -7.574 15.343 11.375 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -8.353 16.436 13.384 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -8.072 14.745 13.747 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -6.229 15.181 15.081 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.776 16.617 14.186 1.00 0.00 H new ATOM 0 HE ARG A 13 -8.160 17.362 15.361 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -5.144 15.955 16.555 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.289 16.710 18.145 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -8.334 18.324 17.406 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -7.085 18.044 18.624 1.00 0.00 H new ATOM 154 N ASN A 14 -7.411 12.840 11.160 1.00 0.00 N ATOM 155 CA ASN A 14 -8.167 11.599 11.035 1.00 0.00 C ATOM 156 C ASN A 14 -7.901 10.933 9.689 1.00 0.00 C ATOM 157 O ASN A 14 -8.802 10.353 9.083 1.00 0.00 O ATOM 158 CB ASN A 14 -9.664 11.870 11.196 1.00 0.00 C ATOM 159 CG ASN A 14 -10.062 12.077 12.645 1.00 0.00 C ATOM 160 OD1 ASN A 14 -9.210 12.136 13.532 1.00 0.00 O ATOM 161 ND2 ASN A 14 -11.361 12.189 12.891 1.00 0.00 N ATOM 0 H ASN A 14 -7.603 13.526 10.430 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.840 10.923 11.825 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -9.935 12.754 10.618 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -10.228 11.034 10.783 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.689 12.330 13.847 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -12.032 12.134 12.125 1.00 0.00 H new ATOM 168 N GLY A 15 -6.658 11.021 9.227 1.00 0.00 N ATOM 169 CA GLY A 15 -6.296 10.423 7.955 1.00 0.00 C ATOM 170 C GLY A 15 -7.096 10.990 6.800 1.00 0.00 C ATOM 171 O GLY A 15 -7.975 11.829 6.996 1.00 0.00 O ATOM 0 H GLY A 15 -5.895 11.495 9.710 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -5.234 10.584 7.771 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -6.451 9.345 8.006 1.00 0.00 H new ATOM 175 N SER A 16 -6.789 10.535 5.589 1.00 0.00 N ATOM 176 CA SER A 16 -7.484 11.003 4.396 1.00 0.00 C ATOM 177 C SER A 16 -7.801 9.842 3.460 1.00 0.00 C ATOM 178 O SER A 16 -8.949 9.652 3.057 1.00 0.00 O ATOM 179 CB SER A 16 -6.640 12.049 3.666 1.00 0.00 C ATOM 180 OG SER A 16 -7.454 13.078 3.130 1.00 0.00 O ATOM 0 H SER A 16 -6.063 9.842 5.409 1.00 0.00 H new ATOM 0 HA SER A 16 -8.423 11.459 4.708 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.912 12.478 4.354 1.00 0.00 H new ATOM 0 HB3 SER A 16 -6.077 11.571 2.864 1.00 0.00 H new ATOM 0 HG SER A 16 -6.891 13.735 2.670 1.00 0.00 H new ATOM 186 N PHE A 17 -6.777 9.069 3.115 1.00 0.00 N ATOM 187 CA PHE A 17 -6.946 7.927 2.226 1.00 0.00 C ATOM 188 C PHE A 17 -7.045 6.628 3.019 1.00 0.00 C ATOM 189 O PHE A 17 -8.081 5.963 3.015 1.00 0.00 O ATOM 190 CB PHE A 17 -5.781 7.846 1.238 1.00 0.00 C ATOM 191 CG PHE A 17 -5.537 9.126 0.492 1.00 0.00 C ATOM 192 CD1 PHE A 17 -6.583 9.796 -0.123 1.00 0.00 C ATOM 193 CD2 PHE A 17 -4.261 9.661 0.405 1.00 0.00 C ATOM 194 CE1 PHE A 17 -6.362 10.974 -0.810 1.00 0.00 C ATOM 195 CE2 PHE A 17 -4.035 10.839 -0.281 1.00 0.00 C ATOM 196 CZ PHE A 17 -5.086 11.496 -0.889 1.00 0.00 C ATOM 0 H PHE A 17 -5.820 9.213 3.438 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.875 8.065 1.673 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.875 7.572 1.779 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.978 7.049 0.521 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -7.583 9.392 -0.064 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.435 9.152 0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.186 11.486 -1.285 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.036 11.246 -0.342 1.00 0.00 H new ATOM 0 HZ PHE A 17 -4.911 12.417 -1.426 1.00 0.00 H new ATOM 206 N ILE A 18 -5.960 6.273 3.700 1.00 0.00 N ATOM 207 CA ILE A 18 -5.924 5.054 4.499 1.00 0.00 C ATOM 208 C ILE A 18 -5.568 5.358 5.950 1.00 0.00 C ATOM 209 O ILE A 18 -4.711 6.198 6.226 1.00 0.00 O ATOM 210 CB ILE A 18 -4.909 4.041 3.935 1.00 0.00 C ATOM 211 CG1 ILE A 18 -5.088 3.891 2.424 1.00 0.00 C ATOM 212 CG2 ILE A 18 -5.062 2.696 4.628 1.00 0.00 C ATOM 213 CD1 ILE A 18 -4.028 3.031 1.771 1.00 0.00 C ATOM 0 H ILE A 18 -5.094 6.812 3.714 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.922 4.619 4.456 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.903 4.414 4.126 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -6.069 3.459 2.224 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -5.075 4.880 1.965 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.338 1.991 4.219 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.887 2.816 5.697 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.070 2.316 4.466 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.219 2.969 0.700 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.046 3.473 1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.055 2.030 2.203 1.00 0.00 H new ATOM 225 N THR A 19 -6.231 4.670 6.873 1.00 0.00 N ATOM 226 CA THR A 19 -5.983 4.867 8.296 1.00 0.00 C ATOM 227 C THR A 19 -5.150 3.723 8.866 1.00 0.00 C ATOM 228 O THR A 19 -4.832 2.763 8.163 1.00 0.00 O ATOM 229 CB THR A 19 -7.306 4.977 9.055 1.00 0.00 C ATOM 230 OG1 THR A 19 -7.982 3.732 9.067 1.00 0.00 O ATOM 231 CG2 THR A 19 -8.248 6.005 8.468 1.00 0.00 C ATOM 0 H THR A 19 -6.944 3.972 6.661 1.00 0.00 H new ATOM 0 HA THR A 19 -5.424 5.795 8.417 1.00 0.00 H new ATOM 0 HB THR A 19 -7.036 5.289 10.064 1.00 0.00 H new ATOM 0 HG1 THR A 19 -8.825 3.822 9.559 1.00 0.00 H new ATOM 0 HG21 THR A 19 -9.167 6.032 9.053 1.00 0.00 H new ATOM 0 HG22 THR A 19 -7.775 6.987 8.490 1.00 0.00 H new ATOM 0 HG23 THR A 19 -8.482 5.738 7.438 1.00 0.00 H new ATOM 239 N LYS A 20 -4.800 3.831 10.143 1.00 0.00 N ATOM 240 CA LYS A 20 -4.004 2.805 10.806 1.00 0.00 C ATOM 241 C LYS A 20 -4.872 1.615 11.205 1.00 0.00 C ATOM 242 O LYS A 20 -4.406 0.477 11.232 1.00 0.00 O ATOM 243 CB LYS A 20 -3.315 3.385 12.042 1.00 0.00 C ATOM 244 CG LYS A 20 -4.272 4.054 13.015 1.00 0.00 C ATOM 245 CD LYS A 20 -3.815 3.883 14.454 1.00 0.00 C ATOM 246 CE LYS A 20 -4.030 5.152 15.262 1.00 0.00 C ATOM 247 NZ LYS A 20 -3.689 4.962 16.699 1.00 0.00 N ATOM 0 H LYS A 20 -5.055 4.618 10.739 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.246 2.459 10.104 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.783 2.586 12.560 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.567 4.111 11.724 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.348 5.116 12.780 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.269 3.629 12.896 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -4.361 3.060 14.915 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.759 3.614 14.472 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -3.419 5.954 14.847 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.070 5.466 15.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -3.850 5.851 17.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -4.289 4.215 17.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -2.690 4.688 16.785 1.00 0.00 H new ATOM 261 N GLU A 21 -6.136 1.888 11.513 1.00 0.00 N ATOM 262 CA GLU A 21 -7.068 0.839 11.910 1.00 0.00 C ATOM 263 C GLU A 21 -7.467 -0.016 10.711 1.00 0.00 C ATOM 264 O GLU A 21 -7.721 -1.213 10.847 1.00 0.00 O ATOM 265 CB GLU A 21 -8.313 1.453 12.555 1.00 0.00 C ATOM 266 CG GLU A 21 -8.519 1.032 14.000 1.00 0.00 C ATOM 267 CD GLU A 21 -9.894 1.396 14.525 1.00 0.00 C ATOM 268 OE1 GLU A 21 -10.294 2.570 14.378 1.00 0.00 O ATOM 269 OE2 GLU A 21 -10.571 0.506 15.082 1.00 0.00 O ATOM 0 H GLU A 21 -6.538 2.825 11.495 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.570 0.199 12.638 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.238 2.539 12.509 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.191 1.169 11.974 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.376 -0.045 14.084 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.760 1.504 14.624 1.00 0.00 H new ATOM 276 N LYS A 22 -7.519 0.605 9.537 1.00 0.00 N ATOM 277 CA LYS A 22 -7.887 -0.099 8.315 1.00 0.00 C ATOM 278 C LYS A 22 -6.814 -1.113 7.927 1.00 0.00 C ATOM 279 O LYS A 22 -7.113 -2.152 7.338 1.00 0.00 O ATOM 280 CB LYS A 22 -8.099 0.896 7.172 1.00 0.00 C ATOM 281 CG LYS A 22 -8.628 0.257 5.899 1.00 0.00 C ATOM 282 CD LYS A 22 -9.021 1.307 4.872 1.00 0.00 C ATOM 283 CE LYS A 22 -10.425 1.832 5.121 1.00 0.00 C ATOM 284 NZ LYS A 22 -10.665 3.129 4.430 1.00 0.00 N ATOM 0 H LYS A 22 -7.311 1.595 9.407 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.818 -0.634 8.501 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -8.796 1.668 7.498 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.153 1.392 6.954 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.868 -0.400 5.477 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.492 -0.365 6.134 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -8.311 2.134 4.905 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.964 0.878 3.872 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.153 1.098 4.777 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.581 1.958 6.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.634 3.452 4.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.987 3.838 4.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -10.542 3.004 3.405 1.00 0.00 H new ATOM 298 N LYS A 23 -5.566 -0.803 8.262 1.00 0.00 N ATOM 299 CA LYS A 23 -4.449 -1.687 7.948 1.00 0.00 C ATOM 300 C LYS A 23 -4.548 -2.990 8.736 1.00 0.00 C ATOM 301 O LYS A 23 -4.360 -4.075 8.188 1.00 0.00 O ATOM 302 CB LYS A 23 -3.121 -0.993 8.255 1.00 0.00 C ATOM 303 CG LYS A 23 -2.569 -0.194 7.086 1.00 0.00 C ATOM 304 CD LYS A 23 -1.321 0.580 7.480 1.00 0.00 C ATOM 305 CE LYS A 23 -1.671 1.924 8.098 1.00 0.00 C ATOM 306 NZ LYS A 23 -0.763 3.006 7.623 1.00 0.00 N ATOM 0 H LYS A 23 -5.303 0.053 8.750 1.00 0.00 H new ATOM 0 HA LYS A 23 -4.492 -1.922 6.884 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -3.257 -0.328 9.108 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -2.388 -1.744 8.550 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.335 -0.868 6.261 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.330 0.499 6.726 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -0.737 -0.006 8.189 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.695 0.734 6.601 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -2.701 2.180 7.851 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -1.612 1.851 9.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.771 3.790 8.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 0.204 2.634 7.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.088 3.350 6.697 1.00 0.00 H new ATOM 320 N ASP A 24 -4.843 -2.873 10.027 1.00 0.00 N ATOM 321 CA ASP A 24 -4.966 -4.042 10.892 1.00 0.00 C ATOM 322 C ASP A 24 -6.051 -4.985 10.385 1.00 0.00 C ATOM 323 O ASP A 24 -5.872 -6.202 10.373 1.00 0.00 O ATOM 324 CB ASP A 24 -5.279 -3.608 12.326 1.00 0.00 C ATOM 325 CG ASP A 24 -4.741 -4.583 13.355 1.00 0.00 C ATOM 326 OD1 ASP A 24 -4.915 -5.805 13.163 1.00 0.00 O ATOM 327 OD2 ASP A 24 -4.143 -4.125 14.351 1.00 0.00 O ATOM 0 H ASP A 24 -5.001 -1.982 10.497 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.015 -4.575 10.879 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.852 -2.622 12.506 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.358 -3.515 12.447 1.00 0.00 H new ATOM 332 N THR A 25 -7.177 -4.414 9.968 1.00 0.00 N ATOM 333 CA THR A 25 -8.292 -5.205 9.461 1.00 0.00 C ATOM 334 C THR A 25 -7.872 -6.021 8.241 1.00 0.00 C ATOM 335 O THR A 25 -8.396 -7.108 7.999 1.00 0.00 O ATOM 336 CB THR A 25 -9.467 -4.295 9.098 1.00 0.00 C ATOM 337 OG1 THR A 25 -9.612 -3.259 10.055 1.00 0.00 O ATOM 338 CG2 THR A 25 -10.787 -5.028 9.011 1.00 0.00 C ATOM 0 H THR A 25 -7.341 -3.407 9.971 1.00 0.00 H new ATOM 0 HA THR A 25 -8.602 -5.893 10.247 1.00 0.00 H new ATOM 0 HB THR A 25 -9.228 -3.893 8.113 1.00 0.00 H new ATOM 0 HG1 THR A 25 -10.367 -2.686 9.805 1.00 0.00 H new ATOM 0 HG21 THR A 25 -11.577 -4.324 8.750 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.724 -5.802 8.246 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.013 -5.487 9.974 1.00 0.00 H new ATOM 346 N VAL A 26 -6.924 -5.488 7.477 1.00 0.00 N ATOM 347 CA VAL A 26 -6.434 -6.167 6.283 1.00 0.00 C ATOM 348 C VAL A 26 -5.530 -7.340 6.649 1.00 0.00 C ATOM 349 O VAL A 26 -5.560 -8.385 6.000 1.00 0.00 O ATOM 350 CB VAL A 26 -5.657 -5.202 5.367 1.00 0.00 C ATOM 351 CG1 VAL A 26 -5.291 -5.885 4.058 1.00 0.00 C ATOM 352 CG2 VAL A 26 -6.466 -3.939 5.108 1.00 0.00 C ATOM 0 H VAL A 26 -6.480 -4.589 7.663 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.309 -6.538 5.749 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.735 -4.917 5.873 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.743 -5.188 3.425 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.668 -6.755 4.264 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.200 -6.202 3.547 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.900 -3.271 4.459 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.407 -4.202 4.625 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.671 -3.438 6.054 1.00 0.00 H new ATOM 362 N LEU A 27 -4.727 -7.159 7.693 1.00 0.00 N ATOM 363 CA LEU A 27 -3.814 -8.202 8.146 1.00 0.00 C ATOM 364 C LEU A 27 -4.564 -9.299 8.894 1.00 0.00 C ATOM 365 O LEU A 27 -4.157 -10.460 8.885 1.00 0.00 O ATOM 366 CB LEU A 27 -2.731 -7.604 9.045 1.00 0.00 C ATOM 367 CG LEU A 27 -2.012 -6.384 8.469 1.00 0.00 C ATOM 368 CD1 LEU A 27 -1.095 -5.763 9.511 1.00 0.00 C ATOM 369 CD2 LEU A 27 -1.225 -6.768 7.224 1.00 0.00 C ATOM 0 H LEU A 27 -4.690 -6.300 8.241 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.345 -8.645 7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.184 -7.324 9.996 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.991 -8.375 9.259 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.761 -5.644 8.188 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.592 -4.896 9.083 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.683 -5.451 10.374 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.351 -6.496 9.824 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.720 -5.888 6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.485 -7.526 7.481 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.906 -7.166 6.471 1.00 0.00 H new ATOM 381 N ARG A 28 -5.663 -8.923 9.543 1.00 0.00 N ATOM 382 CA ARG A 28 -6.469 -9.875 10.298 1.00 0.00 C ATOM 383 C ARG A 28 -6.957 -11.010 9.402 1.00 0.00 C ATOM 384 O ARG A 28 -7.080 -12.152 9.843 1.00 0.00 O ATOM 385 CB ARG A 28 -7.664 -9.168 10.938 1.00 0.00 C ATOM 386 CG ARG A 28 -8.295 -9.950 12.078 1.00 0.00 C ATOM 387 CD ARG A 28 -9.767 -9.606 12.243 1.00 0.00 C ATOM 388 NE ARG A 28 -10.635 -10.593 11.604 1.00 0.00 N ATOM 389 CZ ARG A 28 -11.909 -10.368 11.293 1.00 0.00 C ATOM 390 NH1 ARG A 28 -12.467 -9.194 11.560 1.00 0.00 N ATOM 391 NH2 ARG A 28 -12.627 -11.319 10.713 1.00 0.00 N ATOM 0 H ARG A 28 -6.015 -7.966 9.561 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.842 -10.300 11.082 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -7.343 -8.195 11.310 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -8.419 -8.984 10.173 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.189 -11.018 11.890 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.764 -9.735 13.005 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -10.008 -9.544 13.304 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.960 -8.622 11.815 1.00 0.00 H new ATOM 0 HE ARG A 28 -10.241 -11.508 11.384 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -11.919 -8.458 12.006 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -13.444 -9.027 11.319 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.203 -12.223 10.505 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.604 -11.147 10.474 1.00 0.00 H new ATOM 405 N GLN A 29 -7.232 -10.687 8.143 1.00 0.00 N ATOM 406 CA GLN A 29 -7.705 -11.679 7.185 1.00 0.00 C ATOM 407 C GLN A 29 -6.605 -12.682 6.853 1.00 0.00 C ATOM 408 O GLN A 29 -6.880 -13.848 6.570 1.00 0.00 O ATOM 409 CB GLN A 29 -8.191 -10.993 5.907 1.00 0.00 C ATOM 410 CG GLN A 29 -9.673 -10.658 5.922 1.00 0.00 C ATOM 411 CD GLN A 29 -10.018 -9.499 5.007 1.00 0.00 C ATOM 412 OE1 GLN A 29 -9.277 -8.519 4.922 1.00 0.00 O ATOM 413 NE2 GLN A 29 -11.147 -9.606 4.317 1.00 0.00 N ATOM 0 H GLN A 29 -7.135 -9.746 7.762 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.537 -12.218 7.638 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.621 -10.076 5.758 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.982 -11.640 5.055 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -10.243 -11.537 5.620 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -9.977 -10.415 6.940 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -11.730 -10.437 4.419 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.431 -8.858 3.685 1.00 0.00 H new ATOM 422 N VAL A 30 -5.360 -12.220 6.890 1.00 0.00 N ATOM 423 CA VAL A 30 -4.218 -13.076 6.593 1.00 0.00 C ATOM 424 C VAL A 30 -3.783 -13.860 7.827 1.00 0.00 C ATOM 425 O VAL A 30 -3.458 -15.044 7.739 1.00 0.00 O ATOM 426 CB VAL A 30 -3.022 -12.259 6.071 1.00 0.00 C ATOM 427 CG1 VAL A 30 -1.914 -13.180 5.586 1.00 0.00 C ATOM 428 CG2 VAL A 30 -3.465 -11.315 4.963 1.00 0.00 C ATOM 0 H VAL A 30 -5.116 -11.257 7.123 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.539 -13.771 5.817 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.629 -11.660 6.893 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.078 -12.583 5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.578 -13.810 6.410 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.290 -13.808 4.779 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.607 -10.745 4.606 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.886 -11.892 4.140 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.220 -10.630 5.349 1.00 0.00 H new ATOM 438 N ARG A 31 -3.778 -13.191 8.975 1.00 0.00 N ATOM 439 CA ARG A 31 -3.382 -13.825 10.228 1.00 0.00 C ATOM 440 C ARG A 31 -4.270 -15.027 10.537 1.00 0.00 C ATOM 441 O ARG A 31 -3.831 -15.988 11.168 1.00 0.00 O ATOM 442 CB ARG A 31 -3.451 -12.817 11.377 1.00 0.00 C ATOM 443 CG ARG A 31 -2.356 -11.765 11.329 1.00 0.00 C ATOM 444 CD ARG A 31 -2.297 -10.962 12.618 1.00 0.00 C ATOM 445 NE ARG A 31 -1.899 -11.786 13.757 1.00 0.00 N ATOM 446 CZ ARG A 31 -0.645 -12.163 13.997 1.00 0.00 C ATOM 447 NH1 ARG A 31 0.334 -11.793 13.182 1.00 0.00 N ATOM 448 NH2 ARG A 31 -0.369 -12.914 15.055 1.00 0.00 N ATOM 0 H ARG A 31 -4.044 -12.210 9.064 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.355 -14.174 10.120 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.421 -12.321 11.356 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.387 -13.353 12.324 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.394 -12.247 11.156 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.532 -11.093 10.489 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.591 -10.140 12.501 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.273 -10.519 12.814 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.624 -12.090 14.406 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.128 -11.216 12.366 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.293 -12.085 13.371 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.118 -13.203 15.685 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.592 -13.203 15.239 1.00 0.00 H new ATOM 462 N LEU A 32 -5.518 -14.966 10.087 1.00 0.00 N ATOM 463 CA LEU A 32 -6.466 -16.051 10.316 1.00 0.00 C ATOM 464 C LEU A 32 -6.187 -17.224 9.381 1.00 0.00 C ATOM 465 O LEU A 32 -5.892 -18.332 9.831 1.00 0.00 O ATOM 466 CB LEU A 32 -7.900 -15.554 10.116 1.00 0.00 C ATOM 467 CG LEU A 32 -8.379 -14.530 11.146 1.00 0.00 C ATOM 468 CD1 LEU A 32 -9.559 -13.738 10.602 1.00 0.00 C ATOM 469 CD2 LEU A 32 -8.754 -15.220 12.448 1.00 0.00 C ATOM 0 H LEU A 32 -5.897 -14.178 9.562 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.347 -16.393 11.344 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.980 -15.113 9.123 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.572 -16.412 10.139 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.563 -13.836 11.347 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.887 -13.014 11.348 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -9.258 -13.213 9.695 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.379 -14.418 10.372 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.093 -14.476 13.169 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.554 -15.936 12.263 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.884 -15.742 12.846 1.00 0.00 H new ATOM 481 N ASP A 33 -6.282 -16.973 8.080 1.00 0.00 N ATOM 482 CA ASP A 33 -6.040 -18.010 7.082 1.00 0.00 C ATOM 483 C ASP A 33 -5.030 -17.536 6.037 1.00 0.00 C ATOM 484 O ASP A 33 -5.318 -16.631 5.254 1.00 0.00 O ATOM 485 CB ASP A 33 -7.351 -18.401 6.396 1.00 0.00 C ATOM 486 CG ASP A 33 -7.329 -19.827 5.883 1.00 0.00 C ATOM 487 OD1 ASP A 33 -6.870 -20.720 6.625 1.00 0.00 O ATOM 488 OD2 ASP A 33 -7.772 -20.051 4.737 1.00 0.00 O ATOM 0 H ASP A 33 -6.525 -16.062 7.691 1.00 0.00 H new ATOM 0 HA ASP A 33 -5.628 -18.881 7.592 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.176 -18.283 7.099 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -7.541 -17.721 5.565 1.00 0.00 H new ATOM 493 N PRO A 34 -3.828 -18.142 6.008 1.00 0.00 N ATOM 494 CA PRO A 34 -2.782 -17.770 5.049 1.00 0.00 C ATOM 495 C PRO A 34 -3.293 -17.759 3.611 1.00 0.00 C ATOM 496 O PRO A 34 -4.206 -18.507 3.261 1.00 0.00 O ATOM 497 CB PRO A 34 -1.726 -18.861 5.231 1.00 0.00 C ATOM 498 CG PRO A 34 -1.918 -19.344 6.626 1.00 0.00 C ATOM 499 CD PRO A 34 -3.393 -19.233 6.902 1.00 0.00 C ATOM 0 HA PRO A 34 -2.407 -16.762 5.227 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -1.862 -19.668 4.511 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -0.720 -18.467 5.083 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -1.577 -20.374 6.733 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -1.343 -18.743 7.330 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -3.914 -20.165 6.682 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -3.589 -18.998 7.948 1.00 0.00 H new ATOM 507 N CYS A 35 -2.697 -16.907 2.784 1.00 0.00 N ATOM 508 CA CYS A 35 -3.091 -16.799 1.384 1.00 0.00 C ATOM 509 C CYS A 35 -1.978 -16.171 0.553 1.00 0.00 C ATOM 510 O CYS A 35 -0.926 -15.807 1.079 1.00 0.00 O ATOM 511 CB CYS A 35 -4.371 -15.969 1.256 1.00 0.00 C ATOM 512 SG CYS A 35 -5.511 -16.562 -0.016 1.00 0.00 S ATOM 0 H CYS A 35 -1.940 -16.281 3.059 1.00 0.00 H new ATOM 0 HA CYS A 35 -3.278 -17.804 1.006 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.886 -15.964 2.217 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.101 -14.937 1.034 1.00 0.00 H new ATOM 0 HG CYS A 35 -6.646 -15.937 0.093 1.00 0.00 H new ATOM 518 N ASP A 36 -2.218 -16.045 -0.749 1.00 0.00 N ATOM 519 CA ASP A 36 -1.235 -15.459 -1.653 1.00 0.00 C ATOM 520 C ASP A 36 -1.205 -13.941 -1.514 1.00 0.00 C ATOM 521 O ASP A 36 -2.188 -13.261 -1.810 1.00 0.00 O ATOM 522 CB ASP A 36 -1.547 -15.845 -3.100 1.00 0.00 C ATOM 523 CG ASP A 36 -0.869 -17.136 -3.513 1.00 0.00 C ATOM 524 OD1 ASP A 36 -1.403 -18.217 -3.190 1.00 0.00 O ATOM 525 OD2 ASP A 36 0.197 -17.065 -4.160 1.00 0.00 O ATOM 0 H ASP A 36 -3.084 -16.341 -1.201 1.00 0.00 H new ATOM 0 HA ASP A 36 -0.253 -15.850 -1.384 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -2.625 -15.949 -3.221 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -1.228 -15.042 -3.764 1.00 0.00 H new ATOM 530 N LEU A 37 -0.072 -13.415 -1.062 1.00 0.00 N ATOM 531 CA LEU A 37 0.085 -11.976 -0.883 1.00 0.00 C ATOM 532 C LEU A 37 1.209 -11.438 -1.764 1.00 0.00 C ATOM 533 O LEU A 37 1.886 -10.476 -1.402 1.00 0.00 O ATOM 534 CB LEU A 37 0.372 -11.651 0.584 1.00 0.00 C ATOM 535 CG LEU A 37 -0.687 -12.137 1.574 1.00 0.00 C ATOM 536 CD1 LEU A 37 -0.169 -12.045 3.001 1.00 0.00 C ATOM 537 CD2 LEU A 37 -1.970 -11.333 1.418 1.00 0.00 C ATOM 0 H LEU A 37 0.751 -13.963 -0.813 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.847 -11.495 -1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.331 -12.091 0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.476 -10.571 0.687 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.906 -13.182 1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.937 -12.395 3.690 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.722 -12.664 3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.080 -11.009 3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.713 -11.692 2.130 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.765 -10.280 1.608 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.352 -11.451 0.404 1.00 0.00 H new ATOM 549 N GLN A 38 1.403 -12.066 -2.918 1.00 0.00 N ATOM 550 CA GLN A 38 2.448 -11.649 -3.847 1.00 0.00 C ATOM 551 C GLN A 38 1.902 -10.667 -4.886 1.00 0.00 C ATOM 552 O GLN A 38 2.446 -9.578 -5.063 1.00 0.00 O ATOM 553 CB GLN A 38 3.059 -12.867 -4.543 1.00 0.00 C ATOM 554 CG GLN A 38 4.578 -12.895 -4.496 1.00 0.00 C ATOM 555 CD GLN A 38 5.118 -12.832 -3.081 1.00 0.00 C ATOM 556 OE1 GLN A 38 4.693 -13.588 -2.207 1.00 0.00 O ATOM 557 NE2 GLN A 38 6.062 -11.928 -2.847 1.00 0.00 N ATOM 0 H GLN A 38 0.852 -12.864 -3.233 1.00 0.00 H new ATOM 0 HA GLN A 38 3.224 -11.142 -3.274 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.672 -13.773 -4.077 1.00 0.00 H new ATOM 0 HB3 GLN A 38 2.736 -12.881 -5.584 1.00 0.00 H new ATOM 0 HG2 GLN A 38 4.936 -13.805 -4.978 1.00 0.00 H new ATOM 0 HG3 GLN A 38 4.971 -12.055 -5.069 1.00 0.00 H new ATOM 0 HE21 GLN A 38 6.385 -11.321 -3.601 1.00 0.00 H new ATOM 0 HE22 GLN A 38 6.464 -11.840 -1.914 1.00 0.00 H new ATOM 566 N PRO A 39 0.817 -11.041 -5.589 1.00 0.00 N ATOM 567 CA PRO A 39 0.208 -10.182 -6.611 1.00 0.00 C ATOM 568 C PRO A 39 -0.133 -8.795 -6.075 1.00 0.00 C ATOM 569 O PRO A 39 -0.185 -7.823 -6.829 1.00 0.00 O ATOM 570 CB PRO A 39 -1.068 -10.933 -6.998 1.00 0.00 C ATOM 571 CG PRO A 39 -0.791 -12.355 -6.656 1.00 0.00 C ATOM 572 CD PRO A 39 0.100 -12.322 -5.446 1.00 0.00 C ATOM 0 HA PRO A 39 0.884 -10.006 -7.448 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -1.931 -10.555 -6.450 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -1.289 -10.817 -8.059 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.715 -12.893 -6.446 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -0.305 -12.869 -7.485 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -0.476 -12.360 -4.521 1.00 0.00 H new ATOM 0 HD3 PRO A 39 0.787 -13.168 -5.429 1.00 0.00 H new ATOM 580 N ILE A 40 -0.368 -8.712 -4.769 1.00 0.00 N ATOM 581 CA ILE A 40 -0.705 -7.445 -4.132 1.00 0.00 C ATOM 582 C ILE A 40 0.521 -6.547 -4.002 1.00 0.00 C ATOM 583 O ILE A 40 0.406 -5.321 -3.999 1.00 0.00 O ATOM 584 CB ILE A 40 -1.316 -7.666 -2.735 1.00 0.00 C ATOM 585 CG1 ILE A 40 -2.439 -8.702 -2.801 1.00 0.00 C ATOM 586 CG2 ILE A 40 -1.833 -6.351 -2.169 1.00 0.00 C ATOM 587 CD1 ILE A 40 -2.787 -9.301 -1.456 1.00 0.00 C ATOM 0 H ILE A 40 -0.331 -9.508 -4.132 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.440 -6.957 -4.771 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.538 -8.045 -2.072 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.329 -8.235 -3.223 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.145 -9.502 -3.481 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.262 -6.523 -1.182 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.010 -5.641 -2.088 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.598 -5.946 -2.831 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.591 -10.027 -1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.910 -9.797 -1.041 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.112 -8.511 -0.779 1.00 0.00 H new ATOM 599 N PHE A 41 1.694 -7.163 -3.891 1.00 0.00 N ATOM 600 CA PHE A 41 2.939 -6.417 -3.757 1.00 0.00 C ATOM 601 C PHE A 41 3.604 -6.207 -5.112 1.00 0.00 C ATOM 602 O PHE A 41 3.970 -5.087 -5.468 1.00 0.00 O ATOM 603 CB PHE A 41 3.898 -7.150 -2.816 1.00 0.00 C ATOM 604 CG PHE A 41 3.685 -6.821 -1.367 1.00 0.00 C ATOM 605 CD1 PHE A 41 2.760 -7.524 -0.612 1.00 0.00 C ATOM 606 CD2 PHE A 41 4.409 -5.808 -0.758 1.00 0.00 C ATOM 607 CE1 PHE A 41 2.561 -7.225 0.722 1.00 0.00 C ATOM 608 CE2 PHE A 41 4.215 -5.503 0.575 1.00 0.00 C ATOM 609 CZ PHE A 41 3.289 -6.212 1.316 1.00 0.00 C ATOM 0 H PHE A 41 1.808 -8.177 -3.891 1.00 0.00 H new ATOM 0 HA PHE A 41 2.700 -5.440 -3.337 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.782 -8.225 -2.957 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.923 -6.902 -3.090 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.187 -8.316 -1.072 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.134 -5.250 -1.333 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.838 -7.782 1.299 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.786 -4.712 1.037 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.134 -5.975 2.358 1.00 0.00 H new ATOM 619 N ASP A 42 3.761 -7.290 -5.866 1.00 0.00 N ATOM 620 CA ASP A 42 4.388 -7.224 -7.182 1.00 0.00 C ATOM 621 C ASP A 42 3.672 -6.227 -8.091 1.00 0.00 C ATOM 622 O ASP A 42 4.252 -5.728 -9.056 1.00 0.00 O ATOM 623 CB ASP A 42 4.395 -8.608 -7.834 1.00 0.00 C ATOM 624 CG ASP A 42 5.654 -8.860 -8.640 1.00 0.00 C ATOM 625 OD1 ASP A 42 6.710 -9.120 -8.026 1.00 0.00 O ATOM 626 OD2 ASP A 42 5.585 -8.796 -9.886 1.00 0.00 O ATOM 0 H ASP A 42 3.462 -8.225 -5.588 1.00 0.00 H new ATOM 0 HA ASP A 42 5.414 -6.883 -7.045 1.00 0.00 H new ATOM 0 HB2 ASP A 42 4.303 -9.371 -7.061 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.525 -8.705 -8.484 1.00 0.00 H new ATOM 631 N ASP A 43 2.411 -5.943 -7.782 1.00 0.00 N ATOM 632 CA ASP A 43 1.622 -5.010 -8.580 1.00 0.00 C ATOM 633 C ASP A 43 1.717 -3.586 -8.032 1.00 0.00 C ATOM 634 O ASP A 43 1.451 -2.620 -8.746 1.00 0.00 O ATOM 635 CB ASP A 43 0.158 -5.453 -8.619 1.00 0.00 C ATOM 636 CG ASP A 43 -0.578 -4.909 -9.828 1.00 0.00 C ATOM 637 OD1 ASP A 43 -0.580 -3.674 -10.015 1.00 0.00 O ATOM 638 OD2 ASP A 43 -1.152 -5.718 -10.587 1.00 0.00 O ATOM 0 H ASP A 43 1.914 -6.344 -6.987 1.00 0.00 H new ATOM 0 HA ASP A 43 2.029 -5.013 -9.591 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.111 -6.542 -8.628 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.344 -5.120 -7.711 1.00 0.00 H new ATOM 643 N MET A 44 2.092 -3.461 -6.763 1.00 0.00 N ATOM 644 CA MET A 44 2.212 -2.150 -6.128 1.00 0.00 C ATOM 645 C MET A 44 3.672 -1.721 -6.003 1.00 0.00 C ATOM 646 O MET A 44 3.966 -0.539 -5.831 1.00 0.00 O ATOM 647 CB MET A 44 1.555 -2.170 -4.747 1.00 0.00 C ATOM 648 CG MET A 44 0.042 -2.301 -4.795 1.00 0.00 C ATOM 649 SD MET A 44 -0.741 -0.971 -5.728 1.00 0.00 S ATOM 650 CE MET A 44 -0.744 0.340 -4.509 1.00 0.00 C ATOM 0 H MET A 44 2.318 -4.248 -6.154 1.00 0.00 H new ATOM 0 HA MET A 44 1.700 -1.426 -6.762 1.00 0.00 H new ATOM 0 HB2 MET A 44 1.965 -2.999 -4.171 1.00 0.00 H new ATOM 0 HB3 MET A 44 1.815 -1.254 -4.217 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.222 -3.259 -5.244 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.351 -2.306 -3.778 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.771 0.639 -4.299 1.00 0.00 H new ATOM 0 HE2 MET A 44 -0.275 -0.015 -3.592 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.188 1.195 -4.893 1.00 0.00 H new ATOM 660 N LEU A 45 4.586 -2.685 -6.086 1.00 0.00 N ATOM 661 CA LEU A 45 6.014 -2.399 -5.975 1.00 0.00 C ATOM 662 C LEU A 45 6.440 -1.327 -6.976 1.00 0.00 C ATOM 663 O LEU A 45 7.386 -0.579 -6.732 1.00 0.00 O ATOM 664 CB LEU A 45 6.828 -3.674 -6.201 1.00 0.00 C ATOM 665 CG LEU A 45 6.983 -4.569 -4.970 1.00 0.00 C ATOM 666 CD1 LEU A 45 7.670 -5.873 -5.342 1.00 0.00 C ATOM 667 CD2 LEU A 45 7.764 -3.845 -3.882 1.00 0.00 C ATOM 0 H LEU A 45 4.363 -3.670 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 45 6.205 -2.024 -4.969 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.356 -4.253 -6.995 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.820 -3.395 -6.556 1.00 0.00 H new ATOM 0 HG LEU A 45 5.990 -4.802 -4.585 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.772 -6.497 -4.454 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.074 -6.398 -6.088 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.658 -5.660 -5.751 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.866 -4.495 -3.013 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.753 -3.583 -4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.233 -2.937 -3.596 1.00 0.00 H new ATOM 679 N HIS A 46 5.736 -1.258 -8.101 1.00 0.00 N ATOM 680 CA HIS A 46 6.045 -0.278 -9.136 1.00 0.00 C ATOM 681 C HIS A 46 5.560 1.113 -8.736 1.00 0.00 C ATOM 682 O HIS A 46 6.116 2.122 -9.168 1.00 0.00 O ATOM 683 CB HIS A 46 5.409 -0.691 -10.464 1.00 0.00 C ATOM 684 CG HIS A 46 6.302 -0.479 -11.647 1.00 0.00 C ATOM 685 ND1 HIS A 46 6.185 -1.171 -12.832 1.00 0.00 N ATOM 686 CD2 HIS A 46 7.345 0.374 -11.813 1.00 0.00 C ATOM 687 CE1 HIS A 46 7.140 -0.728 -13.662 1.00 0.00 C ATOM 688 NE2 HIS A 46 7.871 0.210 -13.091 1.00 0.00 N ATOM 0 H HIS A 46 4.948 -1.868 -8.319 1.00 0.00 H new ATOM 0 HA HIS A 46 7.128 -0.243 -9.254 1.00 0.00 H new ATOM 0 HB2 HIS A 46 5.132 -1.744 -10.413 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.488 -0.125 -10.608 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.709 1.069 -11.071 1.00 0.00 H new ATOM 0 HE1 HIS A 46 7.291 -1.092 -14.668 1.00 0.00 H new ATOM 0 HE2 HIS A 46 8.659 0.711 -13.501 1.00 0.00 H new ATOM 696 N PHE A 47 4.520 1.159 -7.908 1.00 0.00 N ATOM 697 CA PHE A 47 3.962 2.427 -7.452 1.00 0.00 C ATOM 698 C PHE A 47 4.950 3.172 -6.563 1.00 0.00 C ATOM 699 O PHE A 47 5.034 4.400 -6.605 1.00 0.00 O ATOM 700 CB PHE A 47 2.655 2.189 -6.693 1.00 0.00 C ATOM 701 CG PHE A 47 1.489 1.879 -7.588 1.00 0.00 C ATOM 702 CD1 PHE A 47 1.435 0.685 -8.290 1.00 0.00 C ATOM 703 CD2 PHE A 47 0.446 2.781 -7.727 1.00 0.00 C ATOM 704 CE1 PHE A 47 0.364 0.397 -9.113 1.00 0.00 C ATOM 705 CE2 PHE A 47 -0.628 2.499 -8.549 1.00 0.00 C ATOM 706 CZ PHE A 47 -0.670 1.306 -9.243 1.00 0.00 C ATOM 0 H PHE A 47 4.048 0.333 -7.540 1.00 0.00 H new ATOM 0 HA PHE A 47 3.760 3.041 -8.330 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.795 1.365 -5.994 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.422 3.074 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.240 -0.028 -8.192 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.473 3.715 -7.186 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.334 -0.537 -9.654 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.434 3.211 -8.649 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.509 1.083 -9.886 1.00 0.00 H new ATOM 716 N LEU A 48 5.697 2.425 -5.757 1.00 0.00 N ATOM 717 CA LEU A 48 6.679 3.018 -4.857 1.00 0.00 C ATOM 718 C LEU A 48 8.021 3.206 -5.558 1.00 0.00 C ATOM 719 O LEU A 48 8.193 2.802 -6.708 1.00 0.00 O ATOM 720 CB LEU A 48 6.857 2.145 -3.614 1.00 0.00 C ATOM 721 CG LEU A 48 5.564 1.812 -2.865 1.00 0.00 C ATOM 722 CD1 LEU A 48 5.112 0.394 -3.181 1.00 0.00 C ATOM 723 CD2 LEU A 48 5.753 1.991 -1.366 1.00 0.00 C ATOM 0 H LEU A 48 5.641 1.408 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 48 6.309 3.998 -4.554 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.338 1.213 -3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.536 2.651 -2.928 1.00 0.00 H new ATOM 0 HG LEU A 48 4.788 2.501 -3.198 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.192 0.176 -2.639 1.00 0.00 H new ATOM 0 HD12 LEU A 48 4.934 0.299 -4.252 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.887 -0.311 -2.878 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.823 1.750 -0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.544 1.327 -1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.027 3.025 -1.155 1.00 0.00 H new ATOM 735 N ASN A 49 8.968 3.822 -4.857 1.00 0.00 N ATOM 736 CA ASN A 49 10.295 4.064 -5.410 1.00 0.00 C ATOM 737 C ASN A 49 11.365 3.337 -4.598 1.00 0.00 C ATOM 738 O ASN A 49 11.125 2.938 -3.459 1.00 0.00 O ATOM 739 CB ASN A 49 10.592 5.565 -5.440 1.00 0.00 C ATOM 740 CG ASN A 49 10.257 6.248 -4.129 1.00 0.00 C ATOM 741 OD1 ASN A 49 9.091 6.338 -3.744 1.00 0.00 O ATOM 742 ND2 ASN A 49 11.280 6.735 -3.436 1.00 0.00 N ATOM 0 H ASN A 49 8.840 4.163 -3.904 1.00 0.00 H new ATOM 0 HA ASN A 49 10.313 3.677 -6.429 1.00 0.00 H new ATOM 0 HB2 ASN A 49 11.647 5.719 -5.667 1.00 0.00 H new ATOM 0 HB3 ASN A 49 10.021 6.029 -6.244 1.00 0.00 H new ATOM 0 HD21 ASN A 49 11.115 7.206 -2.546 1.00 0.00 H new ATOM 0 HD22 ASN A 49 12.230 6.638 -3.793 1.00 0.00 H new ATOM 749 N PRO A 50 12.565 3.153 -5.178 1.00 0.00 N ATOM 750 CA PRO A 50 13.672 2.469 -4.502 1.00 0.00 C ATOM 751 C PRO A 50 13.922 3.013 -3.100 1.00 0.00 C ATOM 752 O PRO A 50 14.337 2.279 -2.202 1.00 0.00 O ATOM 753 CB PRO A 50 14.869 2.754 -5.409 1.00 0.00 C ATOM 754 CG PRO A 50 14.277 2.953 -6.761 1.00 0.00 C ATOM 755 CD PRO A 50 12.935 3.596 -6.536 1.00 0.00 C ATOM 0 HA PRO A 50 13.470 1.407 -4.360 1.00 0.00 H new ATOM 0 HB2 PRO A 50 15.413 3.639 -5.080 1.00 0.00 H new ATOM 0 HB3 PRO A 50 15.576 1.925 -5.404 1.00 0.00 H new ATOM 0 HG2 PRO A 50 14.915 3.587 -7.377 1.00 0.00 H new ATOM 0 HG3 PRO A 50 14.171 2.003 -7.284 1.00 0.00 H new ATOM 0 HD2 PRO A 50 12.994 4.682 -6.602 1.00 0.00 H new ATOM 0 HD3 PRO A 50 12.205 3.271 -7.277 1.00 0.00 H new ATOM 763 N GLU A 51 13.668 4.306 -2.916 1.00 0.00 N ATOM 764 CA GLU A 51 13.866 4.947 -1.622 1.00 0.00 C ATOM 765 C GLU A 51 12.776 4.531 -0.638 1.00 0.00 C ATOM 766 O GLU A 51 13.022 4.413 0.562 1.00 0.00 O ATOM 767 CB GLU A 51 13.874 6.469 -1.778 1.00 0.00 C ATOM 768 CG GLU A 51 14.716 7.183 -0.733 1.00 0.00 C ATOM 769 CD GLU A 51 16.185 7.235 -1.103 1.00 0.00 C ATOM 770 OE1 GLU A 51 16.491 7.524 -2.280 1.00 0.00 O ATOM 771 OE2 GLU A 51 17.030 6.989 -0.218 1.00 0.00 O ATOM 0 H GLU A 51 13.325 4.929 -3.647 1.00 0.00 H new ATOM 0 HA GLU A 51 14.830 4.625 -1.228 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.249 6.722 -2.770 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.850 6.837 -1.721 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.342 8.198 -0.603 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.604 6.677 0.226 1.00 0.00 H new ATOM 778 N GLU A 52 11.573 4.309 -1.157 1.00 0.00 N ATOM 779 CA GLU A 52 10.444 3.906 -0.326 1.00 0.00 C ATOM 780 C GLU A 52 10.459 2.402 -0.085 1.00 0.00 C ATOM 781 O GLU A 52 10.132 1.933 1.006 1.00 0.00 O ATOM 782 CB GLU A 52 9.127 4.312 -0.988 1.00 0.00 C ATOM 783 CG GLU A 52 8.871 5.811 -0.966 1.00 0.00 C ATOM 784 CD GLU A 52 7.504 6.176 -1.510 1.00 0.00 C ATOM 785 OE1 GLU A 52 6.989 5.430 -2.369 1.00 0.00 O ATOM 786 OE2 GLU A 52 6.949 7.207 -1.078 1.00 0.00 O ATOM 0 H GLU A 52 11.355 4.401 -2.149 1.00 0.00 H new ATOM 0 HA GLU A 52 10.532 4.413 0.635 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.128 3.967 -2.022 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.305 3.804 -0.484 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.960 6.176 0.057 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.638 6.316 -1.553 1.00 0.00 H new ATOM 793 N LEU A 53 10.840 1.650 -1.110 1.00 0.00 N ATOM 794 CA LEU A 53 10.898 0.197 -1.015 1.00 0.00 C ATOM 795 C LEU A 53 11.929 -0.241 0.021 1.00 0.00 C ATOM 796 O LEU A 53 11.785 -1.290 0.649 1.00 0.00 O ATOM 797 CB LEU A 53 11.235 -0.412 -2.377 1.00 0.00 C ATOM 798 CG LEU A 53 10.078 -0.442 -3.377 1.00 0.00 C ATOM 799 CD1 LEU A 53 10.550 -0.970 -4.722 1.00 0.00 C ATOM 800 CD2 LEU A 53 8.933 -1.288 -2.840 1.00 0.00 C ATOM 0 H LEU A 53 11.114 2.024 -2.019 1.00 0.00 H new ATOM 0 HA LEU A 53 9.918 -0.160 -0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 53 12.060 0.150 -2.815 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.590 -1.431 -2.224 1.00 0.00 H new ATOM 0 HG LEU A 53 9.716 0.576 -3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.714 -0.984 -5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.337 -0.324 -5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 53 10.938 -1.981 -4.600 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.118 -1.299 -3.564 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.282 -2.307 -2.671 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.578 -0.865 -1.900 1.00 0.00 H new ATOM 812 N ARG A 54 12.969 0.569 0.193 1.00 0.00 N ATOM 813 CA ARG A 54 14.025 0.264 1.152 1.00 0.00 C ATOM 814 C ARG A 54 13.459 0.125 2.563 1.00 0.00 C ATOM 815 O ARG A 54 13.988 -0.627 3.382 1.00 0.00 O ATOM 816 CB ARG A 54 15.096 1.356 1.126 1.00 0.00 C ATOM 817 CG ARG A 54 16.486 0.855 1.486 1.00 0.00 C ATOM 818 CD ARG A 54 17.418 0.873 0.284 1.00 0.00 C ATOM 819 NE ARG A 54 17.855 2.226 -0.049 1.00 0.00 N ATOM 820 CZ ARG A 54 18.802 2.884 0.617 1.00 0.00 C ATOM 821 NH1 ARG A 54 19.411 2.317 1.650 1.00 0.00 N ATOM 822 NH2 ARG A 54 19.141 4.112 0.248 1.00 0.00 N ATOM 0 H ARG A 54 13.103 1.441 -0.319 1.00 0.00 H new ATOM 0 HA ARG A 54 14.476 -0.686 0.867 1.00 0.00 H new ATOM 0 HB2 ARG A 54 15.126 1.800 0.131 1.00 0.00 H new ATOM 0 HB3 ARG A 54 14.813 2.147 1.820 1.00 0.00 H new ATOM 0 HG2 ARG A 54 16.903 1.476 2.279 1.00 0.00 H new ATOM 0 HG3 ARG A 54 16.417 -0.160 1.878 1.00 0.00 H new ATOM 0 HD2 ARG A 54 18.289 0.251 0.491 1.00 0.00 H new ATOM 0 HD3 ARG A 54 16.910 0.434 -0.575 1.00 0.00 H new ATOM 0 HE ARG A 54 17.409 2.694 -0.838 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.155 1.373 1.938 1.00 0.00 H new ATOM 0 HH12 ARG A 54 20.136 2.825 2.157 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.676 4.553 -0.546 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.866 4.616 0.758 1.00 0.00 H new ATOM 836 N VAL A 55 12.383 0.854 2.840 1.00 0.00 N ATOM 837 CA VAL A 55 11.748 0.812 4.151 1.00 0.00 C ATOM 838 C VAL A 55 10.901 -0.446 4.313 1.00 0.00 C ATOM 839 O VAL A 55 10.773 -0.982 5.414 1.00 0.00 O ATOM 840 CB VAL A 55 10.859 2.047 4.385 1.00 0.00 C ATOM 841 CG1 VAL A 55 10.372 2.091 5.826 1.00 0.00 C ATOM 842 CG2 VAL A 55 11.611 3.321 4.030 1.00 0.00 C ATOM 0 H VAL A 55 11.933 1.481 2.173 1.00 0.00 H new ATOM 0 HA VAL A 55 12.550 0.805 4.889 1.00 0.00 H new ATOM 0 HB VAL A 55 9.988 1.973 3.734 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.745 2.971 5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 55 9.793 1.193 6.042 1.00 0.00 H new ATOM 0 HG13 VAL A 55 11.229 2.140 6.498 1.00 0.00 H new ATOM 0 HG21 VAL A 55 10.967 4.183 4.202 1.00 0.00 H new ATOM 0 HG22 VAL A 55 12.502 3.403 4.653 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.904 3.290 2.981 1.00 0.00 H new ATOM 852 N ILE A 56 10.326 -0.913 3.211 1.00 0.00 N ATOM 853 CA ILE A 56 9.490 -2.108 3.231 1.00 0.00 C ATOM 854 C ILE A 56 10.332 -3.370 3.078 1.00 0.00 C ATOM 855 O ILE A 56 10.003 -4.418 3.635 1.00 0.00 O ATOM 856 CB ILE A 56 8.431 -2.073 2.113 1.00 0.00 C ATOM 857 CG1 ILE A 56 7.698 -0.730 2.116 1.00 0.00 C ATOM 858 CG2 ILE A 56 7.446 -3.221 2.280 1.00 0.00 C ATOM 859 CD1 ILE A 56 6.910 -0.470 0.850 1.00 0.00 C ATOM 0 H ILE A 56 10.423 -0.482 2.292 1.00 0.00 H new ATOM 0 HA ILE A 56 8.986 -2.125 4.197 1.00 0.00 H new ATOM 0 HB ILE A 56 8.934 -2.188 1.153 1.00 0.00 H new ATOM 0 HG12 ILE A 56 7.021 -0.696 2.969 1.00 0.00 H new ATOM 0 HG13 ILE A 56 8.424 0.071 2.254 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.704 -3.183 1.483 1.00 0.00 H new ATOM 0 HG22 ILE A 56 7.981 -4.169 2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.946 -3.134 3.245 1.00 0.00 H new ATOM 0 HD11 ILE A 56 6.416 0.499 0.921 1.00 0.00 H new ATOM 0 HD12 ILE A 56 7.585 -0.471 -0.006 1.00 0.00 H new ATOM 0 HD13 ILE A 56 6.160 -1.251 0.721 1.00 0.00 H new ATOM 871 N GLU A 57 11.419 -3.263 2.321 1.00 0.00 N ATOM 872 CA GLU A 57 12.308 -4.396 2.095 1.00 0.00 C ATOM 873 C GLU A 57 12.878 -4.914 3.413 1.00 0.00 C ATOM 874 O GLU A 57 13.168 -6.102 3.551 1.00 0.00 O ATOM 875 CB GLU A 57 13.447 -3.997 1.151 1.00 0.00 C ATOM 876 CG GLU A 57 13.407 -4.718 -0.186 1.00 0.00 C ATOM 877 CD GLU A 57 14.686 -5.482 -0.477 1.00 0.00 C ATOM 878 OE1 GLU A 57 15.765 -5.013 -0.059 1.00 0.00 O ATOM 879 OE2 GLU A 57 14.606 -6.548 -1.123 1.00 0.00 O ATOM 0 H GLU A 57 11.705 -2.403 1.854 1.00 0.00 H new ATOM 0 HA GLU A 57 11.728 -5.195 1.634 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.404 -2.922 0.976 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.400 -4.203 1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 57 12.565 -5.410 -0.196 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.233 -3.992 -0.981 1.00 0.00 H new ATOM 886 N GLU A 58 13.035 -4.015 4.379 1.00 0.00 N ATOM 887 CA GLU A 58 13.570 -4.381 5.686 1.00 0.00 C ATOM 888 C GLU A 58 12.676 -5.408 6.374 1.00 0.00 C ATOM 889 O GLU A 58 13.162 -6.308 7.058 1.00 0.00 O ATOM 890 CB GLU A 58 13.713 -3.140 6.568 1.00 0.00 C ATOM 891 CG GLU A 58 14.815 -2.195 6.116 1.00 0.00 C ATOM 892 CD GLU A 58 14.861 -0.919 6.934 1.00 0.00 C ATOM 893 OE1 GLU A 58 14.158 0.045 6.568 1.00 0.00 O ATOM 894 OE2 GLU A 58 15.600 -0.885 7.941 1.00 0.00 O ATOM 0 H GLU A 58 12.799 -3.027 4.282 1.00 0.00 H new ATOM 0 HA GLU A 58 14.553 -4.826 5.535 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.766 -2.601 6.579 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.913 -3.454 7.593 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.777 -2.703 6.188 1.00 0.00 H new ATOM 0 HG3 GLU A 58 14.665 -1.944 5.066 1.00 0.00 H new ATOM 901 N ILE A 59 11.368 -5.267 6.188 1.00 0.00 N ATOM 902 CA ILE A 59 10.406 -6.181 6.791 1.00 0.00 C ATOM 903 C ILE A 59 10.509 -7.575 6.169 1.00 0.00 C ATOM 904 O ILE A 59 10.174 -7.765 5.001 1.00 0.00 O ATOM 905 CB ILE A 59 8.963 -5.666 6.629 1.00 0.00 C ATOM 906 CG1 ILE A 59 8.858 -4.217 7.110 1.00 0.00 C ATOM 907 CG2 ILE A 59 7.993 -6.555 7.393 1.00 0.00 C ATOM 908 CD1 ILE A 59 7.475 -3.625 6.948 1.00 0.00 C ATOM 0 H ILE A 59 10.950 -4.527 5.624 1.00 0.00 H new ATOM 0 HA ILE A 59 10.646 -6.239 7.853 1.00 0.00 H new ATOM 0 HB ILE A 59 8.699 -5.698 5.572 1.00 0.00 H new ATOM 0 HG12 ILE A 59 9.144 -4.170 8.161 1.00 0.00 H new ATOM 0 HG13 ILE A 59 9.573 -3.607 6.558 1.00 0.00 H new ATOM 0 HG21 ILE A 59 6.978 -6.177 7.268 1.00 0.00 H new ATOM 0 HG22 ILE A 59 8.052 -7.573 7.007 1.00 0.00 H new ATOM 0 HG23 ILE A 59 8.254 -6.552 8.451 1.00 0.00 H new ATOM 0 HD11 ILE A 59 7.475 -2.597 7.309 1.00 0.00 H new ATOM 0 HD12 ILE A 59 7.194 -3.640 5.895 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.758 -4.212 7.523 1.00 0.00 H new ATOM 920 N PRO A 60 10.975 -8.573 6.944 1.00 0.00 N ATOM 921 CA PRO A 60 11.116 -9.947 6.455 1.00 0.00 C ATOM 922 C PRO A 60 9.774 -10.659 6.331 1.00 0.00 C ATOM 923 O PRO A 60 9.508 -11.337 5.338 1.00 0.00 O ATOM 924 CB PRO A 60 11.978 -10.614 7.526 1.00 0.00 C ATOM 925 CG PRO A 60 11.672 -9.863 8.775 1.00 0.00 C ATOM 926 CD PRO A 60 11.401 -8.443 8.352 1.00 0.00 C ATOM 0 HA PRO A 60 11.549 -9.983 5.455 1.00 0.00 H new ATOM 0 HB2 PRO A 60 11.734 -11.671 7.629 1.00 0.00 H new ATOM 0 HB3 PRO A 60 13.037 -10.554 7.277 1.00 0.00 H new ATOM 0 HG2 PRO A 60 10.808 -10.290 9.285 1.00 0.00 H new ATOM 0 HG3 PRO A 60 12.508 -9.909 9.472 1.00 0.00 H new ATOM 0 HD2 PRO A 60 10.625 -7.984 8.964 1.00 0.00 H new ATOM 0 HD3 PRO A 60 12.291 -7.820 8.445 1.00 0.00 H new ATOM 934 N GLN A 61 8.929 -10.500 7.345 1.00 0.00 N ATOM 935 CA GLN A 61 7.613 -11.128 7.351 1.00 0.00 C ATOM 936 C GLN A 61 6.758 -10.610 6.198 1.00 0.00 C ATOM 937 O GLN A 61 7.144 -9.676 5.497 1.00 0.00 O ATOM 938 CB GLN A 61 6.907 -10.867 8.682 1.00 0.00 C ATOM 939 CG GLN A 61 7.589 -11.523 9.872 1.00 0.00 C ATOM 940 CD GLN A 61 6.603 -12.168 10.826 1.00 0.00 C ATOM 941 OE1 GLN A 61 5.671 -12.851 10.406 1.00 0.00 O ATOM 942 NE2 GLN A 61 6.806 -11.953 12.121 1.00 0.00 N ATOM 0 H GLN A 61 9.133 -9.941 8.174 1.00 0.00 H new ATOM 0 HA GLN A 61 7.749 -12.202 7.225 1.00 0.00 H new ATOM 0 HB2 GLN A 61 6.855 -9.791 8.851 1.00 0.00 H new ATOM 0 HB3 GLN A 61 5.881 -11.229 8.617 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.289 -12.278 9.514 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.173 -10.775 10.409 1.00 0.00 H new ATOM 0 HE21 GLN A 61 7.593 -11.379 12.426 1.00 0.00 H new ATOM 0 HE22 GLN A 61 6.175 -12.362 12.811 1.00 0.00 H new ATOM 951 N ALA A 62 5.595 -11.225 6.010 1.00 0.00 N ATOM 952 CA ALA A 62 4.685 -10.828 4.944 1.00 0.00 C ATOM 953 C ALA A 62 3.555 -9.957 5.484 1.00 0.00 C ATOM 954 O ALA A 62 3.146 -8.987 4.845 1.00 0.00 O ATOM 955 CB ALA A 62 4.120 -12.056 4.246 1.00 0.00 C ATOM 0 H ALA A 62 5.261 -12.000 6.583 1.00 0.00 H new ATOM 0 HA ALA A 62 5.248 -10.240 4.219 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.442 -11.743 3.452 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.936 -12.639 3.818 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.577 -12.667 4.967 1.00 0.00 H new ATOM 961 N GLU A 63 3.055 -10.311 6.663 1.00 0.00 N ATOM 962 CA GLU A 63 1.972 -9.561 7.290 1.00 0.00 C ATOM 963 C GLU A 63 2.416 -8.140 7.621 1.00 0.00 C ATOM 964 O GLU A 63 1.699 -7.176 7.354 1.00 0.00 O ATOM 965 CB GLU A 63 1.497 -10.275 8.558 1.00 0.00 C ATOM 966 CG GLU A 63 0.058 -10.760 8.480 1.00 0.00 C ATOM 967 CD GLU A 63 -0.088 -12.218 8.868 1.00 0.00 C ATOM 968 OE1 GLU A 63 0.666 -12.677 9.751 1.00 0.00 O ATOM 969 OE2 GLU A 63 -0.959 -12.902 8.289 1.00 0.00 O ATOM 0 H GLU A 63 3.382 -11.112 7.204 1.00 0.00 H new ATOM 0 HA GLU A 63 1.143 -9.505 6.584 1.00 0.00 H new ATOM 0 HB2 GLU A 63 2.149 -11.127 8.751 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.598 -9.598 9.406 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.563 -10.150 9.135 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.315 -10.619 7.465 1.00 0.00 H new ATOM 976 N ASP A 64 3.604 -8.019 8.205 1.00 0.00 N ATOM 977 CA ASP A 64 4.146 -6.715 8.573 1.00 0.00 C ATOM 978 C ASP A 64 4.524 -5.913 7.332 1.00 0.00 C ATOM 979 O ASP A 64 4.473 -4.683 7.336 1.00 0.00 O ATOM 980 CB ASP A 64 5.368 -6.884 9.478 1.00 0.00 C ATOM 981 CG ASP A 64 4.986 -7.175 10.916 1.00 0.00 C ATOM 982 OD1 ASP A 64 3.918 -6.699 11.355 1.00 0.00 O ATOM 983 OD2 ASP A 64 5.756 -7.879 11.603 1.00 0.00 O ATOM 0 H ASP A 64 4.210 -8.807 8.434 1.00 0.00 H new ATOM 0 HA ASP A 64 3.374 -6.168 9.115 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.988 -7.696 9.098 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.972 -5.977 9.442 1.00 0.00 H new ATOM 988 N LYS A 65 4.904 -6.617 6.270 1.00 0.00 N ATOM 989 CA LYS A 65 5.291 -5.969 5.023 1.00 0.00 C ATOM 990 C LYS A 65 4.148 -5.122 4.472 1.00 0.00 C ATOM 991 O LYS A 65 4.374 -4.065 3.883 1.00 0.00 O ATOM 992 CB LYS A 65 5.710 -7.017 3.988 1.00 0.00 C ATOM 993 CG LYS A 65 6.945 -6.625 3.194 1.00 0.00 C ATOM 994 CD LYS A 65 7.590 -7.834 2.535 1.00 0.00 C ATOM 995 CE LYS A 65 8.889 -7.462 1.838 1.00 0.00 C ATOM 996 NZ LYS A 65 8.696 -7.261 0.375 1.00 0.00 N ATOM 0 H LYS A 65 4.952 -7.636 6.249 1.00 0.00 H new ATOM 0 HA LYS A 65 6.137 -5.314 5.230 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.900 -7.962 4.496 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.883 -7.186 3.298 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.672 -5.896 2.431 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.665 -6.142 3.854 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.785 -8.599 3.287 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.899 -8.267 1.812 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.290 -6.550 2.280 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.627 -8.247 2.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.605 -7.009 -0.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.337 -8.139 -0.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.011 -6.495 0.217 1.00 0.00 H new ATOM 1010 N LEU A 66 2.921 -5.592 4.669 1.00 0.00 N ATOM 1011 CA LEU A 66 1.743 -4.878 4.192 1.00 0.00 C ATOM 1012 C LEU A 66 1.484 -3.632 5.033 1.00 0.00 C ATOM 1013 O LEU A 66 0.986 -2.624 4.532 1.00 0.00 O ATOM 1014 CB LEU A 66 0.517 -5.793 4.226 1.00 0.00 C ATOM 1015 CG LEU A 66 -0.580 -5.442 3.218 1.00 0.00 C ATOM 1016 CD1 LEU A 66 -0.118 -5.741 1.801 1.00 0.00 C ATOM 1017 CD2 LEU A 66 -1.858 -6.203 3.536 1.00 0.00 C ATOM 0 H LEU A 66 2.717 -6.465 5.156 1.00 0.00 H new ATOM 0 HA LEU A 66 1.929 -4.569 3.164 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.842 -6.818 4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.090 -5.767 5.229 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.788 -4.375 3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.911 -5.485 1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.771 -5.151 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.118 -6.801 1.711 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.627 -5.942 2.810 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.664 -7.275 3.490 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.199 -5.939 4.537 1.00 0.00 H new ATOM 1029 N ASP A 67 1.828 -3.709 6.315 1.00 0.00 N ATOM 1030 CA ASP A 67 1.633 -2.587 7.226 1.00 0.00 C ATOM 1031 C ASP A 67 2.422 -1.367 6.763 1.00 0.00 C ATOM 1032 O ASP A 67 1.990 -0.229 6.946 1.00 0.00 O ATOM 1033 CB ASP A 67 2.059 -2.974 8.644 1.00 0.00 C ATOM 1034 CG ASP A 67 1.176 -2.346 9.704 1.00 0.00 C ATOM 1035 OD1 ASP A 67 1.195 -1.105 9.833 1.00 0.00 O ATOM 1036 OD2 ASP A 67 0.465 -3.097 10.405 1.00 0.00 O ATOM 0 H ASP A 67 2.243 -4.535 6.746 1.00 0.00 H new ATOM 0 HA ASP A 67 0.573 -2.334 7.228 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.029 -4.059 8.746 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.092 -2.667 8.807 1.00 0.00 H new ATOM 1041 N ARG A 68 3.582 -1.611 6.161 1.00 0.00 N ATOM 1042 CA ARG A 68 4.431 -0.531 5.671 1.00 0.00 C ATOM 1043 C ARG A 68 3.960 -0.045 4.304 1.00 0.00 C ATOM 1044 O ARG A 68 3.979 1.153 4.020 1.00 0.00 O ATOM 1045 CB ARG A 68 5.886 -0.996 5.585 1.00 0.00 C ATOM 1046 CG ARG A 68 6.886 0.146 5.498 1.00 0.00 C ATOM 1047 CD ARG A 68 7.492 0.462 6.856 1.00 0.00 C ATOM 1048 NE ARG A 68 6.882 1.640 7.467 1.00 0.00 N ATOM 1049 CZ ARG A 68 7.439 2.333 8.458 1.00 0.00 C ATOM 1050 NH1 ARG A 68 8.617 1.970 8.950 1.00 0.00 N ATOM 1051 NH2 ARG A 68 6.817 3.392 8.956 1.00 0.00 N ATOM 0 H ARG A 68 3.955 -2.547 6.001 1.00 0.00 H new ATOM 0 HA ARG A 68 4.362 0.298 6.375 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.117 -1.604 6.460 1.00 0.00 H new ATOM 0 HB3 ARG A 68 6.003 -1.637 4.711 1.00 0.00 H new ATOM 0 HG2 ARG A 68 7.679 -0.116 4.797 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.392 1.034 5.103 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.366 -0.395 7.517 1.00 0.00 H new ATOM 0 HD3 ARG A 68 8.564 0.625 6.745 1.00 0.00 H new ATOM 0 HE ARG A 68 5.977 1.950 7.114 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.100 1.157 8.569 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.039 2.505 9.709 1.00 0.00 H new ATOM 0 HH21 ARG A 68 5.912 3.676 8.580 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.243 3.923 9.715 1.00 0.00 H new ATOM 1065 N LEU A 69 3.535 -0.981 3.462 1.00 0.00 N ATOM 1066 CA LEU A 69 3.059 -0.647 2.125 1.00 0.00 C ATOM 1067 C LEU A 69 1.858 0.292 2.194 1.00 0.00 C ATOM 1068 O LEU A 69 1.734 1.216 1.391 1.00 0.00 O ATOM 1069 CB LEU A 69 2.682 -1.920 1.363 1.00 0.00 C ATOM 1070 CG LEU A 69 2.342 -1.711 -0.114 1.00 0.00 C ATOM 1071 CD1 LEU A 69 3.611 -1.532 -0.934 1.00 0.00 C ATOM 1072 CD2 LEU A 69 1.524 -2.880 -0.641 1.00 0.00 C ATOM 0 H LEU A 69 3.511 -1.977 3.682 1.00 0.00 H new ATOM 0 HA LEU A 69 3.865 -0.139 1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.509 -2.626 1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.826 -2.381 1.856 1.00 0.00 H new ATOM 0 HG LEU A 69 1.745 -0.804 -0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.349 -1.385 -1.982 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.159 -0.663 -0.571 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.235 -2.420 -0.837 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.290 -2.716 -1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.097 -3.801 -0.536 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.598 -2.962 -0.072 1.00 0.00 H new ATOM 1084 N PHE A 70 0.978 0.048 3.159 1.00 0.00 N ATOM 1085 CA PHE A 70 -0.213 0.873 3.333 1.00 0.00 C ATOM 1086 C PHE A 70 0.145 2.228 3.935 1.00 0.00 C ATOM 1087 O PHE A 70 -0.541 3.223 3.700 1.00 0.00 O ATOM 1088 CB PHE A 70 -1.228 0.158 4.226 1.00 0.00 C ATOM 1089 CG PHE A 70 -2.129 -0.783 3.479 1.00 0.00 C ATOM 1090 CD1 PHE A 70 -1.600 -1.770 2.662 1.00 0.00 C ATOM 1091 CD2 PHE A 70 -3.506 -0.680 3.592 1.00 0.00 C ATOM 1092 CE1 PHE A 70 -2.426 -2.636 1.973 1.00 0.00 C ATOM 1093 CE2 PHE A 70 -4.338 -1.544 2.905 1.00 0.00 C ATOM 1094 CZ PHE A 70 -3.798 -2.523 2.094 1.00 0.00 C ATOM 0 H PHE A 70 1.066 -0.713 3.832 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.656 1.038 2.351 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.693 -0.399 4.996 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.838 0.903 4.737 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.529 -1.863 2.563 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.934 0.084 4.224 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.000 -3.401 1.340 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.410 -1.454 3.002 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.446 -3.199 1.556 1.00 0.00 H new ATOM 1104 N GLU A 71 1.222 2.261 4.713 1.00 0.00 N ATOM 1105 CA GLU A 71 1.670 3.495 5.347 1.00 0.00 C ATOM 1106 C GLU A 71 2.135 4.507 4.305 1.00 0.00 C ATOM 1107 O GLU A 71 1.801 5.689 4.381 1.00 0.00 O ATOM 1108 CB GLU A 71 2.803 3.203 6.334 1.00 0.00 C ATOM 1109 CG GLU A 71 2.714 4.009 7.619 1.00 0.00 C ATOM 1110 CD GLU A 71 3.502 5.302 7.552 1.00 0.00 C ATOM 1111 OE1 GLU A 71 3.430 5.988 6.511 1.00 0.00 O ATOM 1112 OE2 GLU A 71 4.193 5.628 8.541 1.00 0.00 O ATOM 0 H GLU A 71 1.801 1.447 4.919 1.00 0.00 H new ATOM 0 HA GLU A 71 0.826 3.922 5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.795 2.141 6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.757 3.411 5.850 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.669 4.235 7.830 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.083 3.406 8.448 1.00 0.00 H new ATOM 1119 N ILE A 72 2.908 4.035 3.333 1.00 0.00 N ATOM 1120 CA ILE A 72 3.419 4.899 2.276 1.00 0.00 C ATOM 1121 C ILE A 72 2.313 5.288 1.300 1.00 0.00 C ATOM 1122 O ILE A 72 2.110 6.467 1.014 1.00 0.00 O ATOM 1123 CB ILE A 72 4.562 4.221 1.496 1.00 0.00 C ATOM 1124 CG1 ILE A 72 5.617 3.677 2.462 1.00 0.00 C ATOM 1125 CG2 ILE A 72 5.190 5.199 0.514 1.00 0.00 C ATOM 1126 CD1 ILE A 72 6.482 2.589 1.862 1.00 0.00 C ATOM 0 H ILE A 72 3.194 3.059 3.255 1.00 0.00 H new ATOM 0 HA ILE A 72 3.804 5.796 2.761 1.00 0.00 H new ATOM 0 HB ILE A 72 4.148 3.386 0.931 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.255 4.498 2.790 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.119 3.286 3.349 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.995 4.703 -0.028 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.434 5.541 -0.192 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.591 6.054 1.058 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.207 2.251 2.602 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.854 1.751 1.559 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.008 2.981 0.992 1.00 0.00 H new ATOM 1138 N ILE A 73 1.601 4.286 0.793 1.00 0.00 N ATOM 1139 CA ILE A 73 0.515 4.523 -0.150 1.00 0.00 C ATOM 1140 C ILE A 73 -0.653 5.234 0.526 1.00 0.00 C ATOM 1141 O ILE A 73 -1.387 5.988 -0.113 1.00 0.00 O ATOM 1142 CB ILE A 73 0.011 3.205 -0.771 1.00 0.00 C ATOM 1143 CG1 ILE A 73 1.182 2.409 -1.352 1.00 0.00 C ATOM 1144 CG2 ILE A 73 -1.030 3.484 -1.844 1.00 0.00 C ATOM 1145 CD1 ILE A 73 1.860 3.096 -2.518 1.00 0.00 C ATOM 0 H ILE A 73 1.757 3.304 1.019 1.00 0.00 H new ATOM 0 HA ILE A 73 0.915 5.157 -0.941 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.457 2.610 0.013 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.917 2.234 -0.566 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.822 1.432 -1.675 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.374 2.542 -2.271 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.875 4.012 -1.403 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.588 4.098 -2.629 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.680 2.475 -2.879 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.138 3.247 -3.321 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.250 4.061 -2.195 1.00 0.00 H new ATOM 1157 N GLY A 74 -0.819 4.988 1.822 1.00 0.00 N ATOM 1158 CA GLY A 74 -1.901 5.612 2.563 1.00 0.00 C ATOM 1159 C GLY A 74 -1.821 7.126 2.543 1.00 0.00 C ATOM 1160 O GLY A 74 -2.836 7.809 2.680 1.00 0.00 O ATOM 0 H GLY A 74 -0.224 4.368 2.372 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.855 5.296 2.141 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.878 5.264 3.596 1.00 0.00 H new ATOM 1164 N VAL A 75 -0.612 7.653 2.373 1.00 0.00 N ATOM 1165 CA VAL A 75 -0.406 9.096 2.336 1.00 0.00 C ATOM 1166 C VAL A 75 0.198 9.534 1.007 1.00 0.00 C ATOM 1167 O VAL A 75 0.958 10.501 0.946 1.00 0.00 O ATOM 1168 CB VAL A 75 0.511 9.564 3.484 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -0.133 9.279 4.832 1.00 0.00 C ATOM 1170 CG2 VAL A 75 1.877 8.898 3.385 1.00 0.00 C ATOM 0 H VAL A 75 0.239 7.102 2.259 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.387 9.556 2.454 1.00 0.00 H new ATOM 0 HB VAL A 75 0.652 10.641 3.395 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.529 9.616 5.630 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.083 9.809 4.901 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.307 8.208 4.933 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.509 9.241 4.204 1.00 0.00 H new ATOM 0 HG22 VAL A 75 1.760 7.816 3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.341 9.159 2.434 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.145 8.816 -0.059 1.00 0.00 N ATOM 1181 CA LYS A 76 0.363 9.131 -1.388 1.00 0.00 C ATOM 1182 C LYS A 76 -0.694 9.852 -2.219 1.00 0.00 C ATOM 1183 O LYS A 76 -0.508 11.001 -2.618 1.00 0.00 O ATOM 1184 CB LYS A 76 0.808 7.855 -2.104 1.00 0.00 C ATOM 1185 CG LYS A 76 2.034 8.045 -2.982 1.00 0.00 C ATOM 1186 CD LYS A 76 2.127 6.970 -4.055 1.00 0.00 C ATOM 1187 CE LYS A 76 3.265 6.002 -3.779 1.00 0.00 C ATOM 1188 NZ LYS A 76 4.597 6.641 -3.965 1.00 0.00 N ATOM 0 H LYS A 76 -0.773 8.013 -0.027 1.00 0.00 H new ATOM 0 HA LYS A 76 1.222 9.792 -1.273 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.020 7.086 -1.361 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.014 7.487 -2.718 1.00 0.00 H new ATOM 0 HG2 LYS A 76 1.996 9.027 -3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.932 8.022 -2.364 1.00 0.00 H new ATOM 0 HD2 LYS A 76 1.186 6.422 -4.104 1.00 0.00 H new ATOM 0 HD3 LYS A 76 2.275 7.438 -5.028 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.182 5.626 -2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.179 5.142 -4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.295 6.173 -3.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.891 6.549 -4.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 4.537 7.648 -3.714 1.00 0.00 H new ATOM 1202 N SER A 77 -1.804 9.168 -2.475 1.00 0.00 N ATOM 1203 CA SER A 77 -2.892 9.741 -3.258 1.00 0.00 C ATOM 1204 C SER A 77 -4.090 8.798 -3.297 1.00 0.00 C ATOM 1205 O SER A 77 -3.983 7.627 -2.935 1.00 0.00 O ATOM 1206 CB SER A 77 -2.420 10.044 -4.680 1.00 0.00 C ATOM 1207 OG SER A 77 -2.993 11.247 -5.163 1.00 0.00 O ATOM 0 H SER A 77 -1.974 8.216 -2.151 1.00 0.00 H new ATOM 0 HA SER A 77 -3.200 10.671 -2.779 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.333 10.123 -4.696 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.689 9.219 -5.339 1.00 0.00 H new ATOM 0 HG SER A 77 -2.674 11.419 -6.073 1.00 0.00 H new ATOM 1213 N GLN A 78 -5.231 9.318 -3.739 1.00 0.00 N ATOM 1214 CA GLN A 78 -6.450 8.521 -3.827 1.00 0.00 C ATOM 1215 C GLN A 78 -6.311 7.422 -4.875 1.00 0.00 C ATOM 1216 O GLN A 78 -6.948 6.374 -4.777 1.00 0.00 O ATOM 1217 CB GLN A 78 -7.644 9.416 -4.164 1.00 0.00 C ATOM 1218 CG GLN A 78 -8.989 8.770 -3.873 1.00 0.00 C ATOM 1219 CD GLN A 78 -10.143 9.516 -4.513 1.00 0.00 C ATOM 1220 OE1 GLN A 78 -10.665 9.105 -5.550 1.00 0.00 O ATOM 1221 NE2 GLN A 78 -10.549 10.620 -3.897 1.00 0.00 N ATOM 0 H GLN A 78 -5.337 10.286 -4.041 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.617 8.051 -2.858 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.565 10.343 -3.596 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.600 9.685 -5.219 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.980 7.742 -4.235 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -9.142 8.727 -2.795 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.088 10.925 -3.040 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -11.322 11.164 -4.281 1.00 0.00 H new ATOM 1230 N GLU A 79 -5.475 7.669 -5.879 1.00 0.00 N ATOM 1231 CA GLU A 79 -5.254 6.700 -6.946 1.00 0.00 C ATOM 1232 C GLU A 79 -4.522 5.469 -6.421 1.00 0.00 C ATOM 1233 O GLU A 79 -4.929 4.336 -6.677 1.00 0.00 O ATOM 1234 CB GLU A 79 -4.457 7.335 -8.085 1.00 0.00 C ATOM 1235 CG GLU A 79 -4.845 6.819 -9.462 1.00 0.00 C ATOM 1236 CD GLU A 79 -3.648 6.368 -10.275 1.00 0.00 C ATOM 1237 OE1 GLU A 79 -3.275 5.181 -10.175 1.00 0.00 O ATOM 1238 OE2 GLU A 79 -3.083 7.203 -11.014 1.00 0.00 O ATOM 0 H GLU A 79 -4.940 8.532 -5.976 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.227 6.387 -7.325 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.599 8.415 -8.058 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.395 7.149 -7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.539 5.986 -9.351 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.373 7.603 -10.004 1.00 0.00 H new ATOM 1245 N ALA A 80 -3.440 5.701 -5.685 1.00 0.00 N ATOM 1246 CA ALA A 80 -2.651 4.611 -5.124 1.00 0.00 C ATOM 1247 C ALA A 80 -3.383 3.941 -3.966 1.00 0.00 C ATOM 1248 O ALA A 80 -3.218 2.746 -3.723 1.00 0.00 O ATOM 1249 CB ALA A 80 -1.294 5.125 -4.667 1.00 0.00 C ATOM 0 H ALA A 80 -3.090 6.633 -5.463 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.502 3.864 -5.904 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.715 4.301 -4.250 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.761 5.550 -5.517 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.433 5.893 -3.906 1.00 0.00 H new ATOM 1255 N SER A 81 -4.192 4.719 -3.254 1.00 0.00 N ATOM 1256 CA SER A 81 -4.950 4.200 -2.121 1.00 0.00 C ATOM 1257 C SER A 81 -6.063 3.270 -2.590 1.00 0.00 C ATOM 1258 O SER A 81 -6.180 2.139 -2.119 1.00 0.00 O ATOM 1259 CB SER A 81 -5.542 5.352 -1.306 1.00 0.00 C ATOM 1260 OG SER A 81 -6.567 4.893 -0.442 1.00 0.00 O ATOM 0 H SER A 81 -4.340 5.711 -3.441 1.00 0.00 H new ATOM 0 HA SER A 81 -4.267 3.630 -1.490 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.756 5.829 -0.721 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.942 6.110 -1.980 1.00 0.00 H new ATOM 0 HG SER A 81 -7.301 5.543 -0.431 1.00 0.00 H new ATOM 1266 N GLN A 82 -6.881 3.754 -3.520 1.00 0.00 N ATOM 1267 CA GLN A 82 -7.987 2.964 -4.052 1.00 0.00 C ATOM 1268 C GLN A 82 -7.479 1.677 -4.694 1.00 0.00 C ATOM 1269 O GLN A 82 -8.024 0.599 -4.462 1.00 0.00 O ATOM 1270 CB GLN A 82 -8.779 3.781 -5.074 1.00 0.00 C ATOM 1271 CG GLN A 82 -10.238 3.372 -5.181 1.00 0.00 C ATOM 1272 CD GLN A 82 -10.967 3.461 -3.855 1.00 0.00 C ATOM 1273 OE1 GLN A 82 -11.525 4.502 -3.508 1.00 0.00 O ATOM 1274 NE2 GLN A 82 -10.966 2.364 -3.104 1.00 0.00 N ATOM 0 H GLN A 82 -6.799 4.688 -3.921 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.643 2.699 -3.223 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.725 4.836 -4.804 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.309 3.678 -6.052 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.738 4.010 -5.910 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.299 2.351 -5.557 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.491 1.523 -3.431 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.441 2.364 -2.201 1.00 0.00 H new ATOM 1283 N THR A 83 -6.432 1.800 -5.504 1.00 0.00 N ATOM 1284 CA THR A 83 -5.852 0.646 -6.181 1.00 0.00 C ATOM 1285 C THR A 83 -5.235 -0.322 -5.178 1.00 0.00 C ATOM 1286 O THR A 83 -5.314 -1.539 -5.346 1.00 0.00 O ATOM 1287 CB THR A 83 -4.791 1.099 -7.187 1.00 0.00 C ATOM 1288 OG1 THR A 83 -5.340 2.019 -8.114 1.00 0.00 O ATOM 1289 CG2 THR A 83 -4.190 -0.044 -7.976 1.00 0.00 C ATOM 0 H THR A 83 -5.969 2.686 -5.707 1.00 0.00 H new ATOM 0 HA THR A 83 -6.652 0.129 -6.712 1.00 0.00 H new ATOM 0 HB THR A 83 -4.005 1.561 -6.590 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.290 2.925 -7.744 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.446 0.345 -8.671 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.715 -0.748 -7.292 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.976 -0.554 -8.534 1.00 0.00 H new ATOM 1297 N LEU A 84 -4.621 0.225 -4.133 1.00 0.00 N ATOM 1298 CA LEU A 84 -3.992 -0.594 -3.103 1.00 0.00 C ATOM 1299 C LEU A 84 -5.014 -1.502 -2.428 1.00 0.00 C ATOM 1300 O LEU A 84 -4.781 -2.700 -2.265 1.00 0.00 O ATOM 1301 CB LEU A 84 -3.314 0.296 -2.058 1.00 0.00 C ATOM 1302 CG LEU A 84 -2.631 -0.457 -0.915 1.00 0.00 C ATOM 1303 CD1 LEU A 84 -1.492 -1.313 -1.445 1.00 0.00 C ATOM 1304 CD2 LEU A 84 -2.124 0.519 0.137 1.00 0.00 C ATOM 0 H LEU A 84 -4.546 1.230 -3.978 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.239 -1.220 -3.582 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.572 0.918 -2.558 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.061 0.968 -1.635 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.364 -1.115 -0.448 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.018 -1.841 -0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.883 -2.036 -2.161 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.757 -0.676 -1.937 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.641 -0.033 0.943 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.406 1.202 -0.316 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.962 1.088 0.539 1.00 0.00 H new ATOM 1316 N LEU A 85 -6.145 -0.925 -2.037 1.00 0.00 N ATOM 1317 CA LEU A 85 -7.202 -1.683 -1.378 1.00 0.00 C ATOM 1318 C LEU A 85 -7.958 -2.549 -2.380 1.00 0.00 C ATOM 1319 O LEU A 85 -8.413 -3.644 -2.050 1.00 0.00 O ATOM 1320 CB LEU A 85 -8.174 -0.737 -0.671 1.00 0.00 C ATOM 1321 CG LEU A 85 -7.574 0.059 0.490 1.00 0.00 C ATOM 1322 CD1 LEU A 85 -8.198 1.444 0.568 1.00 0.00 C ATOM 1323 CD2 LEU A 85 -7.765 -0.688 1.802 1.00 0.00 C ATOM 0 H LEU A 85 -6.353 0.065 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.737 -2.335 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.573 -0.036 -1.404 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.016 -1.319 -0.296 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.505 0.175 0.312 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.759 1.995 1.400 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.010 1.981 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.273 1.351 0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.333 -0.108 2.617 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.829 -0.834 1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.270 -1.657 1.744 1.00 0.00 H new ATOM 1335 N ASP A 86 -8.090 -2.051 -3.605 1.00 0.00 N ATOM 1336 CA ASP A 86 -8.792 -2.779 -4.656 1.00 0.00 C ATOM 1337 C ASP A 86 -8.005 -4.013 -5.084 1.00 0.00 C ATOM 1338 O ASP A 86 -8.580 -5.073 -5.333 1.00 0.00 O ATOM 1339 CB ASP A 86 -9.033 -1.871 -5.863 1.00 0.00 C ATOM 1340 CG ASP A 86 -10.110 -2.408 -6.785 1.00 0.00 C ATOM 1341 OD1 ASP A 86 -10.240 -3.646 -6.887 1.00 0.00 O ATOM 1342 OD2 ASP A 86 -10.821 -1.591 -7.407 1.00 0.00 O ATOM 0 H ASP A 86 -7.720 -1.146 -3.895 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.753 -3.103 -4.256 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.318 -0.878 -5.516 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.103 -1.759 -6.421 1.00 0.00 H new ATOM 1347 N SER A 87 -6.686 -3.869 -5.168 1.00 0.00 N ATOM 1348 CA SER A 87 -5.821 -4.973 -5.567 1.00 0.00 C ATOM 1349 C SER A 87 -5.953 -6.146 -4.601 1.00 0.00 C ATOM 1350 O SER A 87 -5.807 -7.304 -4.993 1.00 0.00 O ATOM 1351 CB SER A 87 -4.364 -4.509 -5.627 1.00 0.00 C ATOM 1352 OG SER A 87 -3.622 -5.275 -6.560 1.00 0.00 O ATOM 0 H SER A 87 -6.193 -2.999 -4.965 1.00 0.00 H new ATOM 0 HA SER A 87 -6.132 -5.305 -6.557 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.326 -3.456 -5.905 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.911 -4.595 -4.639 1.00 0.00 H new ATOM 0 HG SER A 87 -2.695 -4.958 -6.580 1.00 0.00 H new ATOM 1358 N VAL A 88 -6.231 -5.839 -3.339 1.00 0.00 N ATOM 1359 CA VAL A 88 -6.384 -6.868 -2.318 1.00 0.00 C ATOM 1360 C VAL A 88 -7.545 -7.801 -2.646 1.00 0.00 C ATOM 1361 O VAL A 88 -7.358 -9.008 -2.808 1.00 0.00 O ATOM 1362 CB VAL A 88 -6.615 -6.251 -0.926 1.00 0.00 C ATOM 1363 CG1 VAL A 88 -6.572 -7.324 0.150 1.00 0.00 C ATOM 1364 CG2 VAL A 88 -5.588 -5.163 -0.647 1.00 0.00 C ATOM 0 H VAL A 88 -6.355 -4.886 -2.999 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.455 -7.438 -2.305 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.606 -5.796 -0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.737 -6.867 1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -7.350 -8.063 -0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -5.598 -7.812 0.138 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.767 -4.739 0.341 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.586 -5.591 -0.682 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.675 -4.379 -1.400 1.00 0.00 H new ATOM 1374 N TYR A 89 -8.743 -7.235 -2.741 1.00 0.00 N ATOM 1375 CA TYR A 89 -9.936 -8.017 -3.050 1.00 0.00 C ATOM 1376 C TYR A 89 -9.921 -8.484 -4.502 1.00 0.00 C ATOM 1377 O TYR A 89 -10.443 -9.551 -4.826 1.00 0.00 O ATOM 1378 CB TYR A 89 -11.195 -7.191 -2.780 1.00 0.00 C ATOM 1379 CG TYR A 89 -11.301 -6.693 -1.356 1.00 0.00 C ATOM 1380 CD1 TYR A 89 -11.316 -7.583 -0.289 1.00 0.00 C ATOM 1381 CD2 TYR A 89 -11.385 -5.335 -1.080 1.00 0.00 C ATOM 1382 CE1 TYR A 89 -11.413 -7.132 1.014 1.00 0.00 C ATOM 1383 CE2 TYR A 89 -11.481 -4.876 0.220 1.00 0.00 C ATOM 1384 CZ TYR A 89 -11.495 -5.778 1.263 1.00 0.00 C ATOM 1385 OH TYR A 89 -11.590 -5.325 2.559 1.00 0.00 O ATOM 0 H TYR A 89 -8.915 -6.238 -2.609 1.00 0.00 H new ATOM 0 HA TYR A 89 -9.941 -8.896 -2.406 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -11.210 -6.337 -3.457 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -12.072 -7.796 -3.010 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -11.251 -8.644 -0.481 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -11.375 -4.626 -1.894 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -11.425 -7.836 1.833 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -11.545 -3.816 0.418 1.00 0.00 H new ATOM 0 HH TYR A 89 -11.638 -4.346 2.561 1.00 0.00 H new ATOM 1395 N SER A 90 -9.321 -7.679 -5.372 1.00 0.00 N ATOM 1396 CA SER A 90 -9.239 -8.009 -6.790 1.00 0.00 C ATOM 1397 C SER A 90 -8.400 -9.265 -7.010 1.00 0.00 C ATOM 1398 O SER A 90 -8.630 -10.019 -7.955 1.00 0.00 O ATOM 1399 CB SER A 90 -8.645 -6.839 -7.575 1.00 0.00 C ATOM 1400 OG SER A 90 -8.747 -7.056 -8.971 1.00 0.00 O ATOM 0 H SER A 90 -8.884 -6.793 -5.120 1.00 0.00 H new ATOM 0 HA SER A 90 -10.249 -8.202 -7.151 1.00 0.00 H new ATOM 0 HB2 SER A 90 -9.163 -5.918 -7.308 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.599 -6.707 -7.300 1.00 0.00 H new ATOM 0 HG SER A 90 -8.361 -6.293 -9.450 1.00 0.00 H new ATOM 1406 N HIS A 91 -7.424 -9.479 -6.134 1.00 0.00 N ATOM 1407 CA HIS A 91 -6.549 -10.642 -6.234 1.00 0.00 C ATOM 1408 C HIS A 91 -7.012 -11.756 -5.300 1.00 0.00 C ATOM 1409 O HIS A 91 -6.833 -12.938 -5.592 1.00 0.00 O ATOM 1410 CB HIS A 91 -5.108 -10.251 -5.905 1.00 0.00 C ATOM 1411 CG HIS A 91 -4.421 -9.511 -7.010 1.00 0.00 C ATOM 1412 ND1 HIS A 91 -4.727 -9.668 -8.344 1.00 0.00 N ATOM 1413 CD2 HIS A 91 -3.424 -8.592 -6.959 1.00 0.00 C ATOM 1414 CE1 HIS A 91 -3.924 -8.857 -9.047 1.00 0.00 C ATOM 1415 NE2 HIS A 91 -3.114 -8.182 -8.254 1.00 0.00 N ATOM 0 H HIS A 91 -7.219 -8.863 -5.347 1.00 0.00 H new ATOM 0 HA HIS A 91 -6.594 -11.011 -7.259 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -5.104 -9.633 -5.007 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -4.540 -11.152 -5.674 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.947 -8.235 -6.058 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.938 -8.768 -10.123 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -2.407 -7.501 -8.532 1.00 0.00 H new ATOM 1423 N LEU A 92 -7.608 -11.371 -4.177 1.00 0.00 N ATOM 1424 CA LEU A 92 -8.097 -12.337 -3.199 1.00 0.00 C ATOM 1425 C LEU A 92 -9.591 -12.150 -2.947 1.00 0.00 C ATOM 1426 O LEU A 92 -9.988 -11.409 -2.047 1.00 0.00 O ATOM 1427 CB LEU A 92 -7.324 -12.201 -1.886 1.00 0.00 C ATOM 1428 CG LEU A 92 -5.824 -12.480 -1.985 1.00 0.00 C ATOM 1429 CD1 LEU A 92 -5.083 -11.839 -0.823 1.00 0.00 C ATOM 1430 CD2 LEU A 92 -5.563 -13.979 -2.025 1.00 0.00 C ATOM 0 H LEU A 92 -7.764 -10.396 -3.921 1.00 0.00 H new ATOM 0 HA LEU A 92 -7.939 -13.337 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -7.465 -11.191 -1.502 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -7.757 -12.883 -1.155 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.453 -12.041 -2.911 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -4.017 -12.049 -0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -5.243 -10.761 -0.840 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.457 -12.247 0.116 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.490 -14.160 -2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -5.950 -14.440 -1.116 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -6.062 -14.412 -2.892 1.00 0.00 H new ATOM 1442 N PRO A 93 -10.443 -12.823 -3.740 1.00 0.00 N ATOM 1443 CA PRO A 93 -11.899 -12.727 -3.596 1.00 0.00 C ATOM 1444 C PRO A 93 -12.402 -13.414 -2.331 1.00 0.00 C ATOM 1445 O PRO A 93 -13.418 -13.019 -1.759 1.00 0.00 O ATOM 1446 CB PRO A 93 -12.428 -13.443 -4.839 1.00 0.00 C ATOM 1447 CG PRO A 93 -11.348 -14.397 -5.214 1.00 0.00 C ATOM 1448 CD PRO A 93 -10.054 -13.729 -4.837 1.00 0.00 C ATOM 0 HA PRO A 93 -12.232 -11.693 -3.510 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.362 -13.965 -4.628 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.632 -12.738 -5.645 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -11.465 -15.345 -4.689 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -11.376 -14.618 -6.281 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -9.307 -14.454 -4.513 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.625 -13.182 -5.677 1.00 0.00 H new ATOM 1456 N ASP A 94 -11.683 -14.445 -1.899 1.00 0.00 N ATOM 1457 CA ASP A 94 -12.056 -15.189 -0.701 1.00 0.00 C ATOM 1458 C ASP A 94 -12.084 -14.277 0.522 1.00 0.00 C ATOM 1459 O ASP A 94 -12.814 -14.531 1.480 1.00 0.00 O ATOM 1460 CB ASP A 94 -11.079 -16.344 -0.469 1.00 0.00 C ATOM 1461 CG ASP A 94 -11.583 -17.652 -1.044 1.00 0.00 C ATOM 1462 OD1 ASP A 94 -11.762 -17.729 -2.277 1.00 0.00 O ATOM 1463 OD2 ASP A 94 -11.801 -18.601 -0.261 1.00 0.00 O ATOM 0 H ASP A 94 -10.839 -14.784 -2.360 1.00 0.00 H new ATOM 0 HA ASP A 94 -13.057 -15.593 -0.852 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -10.117 -16.099 -0.920 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -10.908 -16.463 0.601 1.00 0.00 H new ATOM 1468 N LEU A 95 -11.285 -13.214 0.483 1.00 0.00 N ATOM 1469 CA LEU A 95 -11.219 -12.265 1.589 1.00 0.00 C ATOM 1470 C LEU A 95 -12.600 -11.696 1.906 1.00 0.00 C ATOM 1471 O LEU A 95 -12.894 -11.357 3.052 1.00 0.00 O ATOM 1472 CB LEU A 95 -10.252 -11.128 1.255 1.00 0.00 C ATOM 1473 CG LEU A 95 -8.771 -11.508 1.288 1.00 0.00 C ATOM 1474 CD1 LEU A 95 -7.902 -10.298 0.977 1.00 0.00 C ATOM 1475 CD2 LEU A 95 -8.403 -12.095 2.642 1.00 0.00 C ATOM 0 H LEU A 95 -10.675 -12.989 -0.303 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.856 -12.797 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.492 -10.747 0.262 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.418 -10.312 1.958 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.592 -12.264 0.524 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.852 -10.588 1.005 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.148 -9.919 -0.015 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.084 -9.519 1.718 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.346 -12.360 2.648 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.597 -11.359 3.422 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.002 -12.987 2.827 1.00 0.00 H new ATOM 1487 N LEU A 96 -13.442 -11.594 0.884 1.00 0.00 N ATOM 1488 CA LEU A 96 -14.791 -11.065 1.054 1.00 0.00 C ATOM 1489 C LEU A 96 -15.701 -11.522 -0.082 1.00 0.00 C ATOM 1490 O LEU A 96 -15.369 -11.366 -1.257 1.00 0.00 O ATOM 1491 CB LEU A 96 -14.756 -9.536 1.120 1.00 0.00 C ATOM 1492 CG LEU A 96 -15.449 -8.925 2.339 1.00 0.00 C ATOM 1493 CD1 LEU A 96 -14.708 -7.683 2.809 1.00 0.00 C ATOM 1494 CD2 LEU A 96 -16.899 -8.595 2.017 1.00 0.00 C ATOM 0 H LEU A 96 -13.215 -11.871 -0.071 1.00 0.00 H new ATOM 0 HA LEU A 96 -15.193 -11.451 1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -13.716 -9.211 1.111 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.222 -9.138 0.219 1.00 0.00 H new ATOM 0 HG LEU A 96 -15.434 -9.657 3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.216 -7.263 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -13.687 -7.950 3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.689 -6.945 2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -17.377 -8.161 2.895 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -16.936 -7.881 1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -17.425 -9.506 1.731 1.00 0.00 H new ATOM 1506 N SER A 97 -16.851 -12.085 0.277 1.00 0.00 N ATOM 1507 CA SER A 97 -17.808 -12.563 -0.713 1.00 0.00 C ATOM 1508 C SER A 97 -19.202 -12.688 -0.107 1.00 0.00 C ATOM 1509 O SER A 97 -19.359 -13.150 1.024 1.00 0.00 O ATOM 1510 CB SER A 97 -17.361 -13.914 -1.274 1.00 0.00 C ATOM 1511 OG SER A 97 -16.596 -13.748 -2.456 1.00 0.00 O ATOM 0 H SER A 97 -17.142 -12.221 1.245 1.00 0.00 H new ATOM 0 HA SER A 97 -17.848 -11.835 -1.524 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.771 -14.444 -0.527 1.00 0.00 H new ATOM 0 HB3 SER A 97 -18.235 -14.530 -1.486 1.00 0.00 H new ATOM 0 HG SER A 97 -16.001 -12.976 -2.355 1.00 0.00 H new ATOM 1517 N GLY A 98 -20.211 -12.274 -0.866 1.00 0.00 N ATOM 1518 CA GLY A 98 -21.580 -12.349 -0.387 1.00 0.00 C ATOM 1519 C GLY A 98 -22.099 -11.007 0.097 1.00 0.00 C ATOM 1520 O GLY A 98 -21.344 -10.216 0.663 1.00 0.00 O ATOM 0 H GLY A 98 -20.106 -11.888 -1.804 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -22.222 -12.716 -1.187 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -21.638 -13.073 0.426 1.00 0.00 H new ATOM 1524 N PRO A 99 -23.395 -10.717 -0.113 1.00 0.00 N ATOM 1525 CA PRO A 99 -24.000 -9.452 0.314 1.00 0.00 C ATOM 1526 C PRO A 99 -24.214 -9.390 1.822 1.00 0.00 C ATOM 1527 O PRO A 99 -24.759 -10.318 2.420 1.00 0.00 O ATOM 1528 CB PRO A 99 -25.342 -9.441 -0.417 1.00 0.00 C ATOM 1529 CG PRO A 99 -25.682 -10.880 -0.598 1.00 0.00 C ATOM 1530 CD PRO A 99 -24.372 -11.599 -0.781 1.00 0.00 C ATOM 0 HA PRO A 99 -23.365 -8.597 0.084 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -26.106 -8.923 0.163 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -25.267 -8.928 -1.376 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -26.220 -11.265 0.268 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -26.329 -11.022 -1.464 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -24.392 -12.590 -0.328 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -24.133 -11.735 -1.836 1.00 0.00 H new ATOM 1538 N SER A 100 -23.781 -8.292 2.432 1.00 0.00 N ATOM 1539 CA SER A 100 -23.926 -8.110 3.872 1.00 0.00 C ATOM 1540 C SER A 100 -25.276 -7.482 4.207 1.00 0.00 C ATOM 1541 O SER A 100 -25.815 -6.695 3.430 1.00 0.00 O ATOM 1542 CB SER A 100 -22.795 -7.234 4.412 1.00 0.00 C ATOM 1543 OG SER A 100 -21.527 -7.783 4.094 1.00 0.00 O ATOM 0 H SER A 100 -23.327 -7.515 1.952 1.00 0.00 H new ATOM 0 HA SER A 100 -23.874 -9.091 4.345 1.00 0.00 H new ATOM 0 HB2 SER A 100 -22.876 -6.231 3.993 1.00 0.00 H new ATOM 0 HB3 SER A 100 -22.891 -7.136 5.493 1.00 0.00 H new ATOM 0 HG SER A 100 -20.821 -7.203 4.449 1.00 0.00 H new ATOM 1549 N SER A 101 -25.815 -7.836 5.369 1.00 0.00 N ATOM 1550 CA SER A 101 -27.101 -7.308 5.807 1.00 0.00 C ATOM 1551 C SER A 101 -26.970 -5.853 6.247 1.00 0.00 C ATOM 1552 O SER A 101 -27.473 -4.947 5.584 1.00 0.00 O ATOM 1553 CB SER A 101 -27.659 -8.151 6.954 1.00 0.00 C ATOM 1554 OG SER A 101 -26.624 -8.579 7.824 1.00 0.00 O ATOM 0 H SER A 101 -25.381 -8.486 6.024 1.00 0.00 H new ATOM 0 HA SER A 101 -27.790 -7.354 4.964 1.00 0.00 H new ATOM 0 HB2 SER A 101 -28.391 -7.569 7.514 1.00 0.00 H new ATOM 0 HB3 SER A 101 -28.181 -9.019 6.551 1.00 0.00 H new ATOM 0 HG SER A 101 -27.007 -9.115 8.550 1.00 0.00 H new ATOM 1560 N GLY A 102 -26.292 -5.639 7.370 1.00 0.00 N ATOM 1561 CA GLY A 102 -26.107 -4.293 7.878 1.00 0.00 C ATOM 1562 C GLY A 102 -27.254 -3.844 8.763 1.00 0.00 C ATOM 1563 O GLY A 102 -27.146 -3.998 9.998 1.00 0.00 O ATOM 1564 OXT GLY A 102 -28.260 -3.341 8.221 1.00 0.00 O ATOM 0 H GLY A 102 -25.868 -6.373 7.937 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -25.176 -4.246 8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -26.007 -3.603 7.041 1.00 0.00 H new TER 1568 GLY A 102