USER MOD reduce.3.24.130724 H: found=0, std=0, add=651, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 649 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 Single : A 1 GLY N :NH3+ -124:sc= 0.0669 (180deg=0) 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= -0.0581 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.183 X(o=-0.18,f=-0.66) USER MOD Single : A 10 ASN : amide:sc=-0.00323 X(o=-0.0032,f=-0.0032) USER MOD Single : A 12 THR OG1 : rot 37:sc= 0.729 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.687 USER MOD Single : A 16 GLN : amide:sc= -0.534 X(o=-0.53,f=-0.7) USER MOD Single : A 18 GLN : amide:sc= 0.0899 K(o=0.09,f=-2.8!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 HIS :FLIP no HD1:sc= -1.34 F(o=-4.6,f=-1.3) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -1.34 K(o=-1.3,f=-2.4) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0163) USER MOD Single : A 70 ASN : amide:sc= -0.0839 K(o=-0.084,f=-0.83) USER MOD Single : A 71 GLN : amide:sc=-0.00846 X(o=-0.0085,f=-0.29) USER MOD Single : A 74 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.42) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.664 10.627 33.927 1.00 0.00 N ATOM 2 CA GLY A 1 9.696 10.666 32.846 1.00 0.00 C ATOM 3 C GLY A 1 8.651 9.575 32.965 1.00 0.00 C ATOM 4 O GLY A 1 8.535 8.927 34.005 1.00 0.00 O ATOM 0 H1 GLY A 1 10.684 11.548 34.409 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.396 9.887 34.607 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.607 10.418 33.541 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.203 11.638 32.839 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.216 10.565 31.893 1.00 0.00 H new ATOM 8 N SER A 2 7.887 9.371 31.896 1.00 0.00 N ATOM 9 CA SER A 2 6.842 8.353 31.887 1.00 0.00 C ATOM 10 C SER A 2 7.289 7.122 31.106 1.00 0.00 C ATOM 11 O SER A 2 8.300 7.152 30.403 1.00 0.00 O ATOM 12 CB SER A 2 5.557 8.918 31.277 1.00 0.00 C ATOM 13 OG SER A 2 4.424 8.181 31.704 1.00 0.00 O ATOM 0 H SER A 2 7.972 9.896 31.026 1.00 0.00 H new ATOM 0 HA SER A 2 6.648 8.057 32.918 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.444 9.964 31.563 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.624 8.891 30.189 1.00 0.00 H new ATOM 0 HG SER A 2 3.615 8.562 31.302 1.00 0.00 H new ATOM 19 N SER A 3 6.530 6.038 31.236 1.00 0.00 N ATOM 20 CA SER A 3 6.849 4.794 30.545 1.00 0.00 C ATOM 21 C SER A 3 5.968 4.615 29.313 1.00 0.00 C ATOM 22 O SER A 3 4.818 5.049 29.291 1.00 0.00 O ATOM 23 CB SER A 3 6.674 3.603 31.490 1.00 0.00 C ATOM 24 OG SER A 3 7.857 3.361 32.230 1.00 0.00 O ATOM 0 H SER A 3 5.690 5.996 31.813 1.00 0.00 H new ATOM 0 HA SER A 3 7.889 4.843 30.221 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.847 3.796 32.173 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.413 2.714 30.916 1.00 0.00 H new ATOM 0 HG SER A 3 7.719 2.596 32.827 1.00 0.00 H new ATOM 30 N GLY A 4 6.518 3.969 28.289 1.00 0.00 N ATOM 31 CA GLY A 4 5.769 3.743 27.066 1.00 0.00 C ATOM 32 C GLY A 4 6.655 3.748 25.835 1.00 0.00 C ATOM 33 O GLY A 4 7.270 4.762 25.509 1.00 0.00 O ATOM 0 H GLY A 4 7.468 3.598 28.284 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.250 2.787 27.133 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.005 4.514 26.963 1.00 0.00 H new ATOM 37 N SER A 5 6.719 2.610 25.151 1.00 0.00 N ATOM 38 CA SER A 5 7.539 2.486 23.951 1.00 0.00 C ATOM 39 C SER A 5 6.666 2.367 22.707 1.00 0.00 C ATOM 40 O SER A 5 5.498 1.986 22.787 1.00 0.00 O ATOM 41 CB SER A 5 8.458 1.268 24.062 1.00 0.00 C ATOM 42 OG SER A 5 9.160 1.047 22.851 1.00 0.00 O ATOM 0 H SER A 5 6.214 1.762 25.407 1.00 0.00 H new ATOM 0 HA SER A 5 8.148 3.386 23.861 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.168 1.417 24.876 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.869 0.385 24.311 1.00 0.00 H new ATOM 0 HG SER A 5 9.742 0.264 22.948 1.00 0.00 H new ATOM 48 N SER A 6 7.242 2.697 21.555 1.00 0.00 N ATOM 49 CA SER A 6 6.516 2.632 20.291 1.00 0.00 C ATOM 50 C SER A 6 6.955 1.420 19.475 1.00 0.00 C ATOM 51 O SER A 6 6.128 0.621 19.036 1.00 0.00 O ATOM 52 CB SER A 6 6.739 3.913 19.485 1.00 0.00 C ATOM 53 OG SER A 6 6.342 5.055 20.222 1.00 0.00 O ATOM 0 H SER A 6 8.209 3.012 21.471 1.00 0.00 H new ATOM 0 HA SER A 6 5.454 2.532 20.514 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.792 3.998 19.216 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.175 3.863 18.554 1.00 0.00 H new ATOM 0 HG SER A 6 6.496 5.860 19.686 1.00 0.00 H new ATOM 59 N GLY A 7 8.263 1.290 19.275 1.00 0.00 N ATOM 60 CA GLY A 7 8.790 0.173 18.512 1.00 0.00 C ATOM 61 C GLY A 7 8.485 0.288 17.032 1.00 0.00 C ATOM 62 O GLY A 7 7.669 -0.464 16.500 1.00 0.00 O ATOM 0 H GLY A 7 8.967 1.938 19.628 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.869 0.117 18.654 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.369 -0.756 18.896 1.00 0.00 H new ATOM 66 N GLN A 8 9.141 1.233 16.365 1.00 0.00 N ATOM 67 CA GLN A 8 8.934 1.444 14.938 1.00 0.00 C ATOM 68 C GLN A 8 10.243 1.295 14.170 1.00 0.00 C ATOM 69 O GLN A 8 11.209 2.016 14.423 1.00 0.00 O ATOM 70 CB GLN A 8 8.337 2.830 14.688 1.00 0.00 C ATOM 71 CG GLN A 8 7.558 2.930 13.386 1.00 0.00 C ATOM 72 CD GLN A 8 6.285 2.106 13.403 1.00 0.00 C ATOM 73 OE1 GLN A 8 5.590 2.035 14.416 1.00 0.00 O ATOM 74 NE2 GLN A 8 5.974 1.476 12.276 1.00 0.00 N ATOM 0 H GLN A 8 9.820 1.864 16.791 1.00 0.00 H new ATOM 0 HA GLN A 8 8.237 0.686 14.581 1.00 0.00 H new ATOM 0 HB2 GLN A 8 7.678 3.088 15.517 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.140 3.567 14.679 1.00 0.00 H new ATOM 0 HG2 GLN A 8 7.308 3.974 13.196 1.00 0.00 H new ATOM 0 HG3 GLN A 8 8.190 2.598 12.562 1.00 0.00 H new ATOM 0 HE21 GLN A 8 6.579 1.563 11.460 1.00 0.00 H new ATOM 0 HE22 GLN A 8 5.130 0.905 12.227 1.00 0.00 H new ATOM 83 N ARG A 9 10.269 0.355 13.230 1.00 0.00 N ATOM 84 CA ARG A 9 11.460 0.111 12.426 1.00 0.00 C ATOM 85 C ARG A 9 11.297 0.690 11.024 1.00 0.00 C ATOM 86 O ARG A 9 10.181 0.844 10.531 1.00 0.00 O ATOM 87 CB ARG A 9 11.744 -1.390 12.341 1.00 0.00 C ATOM 88 CG ARG A 9 10.680 -2.169 11.588 1.00 0.00 C ATOM 89 CD ARG A 9 9.583 -2.659 12.521 1.00 0.00 C ATOM 90 NE ARG A 9 8.983 -3.906 12.054 1.00 0.00 N ATOM 91 CZ ARG A 9 8.214 -3.993 10.975 1.00 0.00 C ATOM 92 NH1 ARG A 9 7.953 -2.911 10.254 1.00 0.00 N ATOM 93 NH2 ARG A 9 7.705 -5.164 10.614 1.00 0.00 N ATOM 0 H ARG A 9 9.478 -0.250 13.007 1.00 0.00 H new ATOM 0 HA ARG A 9 12.303 0.606 12.909 1.00 0.00 H new ATOM 0 HB2 ARG A 9 12.707 -1.542 11.853 1.00 0.00 H new ATOM 0 HB3 ARG A 9 11.831 -1.792 13.350 1.00 0.00 H new ATOM 0 HG2 ARG A 9 10.245 -1.537 10.813 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.139 -3.020 11.085 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.995 -2.807 13.519 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.811 -1.894 12.605 1.00 0.00 H new ATOM 0 HE ARG A 9 9.165 -4.757 12.586 1.00 0.00 H new ATOM 0 HH11 ARG A 9 8.343 -2.009 10.528 1.00 0.00 H new ATOM 0 HH12 ARG A 9 7.362 -2.981 9.426 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.904 -5.999 11.166 1.00 0.00 H new ATOM 0 HH22 ARG A 9 7.114 -5.230 9.785 1.00 0.00 H new ATOM 107 N ASN A 10 12.419 1.009 10.387 1.00 0.00 N ATOM 108 CA ASN A 10 12.401 1.572 9.041 1.00 0.00 C ATOM 109 C ASN A 10 13.398 0.852 8.138 1.00 0.00 C ATOM 110 O ASN A 10 14.564 1.237 8.051 1.00 0.00 O ATOM 111 CB ASN A 10 12.724 3.066 9.087 1.00 0.00 C ATOM 112 CG ASN A 10 11.709 3.852 9.893 1.00 0.00 C ATOM 113 OD1 ASN A 10 11.949 4.194 11.052 1.00 0.00 O ATOM 114 ND2 ASN A 10 10.565 4.144 9.283 1.00 0.00 N ATOM 0 H ASN A 10 13.352 0.887 10.781 1.00 0.00 H new ATOM 0 HA ASN A 10 11.401 1.436 8.630 1.00 0.00 H new ATOM 0 HB2 ASN A 10 13.715 3.208 9.519 1.00 0.00 H new ATOM 0 HB3 ASN A 10 12.760 3.459 8.071 1.00 0.00 H new ATOM 0 HD21 ASN A 10 9.844 4.671 9.776 1.00 0.00 H new ATOM 0 HD22 ASN A 10 10.408 3.841 8.322 1.00 0.00 H new ATOM 121 N ARG A 11 12.930 -0.196 7.466 1.00 0.00 N ATOM 122 CA ARG A 11 13.780 -0.969 6.569 1.00 0.00 C ATOM 123 C ARG A 11 13.011 -1.388 5.318 1.00 0.00 C ATOM 124 O ARG A 11 12.083 -2.195 5.388 1.00 0.00 O ATOM 125 CB ARG A 11 14.321 -2.207 7.286 1.00 0.00 C ATOM 126 CG ARG A 11 13.234 -3.133 7.808 1.00 0.00 C ATOM 127 CD ARG A 11 13.761 -4.051 8.899 1.00 0.00 C ATOM 128 NE ARG A 11 14.636 -5.090 8.364 1.00 0.00 N ATOM 129 CZ ARG A 11 15.130 -6.083 9.096 1.00 0.00 C ATOM 130 NH1 ARG A 11 14.838 -6.171 10.385 1.00 0.00 N ATOM 131 NH2 ARG A 11 15.921 -6.991 8.536 1.00 0.00 N ATOM 0 H ARG A 11 11.968 -0.528 7.526 1.00 0.00 H new ATOM 0 HA ARG A 11 14.616 -0.338 6.267 1.00 0.00 H new ATOM 0 HB2 ARG A 11 14.961 -2.762 6.601 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.947 -1.889 8.120 1.00 0.00 H new ATOM 0 HG2 ARG A 11 12.406 -2.541 8.198 1.00 0.00 H new ATOM 0 HG3 ARG A 11 12.839 -3.731 6.987 1.00 0.00 H new ATOM 0 HD2 ARG A 11 14.306 -3.462 9.636 1.00 0.00 H new ATOM 0 HD3 ARG A 11 12.923 -4.515 9.419 1.00 0.00 H new ATOM 0 HE ARG A 11 14.881 -5.052 7.375 1.00 0.00 H new ATOM 0 HH11 ARG A 11 14.232 -5.475 10.819 1.00 0.00 H new ATOM 0 HH12 ARG A 11 15.219 -6.935 10.943 1.00 0.00 H new ATOM 0 HH21 ARG A 11 16.149 -6.926 7.544 1.00 0.00 H new ATOM 0 HH22 ARG A 11 16.300 -7.753 9.098 1.00 0.00 H new ATOM 145 N THR A 12 13.403 -0.833 4.176 1.00 0.00 N ATOM 146 CA THR A 12 12.751 -1.146 2.911 1.00 0.00 C ATOM 147 C THR A 12 13.536 -2.196 2.133 1.00 0.00 C ATOM 148 O THR A 12 14.624 -1.923 1.627 1.00 0.00 O ATOM 149 CB THR A 12 12.589 0.111 2.035 1.00 0.00 C ATOM 150 OG1 THR A 12 13.870 0.700 1.785 1.00 0.00 O ATOM 151 CG2 THR A 12 11.680 1.127 2.709 1.00 0.00 C ATOM 0 H THR A 12 14.169 -0.164 4.101 1.00 0.00 H new ATOM 0 HA THR A 12 11.764 -1.540 3.154 1.00 0.00 H new ATOM 0 HB THR A 12 12.135 -0.187 1.090 1.00 0.00 H new ATOM 0 HG1 THR A 12 14.538 -0.007 1.669 1.00 0.00 H new ATOM 0 HG21 THR A 12 11.581 2.006 2.072 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.697 0.684 2.872 1.00 0.00 H new ATOM 0 HG23 THR A 12 12.109 1.420 3.667 1.00 0.00 H new ATOM 159 N SER A 13 12.976 -3.398 2.040 1.00 0.00 N ATOM 160 CA SER A 13 13.625 -4.491 1.326 1.00 0.00 C ATOM 161 C SER A 13 13.303 -4.434 -0.164 1.00 0.00 C ATOM 162 O SER A 13 14.190 -4.562 -1.008 1.00 0.00 O ATOM 163 CB SER A 13 13.187 -5.838 1.903 1.00 0.00 C ATOM 164 OG SER A 13 13.683 -6.016 3.219 1.00 0.00 O ATOM 0 H SER A 13 12.074 -3.639 2.450 1.00 0.00 H new ATOM 0 HA SER A 13 14.702 -4.384 1.451 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.099 -5.897 1.910 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.546 -6.645 1.264 1.00 0.00 H new ATOM 0 HG SER A 13 13.387 -6.884 3.565 1.00 0.00 H new ATOM 170 N PHE A 14 12.027 -4.241 -0.480 1.00 0.00 N ATOM 171 CA PHE A 14 11.585 -4.167 -1.867 1.00 0.00 C ATOM 172 C PHE A 14 12.322 -3.059 -2.615 1.00 0.00 C ATOM 173 O PHE A 14 12.973 -2.210 -2.006 1.00 0.00 O ATOM 174 CB PHE A 14 10.076 -3.925 -1.932 1.00 0.00 C ATOM 175 CG PHE A 14 9.269 -4.982 -1.235 1.00 0.00 C ATOM 176 CD1 PHE A 14 9.000 -4.885 0.121 1.00 0.00 C ATOM 177 CD2 PHE A 14 8.778 -6.073 -1.934 1.00 0.00 C ATOM 178 CE1 PHE A 14 8.257 -5.856 0.767 1.00 0.00 C ATOM 179 CE2 PHE A 14 8.034 -7.047 -1.294 1.00 0.00 C ATOM 180 CZ PHE A 14 7.775 -6.938 0.058 1.00 0.00 C ATOM 0 H PHE A 14 11.280 -4.133 0.207 1.00 0.00 H new ATOM 0 HA PHE A 14 11.814 -5.119 -2.346 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.852 -2.956 -1.487 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.769 -3.875 -2.977 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.375 -4.041 0.680 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.979 -6.164 -2.991 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.054 -5.768 1.824 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.656 -7.892 -1.851 1.00 0.00 H new ATOM 0 HZ PHE A 14 7.196 -7.699 0.560 1.00 0.00 H new ATOM 190 N THR A 15 12.216 -3.075 -3.940 1.00 0.00 N ATOM 191 CA THR A 15 12.872 -2.075 -4.772 1.00 0.00 C ATOM 192 C THR A 15 11.852 -1.174 -5.457 1.00 0.00 C ATOM 193 O THR A 15 10.708 -1.573 -5.679 1.00 0.00 O ATOM 194 CB THR A 15 13.763 -2.732 -5.844 1.00 0.00 C ATOM 195 OG1 THR A 15 12.959 -3.515 -6.735 1.00 0.00 O ATOM 196 CG2 THR A 15 14.822 -3.613 -5.201 1.00 0.00 C ATOM 0 H THR A 15 11.681 -3.771 -4.460 1.00 0.00 H new ATOM 0 HA THR A 15 13.496 -1.474 -4.110 1.00 0.00 H new ATOM 0 HB THR A 15 14.263 -1.942 -6.405 1.00 0.00 H new ATOM 0 HG1 THR A 15 13.532 -3.928 -7.415 1.00 0.00 H new ATOM 0 HG21 THR A 15 15.439 -4.066 -5.977 1.00 0.00 H new ATOM 0 HG22 THR A 15 15.449 -3.009 -4.546 1.00 0.00 H new ATOM 0 HG23 THR A 15 14.338 -4.397 -4.618 1.00 0.00 H new ATOM 204 N GLN A 16 12.272 0.041 -5.793 1.00 0.00 N ATOM 205 CA GLN A 16 11.393 0.998 -6.453 1.00 0.00 C ATOM 206 C GLN A 16 10.727 0.373 -7.676 1.00 0.00 C ATOM 207 O GLN A 16 9.587 0.696 -8.007 1.00 0.00 O ATOM 208 CB GLN A 16 12.178 2.243 -6.868 1.00 0.00 C ATOM 209 CG GLN A 16 11.301 3.454 -7.139 1.00 0.00 C ATOM 210 CD GLN A 16 10.724 3.456 -8.541 1.00 0.00 C ATOM 211 OE1 GLN A 16 9.508 3.412 -8.724 1.00 0.00 O ATOM 212 NE2 GLN A 16 11.597 3.506 -9.540 1.00 0.00 N ATOM 0 H GLN A 16 13.216 0.386 -5.619 1.00 0.00 H new ATOM 0 HA GLN A 16 10.616 1.286 -5.745 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.892 2.491 -6.082 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.756 2.016 -7.764 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.486 3.477 -6.415 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.886 4.362 -6.990 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.597 3.541 -9.342 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.268 3.509 -10.505 1.00 0.00 H new ATOM 221 N GLU A 17 11.448 -0.524 -8.341 1.00 0.00 N ATOM 222 CA GLU A 17 10.928 -1.194 -9.528 1.00 0.00 C ATOM 223 C GLU A 17 9.748 -2.093 -9.170 1.00 0.00 C ATOM 224 O GLU A 17 8.871 -2.340 -9.997 1.00 0.00 O ATOM 225 CB GLU A 17 12.028 -2.019 -10.199 1.00 0.00 C ATOM 226 CG GLU A 17 12.843 -1.235 -11.214 1.00 0.00 C ATOM 227 CD GLU A 17 13.695 -2.130 -12.094 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.467 -2.940 -11.543 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.588 -2.019 -13.333 1.00 0.00 O ATOM 0 H GLU A 17 12.393 -0.804 -8.079 1.00 0.00 H new ATOM 0 HA GLU A 17 10.583 -0.430 -10.224 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.697 -2.409 -9.432 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.575 -2.878 -10.694 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.170 -0.650 -11.841 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.486 -0.528 -10.690 1.00 0.00 H new ATOM 236 N GLN A 18 9.736 -2.580 -7.934 1.00 0.00 N ATOM 237 CA GLN A 18 8.665 -3.454 -7.468 1.00 0.00 C ATOM 238 C GLN A 18 7.560 -2.647 -6.792 1.00 0.00 C ATOM 239 O GLN A 18 6.375 -2.912 -6.993 1.00 0.00 O ATOM 240 CB GLN A 18 9.217 -4.498 -6.496 1.00 0.00 C ATOM 241 CG GLN A 18 10.363 -5.316 -7.069 1.00 0.00 C ATOM 242 CD GLN A 18 11.015 -6.212 -6.034 1.00 0.00 C ATOM 243 OE1 GLN A 18 11.157 -5.835 -4.871 1.00 0.00 O ATOM 244 NE2 GLN A 18 11.415 -7.407 -6.453 1.00 0.00 N ATOM 0 H GLN A 18 10.455 -2.385 -7.237 1.00 0.00 H new ATOM 0 HA GLN A 18 8.242 -3.962 -8.334 1.00 0.00 H new ATOM 0 HB2 GLN A 18 9.557 -3.995 -5.591 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.412 -5.172 -6.203 1.00 0.00 H new ATOM 0 HG2 GLN A 18 9.992 -5.928 -7.892 1.00 0.00 H new ATOM 0 HG3 GLN A 18 11.112 -4.643 -7.485 1.00 0.00 H new ATOM 0 HE21 GLN A 18 11.277 -7.678 -7.427 1.00 0.00 H new ATOM 0 HE22 GLN A 18 11.860 -8.053 -5.801 1.00 0.00 H new ATOM 253 N ILE A 19 7.958 -1.665 -5.991 1.00 0.00 N ATOM 254 CA ILE A 19 7.001 -0.821 -5.287 1.00 0.00 C ATOM 255 C ILE A 19 6.037 -0.151 -6.261 1.00 0.00 C ATOM 256 O ILE A 19 4.849 -0.005 -5.972 1.00 0.00 O ATOM 257 CB ILE A 19 7.712 0.267 -4.459 1.00 0.00 C ATOM 258 CG1 ILE A 19 8.665 -0.374 -3.447 1.00 0.00 C ATOM 259 CG2 ILE A 19 6.691 1.145 -3.750 1.00 0.00 C ATOM 260 CD1 ILE A 19 9.266 0.615 -2.474 1.00 0.00 C ATOM 0 H ILE A 19 8.936 -1.434 -5.813 1.00 0.00 H new ATOM 0 HA ILE A 19 6.442 -1.472 -4.615 1.00 0.00 H new ATOM 0 HB ILE A 19 8.295 0.894 -5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.127 -1.140 -2.888 1.00 0.00 H new ATOM 0 HG13 ILE A 19 9.469 -0.877 -3.985 1.00 0.00 H new ATOM 0 HG21 ILE A 19 7.209 1.909 -3.169 1.00 0.00 H new ATOM 0 HG22 ILE A 19 6.048 1.624 -4.488 1.00 0.00 H new ATOM 0 HG23 ILE A 19 6.084 0.532 -3.084 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.930 0.091 -1.787 1.00 0.00 H new ATOM 0 HD12 ILE A 19 9.832 1.368 -3.023 1.00 0.00 H new ATOM 0 HD13 ILE A 19 8.470 1.100 -1.910 1.00 0.00 H new ATOM 272 N GLU A 20 6.555 0.251 -7.418 1.00 0.00 N ATOM 273 CA GLU A 20 5.740 0.903 -8.435 1.00 0.00 C ATOM 274 C GLU A 20 4.587 0.002 -8.867 1.00 0.00 C ATOM 275 O GLU A 20 3.444 0.446 -8.973 1.00 0.00 O ATOM 276 CB GLU A 20 6.596 1.272 -9.647 1.00 0.00 C ATOM 277 CG GLU A 20 7.375 0.100 -10.221 1.00 0.00 C ATOM 278 CD GLU A 20 8.170 0.476 -11.457 1.00 0.00 C ATOM 279 OE1 GLU A 20 9.220 1.135 -11.310 1.00 0.00 O ATOM 280 OE2 GLU A 20 7.739 0.112 -12.572 1.00 0.00 O ATOM 0 H GLU A 20 7.536 0.136 -7.674 1.00 0.00 H new ATOM 0 HA GLU A 20 5.325 1.813 -8.003 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.952 1.685 -10.424 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.296 2.058 -9.362 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.054 -0.287 -9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.683 -0.704 -10.470 1.00 0.00 H new ATOM 287 N ALA A 21 4.895 -1.267 -9.115 1.00 0.00 N ATOM 288 CA ALA A 21 3.886 -2.231 -9.535 1.00 0.00 C ATOM 289 C ALA A 21 3.019 -2.665 -8.358 1.00 0.00 C ATOM 290 O ALA A 21 1.830 -2.942 -8.518 1.00 0.00 O ATOM 291 CB ALA A 21 4.547 -3.439 -10.181 1.00 0.00 C ATOM 0 H ALA A 21 5.836 -1.651 -9.032 1.00 0.00 H new ATOM 0 HA ALA A 21 3.241 -1.749 -10.269 1.00 0.00 H new ATOM 0 HB1 ALA A 21 3.781 -4.151 -10.490 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.118 -3.119 -11.053 1.00 0.00 H new ATOM 0 HB3 ALA A 21 5.216 -3.914 -9.464 1.00 0.00 H new ATOM 297 N LEU A 22 3.623 -2.725 -7.175 1.00 0.00 N ATOM 298 CA LEU A 22 2.905 -3.127 -5.971 1.00 0.00 C ATOM 299 C LEU A 22 1.912 -2.051 -5.543 1.00 0.00 C ATOM 300 O LEU A 22 0.919 -2.340 -4.879 1.00 0.00 O ATOM 301 CB LEU A 22 3.892 -3.407 -4.835 1.00 0.00 C ATOM 302 CG LEU A 22 4.562 -4.781 -4.851 1.00 0.00 C ATOM 303 CD1 LEU A 22 5.867 -4.748 -4.072 1.00 0.00 C ATOM 304 CD2 LEU A 22 3.625 -5.837 -4.282 1.00 0.00 C ATOM 0 H LEU A 22 4.607 -2.501 -7.025 1.00 0.00 H new ATOM 0 HA LEU A 22 2.350 -4.038 -6.196 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.671 -2.645 -4.861 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.366 -3.293 -3.887 1.00 0.00 H new ATOM 0 HG LEU A 22 4.787 -5.042 -5.885 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.329 -5.735 -4.095 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.542 -4.021 -4.523 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.667 -4.465 -3.039 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.118 -6.809 -4.301 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.369 -5.580 -3.254 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.717 -5.879 -4.883 1.00 0.00 H new ATOM 316 N GLU A 23 2.190 -0.810 -5.931 1.00 0.00 N ATOM 317 CA GLU A 23 1.318 0.308 -5.589 1.00 0.00 C ATOM 318 C GLU A 23 0.155 0.412 -6.569 1.00 0.00 C ATOM 319 O GLU A 23 -1.004 0.520 -6.167 1.00 0.00 O ATOM 320 CB GLU A 23 2.112 1.617 -5.581 1.00 0.00 C ATOM 321 CG GLU A 23 2.796 1.906 -4.255 1.00 0.00 C ATOM 322 CD GLU A 23 1.910 2.678 -3.296 1.00 0.00 C ATOM 323 OE1 GLU A 23 0.986 3.371 -3.772 1.00 0.00 O ATOM 324 OE2 GLU A 23 2.141 2.589 -2.073 1.00 0.00 O ATOM 0 H GLU A 23 3.010 -0.554 -6.481 1.00 0.00 H new ATOM 0 HA GLU A 23 0.914 0.129 -4.593 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.865 1.580 -6.368 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.440 2.441 -5.821 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.093 0.965 -3.791 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.708 2.474 -4.438 1.00 0.00 H new ATOM 331 N LYS A 24 0.471 0.379 -7.859 1.00 0.00 N ATOM 332 CA LYS A 24 -0.546 0.468 -8.900 1.00 0.00 C ATOM 333 C LYS A 24 -1.616 -0.601 -8.709 1.00 0.00 C ATOM 334 O LYS A 24 -2.807 -0.336 -8.869 1.00 0.00 O ATOM 335 CB LYS A 24 0.095 0.324 -10.282 1.00 0.00 C ATOM 336 CG LYS A 24 -0.703 0.983 -11.394 1.00 0.00 C ATOM 337 CD LYS A 24 0.053 0.957 -12.712 1.00 0.00 C ATOM 338 CE LYS A 24 -0.731 1.649 -13.817 1.00 0.00 C ATOM 339 NZ LYS A 24 -0.023 1.581 -15.125 1.00 0.00 N ATOM 0 H LYS A 24 1.425 0.291 -8.209 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.020 1.447 -8.827 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.094 0.758 -10.257 1.00 0.00 H new ATOM 0 HB3 LYS A 24 0.213 -0.735 -10.510 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.658 0.471 -11.511 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.926 2.015 -11.121 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.019 1.446 -12.588 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.253 -0.076 -12.998 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.713 1.185 -13.911 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.896 2.692 -13.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.589 2.064 -15.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 0.904 2.046 -15.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.112 0.586 -15.395 1.00 0.00 H new ATOM 353 N GLU A 25 -1.182 -1.810 -8.364 1.00 0.00 N ATOM 354 CA GLU A 25 -2.104 -2.920 -8.151 1.00 0.00 C ATOM 355 C GLU A 25 -3.042 -2.630 -6.983 1.00 0.00 C ATOM 356 O GLU A 25 -4.187 -3.084 -6.964 1.00 0.00 O ATOM 357 CB GLU A 25 -1.329 -4.213 -7.889 1.00 0.00 C ATOM 358 CG GLU A 25 -2.220 -5.405 -7.582 1.00 0.00 C ATOM 359 CD GLU A 25 -3.294 -5.616 -8.630 1.00 0.00 C ATOM 360 OE1 GLU A 25 -2.983 -6.195 -9.691 1.00 0.00 O ATOM 361 OE2 GLU A 25 -4.448 -5.202 -8.389 1.00 0.00 O ATOM 0 H GLU A 25 -0.199 -2.045 -8.226 1.00 0.00 H new ATOM 0 HA GLU A 25 -2.702 -3.041 -9.054 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -0.717 -4.443 -8.761 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.647 -4.055 -7.053 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -1.607 -6.303 -7.510 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -2.690 -5.261 -6.609 1.00 0.00 H new ATOM 368 N PHE A 26 -2.548 -1.873 -6.009 1.00 0.00 N ATOM 369 CA PHE A 26 -3.341 -1.523 -4.836 1.00 0.00 C ATOM 370 C PHE A 26 -4.413 -0.497 -5.189 1.00 0.00 C ATOM 371 O PHE A 26 -5.560 -0.607 -4.754 1.00 0.00 O ATOM 372 CB PHE A 26 -2.439 -0.975 -3.729 1.00 0.00 C ATOM 373 CG PHE A 26 -3.118 -0.878 -2.393 1.00 0.00 C ATOM 374 CD1 PHE A 26 -4.205 -0.036 -2.214 1.00 0.00 C ATOM 375 CD2 PHE A 26 -2.672 -1.627 -1.318 1.00 0.00 C ATOM 376 CE1 PHE A 26 -4.833 0.055 -0.986 1.00 0.00 C ATOM 377 CE2 PHE A 26 -3.296 -1.540 -0.088 1.00 0.00 C ATOM 378 CZ PHE A 26 -4.378 -0.697 0.079 1.00 0.00 C ATOM 0 H PHE A 26 -1.603 -1.490 -6.009 1.00 0.00 H new ATOM 0 HA PHE A 26 -3.833 -2.428 -4.479 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -1.562 -1.616 -3.636 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -2.082 0.013 -4.019 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -4.565 0.555 -3.043 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.826 -2.287 -1.442 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.679 0.714 -0.860 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -2.938 -2.131 0.742 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.866 -0.626 1.040 1.00 0.00 H new ATOM 388 N GLU A 27 -4.031 0.500 -5.981 1.00 0.00 N ATOM 389 CA GLU A 27 -4.959 1.547 -6.392 1.00 0.00 C ATOM 390 C GLU A 27 -6.200 0.947 -7.046 1.00 0.00 C ATOM 391 O GLU A 27 -7.292 1.513 -6.967 1.00 0.00 O ATOM 392 CB GLU A 27 -4.276 2.514 -7.359 1.00 0.00 C ATOM 393 CG GLU A 27 -3.472 3.602 -6.667 1.00 0.00 C ATOM 394 CD GLU A 27 -4.338 4.747 -6.178 1.00 0.00 C ATOM 395 OE1 GLU A 27 -4.651 5.642 -6.992 1.00 0.00 O ATOM 396 OE2 GLU A 27 -4.702 4.748 -4.985 1.00 0.00 O ATOM 0 H GLU A 27 -3.086 0.605 -6.351 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.267 2.094 -5.501 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -3.616 1.950 -8.018 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.034 2.979 -7.989 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.936 3.170 -5.822 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.721 3.988 -7.357 1.00 0.00 H new ATOM 403 N ARG A 28 -6.025 -0.200 -7.693 1.00 0.00 N ATOM 404 CA ARG A 28 -7.129 -0.876 -8.363 1.00 0.00 C ATOM 405 C ARG A 28 -7.856 -1.813 -7.403 1.00 0.00 C ATOM 406 O ARG A 28 -9.087 -1.847 -7.363 1.00 0.00 O ATOM 407 CB ARG A 28 -6.616 -1.664 -9.571 1.00 0.00 C ATOM 408 CG ARG A 28 -7.671 -1.892 -10.641 1.00 0.00 C ATOM 409 CD ARG A 28 -7.182 -2.862 -11.706 1.00 0.00 C ATOM 410 NE ARG A 28 -6.432 -2.186 -12.760 1.00 0.00 N ATOM 411 CZ ARG A 28 -6.974 -1.316 -13.605 1.00 0.00 C ATOM 412 NH1 ARG A 28 -8.263 -1.018 -13.519 1.00 0.00 N ATOM 413 NH2 ARG A 28 -6.226 -0.741 -14.539 1.00 0.00 N ATOM 0 H ARG A 28 -5.129 -0.681 -7.768 1.00 0.00 H new ATOM 0 HA ARG A 28 -7.832 -0.117 -8.705 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -5.773 -1.131 -10.011 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -6.240 -2.629 -9.232 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.579 -2.282 -10.181 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.932 -0.941 -11.105 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -6.552 -3.621 -11.243 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -8.035 -3.380 -12.144 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.438 -2.393 -12.853 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.841 -1.457 -12.803 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -8.676 -0.350 -14.169 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.234 -0.967 -14.608 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -6.644 -0.073 -15.187 1.00 0.00 H new ATOM 427 N THR A 29 -7.087 -2.574 -6.631 1.00 0.00 N ATOM 428 CA THR A 29 -7.657 -3.513 -5.673 1.00 0.00 C ATOM 429 C THR A 29 -6.776 -3.637 -4.435 1.00 0.00 C ATOM 430 O THR A 29 -5.585 -3.936 -4.535 1.00 0.00 O ATOM 431 CB THR A 29 -7.846 -4.908 -6.297 1.00 0.00 C ATOM 432 OG1 THR A 29 -8.366 -5.816 -5.320 1.00 0.00 O ATOM 433 CG2 THR A 29 -6.530 -5.440 -6.842 1.00 0.00 C ATOM 0 H THR A 29 -6.067 -2.558 -6.651 1.00 0.00 H new ATOM 0 HA THR A 29 -8.631 -3.118 -5.385 1.00 0.00 H new ATOM 0 HB THR A 29 -8.553 -4.820 -7.122 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.485 -6.700 -5.726 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.689 -6.426 -7.278 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.152 -4.762 -7.607 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.804 -5.514 -6.032 1.00 0.00 H new ATOM 441 N HIS A 30 -7.368 -3.408 -3.267 1.00 0.00 N ATOM 442 CA HIS A 30 -6.636 -3.497 -2.008 1.00 0.00 C ATOM 443 C HIS A 30 -6.391 -4.953 -1.624 1.00 0.00 C ATOM 444 O HIS A 30 -5.556 -5.247 -0.768 1.00 0.00 O ATOM 445 CB HIS A 30 -7.406 -2.786 -0.895 1.00 0.00 C ATOM 446 CG HIS A 30 -7.693 -1.346 -1.190 1.00 0.00 C ATOM 447 ND1 HIS A 30 -7.525 -0.624 -2.323 1.00 0.00 N flip ATOM 448 CD2 HIS A 30 -8.214 -0.476 -0.255 1.00 0.00 C flip ATOM 449 CE1 HIS A 30 -7.945 0.656 -2.055 1.00 0.00 C flip ATOM 450 NE2 HIS A 30 -8.357 0.719 -0.802 1.00 0.00 N flip ATOM 0 H HIS A 30 -8.352 -3.160 -3.166 1.00 0.00 H new ATOM 0 HA HIS A 30 -5.671 -3.008 -2.141 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -8.348 -3.308 -0.725 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -6.834 -2.852 0.030 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -8.466 -0.731 0.764 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -7.939 1.478 -2.756 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -8.723 1.549 -0.335 1.00 0.00 H new ATOM 459 N TYR A 31 -7.124 -5.859 -2.261 1.00 0.00 N ATOM 460 CA TYR A 31 -6.988 -7.285 -1.983 1.00 0.00 C ATOM 461 C TYR A 31 -6.916 -8.087 -3.279 1.00 0.00 C ATOM 462 O TYR A 31 -7.902 -8.665 -3.737 1.00 0.00 O ATOM 463 CB TYR A 31 -8.160 -7.774 -1.131 1.00 0.00 C ATOM 464 CG TYR A 31 -8.352 -6.984 0.144 1.00 0.00 C ATOM 465 CD1 TYR A 31 -7.498 -7.158 1.226 1.00 0.00 C ATOM 466 CD2 TYR A 31 -9.388 -6.066 0.267 1.00 0.00 C ATOM 467 CE1 TYR A 31 -7.670 -6.439 2.395 1.00 0.00 C ATOM 468 CE2 TYR A 31 -9.566 -5.342 1.430 1.00 0.00 C ATOM 469 CZ TYR A 31 -8.705 -5.532 2.490 1.00 0.00 C ATOM 470 OH TYR A 31 -8.882 -4.814 3.651 1.00 0.00 O ATOM 0 H TYR A 31 -7.818 -5.632 -2.973 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.060 -7.436 -1.431 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.074 -7.722 -1.722 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.002 -8.823 -0.879 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -6.686 -7.867 1.153 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -10.065 -5.916 -0.561 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -6.998 -6.587 3.228 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -10.375 -4.631 1.508 1.00 0.00 H new ATOM 0 HH TYR A 31 -9.654 -4.219 3.553 1.00 0.00 H new ATOM 480 N PRO A 32 -5.720 -8.126 -3.885 1.00 0.00 N ATOM 481 CA PRO A 32 -5.489 -8.855 -5.135 1.00 0.00 C ATOM 482 C PRO A 32 -5.550 -10.367 -4.944 1.00 0.00 C ATOM 483 O PRO A 32 -4.632 -10.969 -4.387 1.00 0.00 O ATOM 484 CB PRO A 32 -4.078 -8.424 -5.542 1.00 0.00 C ATOM 485 CG PRO A 32 -3.417 -8.037 -4.263 1.00 0.00 C ATOM 486 CD PRO A 32 -4.501 -7.460 -3.395 1.00 0.00 C ATOM 0 HA PRO A 32 -6.250 -8.632 -5.883 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -3.543 -9.236 -6.035 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.105 -7.589 -6.242 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -2.954 -8.901 -3.786 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -2.627 -7.307 -4.437 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -4.325 -7.669 -2.340 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.565 -6.377 -3.499 1.00 0.00 H new ATOM 494 N ASP A 33 -6.636 -10.974 -5.410 1.00 0.00 N ATOM 495 CA ASP A 33 -6.815 -12.416 -5.291 1.00 0.00 C ATOM 496 C ASP A 33 -5.603 -13.161 -5.840 1.00 0.00 C ATOM 497 O ASP A 33 -4.650 -12.549 -6.321 1.00 0.00 O ATOM 498 CB ASP A 33 -8.079 -12.857 -6.032 1.00 0.00 C ATOM 499 CG ASP A 33 -9.306 -12.079 -5.598 1.00 0.00 C ATOM 500 OD1 ASP A 33 -9.623 -12.098 -4.390 1.00 0.00 O ATOM 501 OD2 ASP A 33 -9.948 -11.451 -6.464 1.00 0.00 O ATOM 0 H ASP A 33 -7.405 -10.490 -5.873 1.00 0.00 H new ATOM 0 HA ASP A 33 -6.919 -12.658 -4.233 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.931 -12.729 -7.104 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -8.246 -13.920 -5.858 1.00 0.00 H new ATOM 506 N VAL A 34 -5.646 -14.488 -5.764 1.00 0.00 N ATOM 507 CA VAL A 34 -4.552 -15.318 -6.253 1.00 0.00 C ATOM 508 C VAL A 34 -4.242 -15.013 -7.714 1.00 0.00 C ATOM 509 O VAL A 34 -3.079 -14.985 -8.121 1.00 0.00 O ATOM 510 CB VAL A 34 -4.876 -16.817 -6.110 1.00 0.00 C ATOM 511 CG1 VAL A 34 -6.187 -17.149 -6.807 1.00 0.00 C ATOM 512 CG2 VAL A 34 -3.739 -17.663 -6.664 1.00 0.00 C ATOM 0 H VAL A 34 -6.427 -15.011 -5.368 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.680 -15.083 -5.643 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.987 -17.047 -5.050 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.399 -18.212 -6.695 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -6.994 -16.569 -6.360 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.108 -16.904 -7.866 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.985 -18.719 -6.555 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.594 -17.431 -7.719 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.823 -17.445 -6.115 1.00 0.00 H new ATOM 522 N PHE A 35 -5.288 -14.785 -8.500 1.00 0.00 N ATOM 523 CA PHE A 35 -5.128 -14.482 -9.918 1.00 0.00 C ATOM 524 C PHE A 35 -4.372 -13.171 -10.112 1.00 0.00 C ATOM 525 O PHE A 35 -3.789 -12.929 -11.168 1.00 0.00 O ATOM 526 CB PHE A 35 -6.495 -14.402 -10.602 1.00 0.00 C ATOM 527 CG PHE A 35 -7.039 -15.741 -11.013 1.00 0.00 C ATOM 528 CD1 PHE A 35 -6.298 -16.584 -11.824 1.00 0.00 C ATOM 529 CD2 PHE A 35 -8.291 -16.154 -10.587 1.00 0.00 C ATOM 530 CE1 PHE A 35 -6.796 -17.816 -12.204 1.00 0.00 C ATOM 531 CE2 PHE A 35 -8.794 -17.386 -10.964 1.00 0.00 C ATOM 532 CZ PHE A 35 -8.045 -18.217 -11.774 1.00 0.00 C ATOM 0 H PHE A 35 -6.256 -14.804 -8.180 1.00 0.00 H new ATOM 0 HA PHE A 35 -4.549 -15.286 -10.373 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.203 -13.923 -9.926 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.415 -13.765 -11.483 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -5.320 -16.275 -12.163 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.880 -15.507 -9.954 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -6.208 -18.465 -12.837 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -9.771 -17.698 -10.625 1.00 0.00 H new ATOM 0 HZ PHE A 35 -8.436 -19.179 -12.071 1.00 0.00 H new ATOM 542 N ALA A 36 -4.388 -12.328 -9.085 1.00 0.00 N ATOM 543 CA ALA A 36 -3.703 -11.042 -9.141 1.00 0.00 C ATOM 544 C ALA A 36 -2.291 -11.147 -8.578 1.00 0.00 C ATOM 545 O ALA A 36 -1.328 -10.705 -9.204 1.00 0.00 O ATOM 546 CB ALA A 36 -4.499 -9.988 -8.385 1.00 0.00 C ATOM 0 H ALA A 36 -4.868 -12.512 -8.204 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.627 -10.743 -10.187 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.977 -9.033 -8.435 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.486 -9.885 -8.835 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.605 -10.290 -7.343 1.00 0.00 H new ATOM 552 N ARG A 37 -2.175 -11.735 -7.391 1.00 0.00 N ATOM 553 CA ARG A 37 -0.878 -11.896 -6.743 1.00 0.00 C ATOM 554 C ARG A 37 0.067 -12.717 -7.615 1.00 0.00 C ATOM 555 O ARG A 37 1.269 -12.456 -7.658 1.00 0.00 O ATOM 556 CB ARG A 37 -1.047 -12.570 -5.380 1.00 0.00 C ATOM 557 CG ARG A 37 -1.434 -11.608 -4.269 1.00 0.00 C ATOM 558 CD ARG A 37 -0.924 -12.084 -2.917 1.00 0.00 C ATOM 559 NE ARG A 37 -1.519 -13.358 -2.524 1.00 0.00 N ATOM 560 CZ ARG A 37 -2.798 -13.502 -2.195 1.00 0.00 C ATOM 561 NH1 ARG A 37 -3.612 -12.456 -2.212 1.00 0.00 N ATOM 562 NH2 ARG A 37 -3.264 -14.695 -1.849 1.00 0.00 N ATOM 0 H ARG A 37 -2.962 -12.107 -6.859 1.00 0.00 H new ATOM 0 HA ARG A 37 -0.445 -10.906 -6.601 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.809 -13.345 -5.460 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.114 -13.066 -5.111 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -1.029 -10.619 -4.485 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -2.519 -11.507 -4.235 1.00 0.00 H new ATOM 0 HD2 ARG A 37 0.160 -12.187 -2.955 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.147 -11.332 -2.160 1.00 0.00 H new ATOM 0 HE ARG A 37 -0.920 -14.183 -2.501 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -3.257 -11.538 -2.478 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.594 -12.569 -1.959 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -2.640 -15.502 -1.836 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -4.246 -14.805 -1.596 1.00 0.00 H new ATOM 576 N GLU A 38 -0.484 -13.709 -8.307 1.00 0.00 N ATOM 577 CA GLU A 38 0.312 -14.567 -9.175 1.00 0.00 C ATOM 578 C GLU A 38 0.852 -13.784 -10.368 1.00 0.00 C ATOM 579 O GLU A 38 2.057 -13.775 -10.623 1.00 0.00 O ATOM 580 CB GLU A 38 -0.526 -15.751 -9.667 1.00 0.00 C ATOM 581 CG GLU A 38 -0.644 -16.875 -8.652 1.00 0.00 C ATOM 582 CD GLU A 38 -1.069 -18.187 -9.282 1.00 0.00 C ATOM 583 OE1 GLU A 38 -2.161 -18.228 -9.888 1.00 0.00 O ATOM 584 OE2 GLU A 38 -0.310 -19.172 -9.170 1.00 0.00 O ATOM 0 H GLU A 38 -1.478 -13.938 -8.283 1.00 0.00 H new ATOM 0 HA GLU A 38 1.156 -14.942 -8.596 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.525 -15.397 -9.923 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.083 -16.144 -10.582 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.315 -17.010 -8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.366 -16.593 -7.886 1.00 0.00 H new ATOM 591 N ARG A 39 -0.047 -13.128 -11.094 1.00 0.00 N ATOM 592 CA ARG A 39 0.340 -12.343 -12.260 1.00 0.00 C ATOM 593 C ARG A 39 1.377 -11.289 -11.886 1.00 0.00 C ATOM 594 O ARG A 39 2.355 -11.081 -12.608 1.00 0.00 O ATOM 595 CB ARG A 39 -0.887 -11.669 -12.876 1.00 0.00 C ATOM 596 CG ARG A 39 -1.593 -12.523 -13.917 1.00 0.00 C ATOM 597 CD ARG A 39 -1.003 -12.314 -15.303 1.00 0.00 C ATOM 598 NE ARG A 39 -1.481 -11.079 -15.921 1.00 0.00 N ATOM 599 CZ ARG A 39 -1.176 -10.713 -17.161 1.00 0.00 C ATOM 600 NH1 ARG A 39 -0.399 -11.482 -17.911 1.00 0.00 N ATOM 601 NH2 ARG A 39 -1.650 -9.575 -17.653 1.00 0.00 N ATOM 0 H ARG A 39 -1.048 -13.124 -10.896 1.00 0.00 H new ATOM 0 HA ARG A 39 0.782 -13.019 -12.992 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -1.592 -11.422 -12.082 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -0.582 -10.729 -13.336 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -1.513 -13.575 -13.641 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.655 -12.277 -13.932 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.084 -12.287 -15.234 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.261 -13.161 -15.939 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.081 -10.465 -15.371 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.034 -12.357 -17.536 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -0.167 -11.198 -18.863 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.249 -8.981 -17.079 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -1.416 -9.294 -18.605 1.00 0.00 H new ATOM 615 N LEU A 40 1.160 -10.625 -10.757 1.00 0.00 N ATOM 616 CA LEU A 40 2.077 -9.592 -10.287 1.00 0.00 C ATOM 617 C LEU A 40 3.401 -10.202 -9.839 1.00 0.00 C ATOM 618 O LEU A 40 4.465 -9.621 -10.048 1.00 0.00 O ATOM 619 CB LEU A 40 1.447 -8.810 -9.133 1.00 0.00 C ATOM 620 CG LEU A 40 1.922 -7.367 -8.963 1.00 0.00 C ATOM 621 CD1 LEU A 40 1.064 -6.421 -9.786 1.00 0.00 C ATOM 622 CD2 LEU A 40 1.900 -6.968 -7.494 1.00 0.00 C ATOM 0 H LEU A 40 0.356 -10.783 -10.149 1.00 0.00 H new ATOM 0 HA LEU A 40 2.273 -8.911 -11.115 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.366 -8.802 -9.273 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.644 -9.348 -8.206 1.00 0.00 H new ATOM 0 HG LEU A 40 2.949 -7.299 -9.323 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.418 -5.399 -9.652 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.131 -6.693 -10.840 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.027 -6.492 -9.458 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.241 -5.938 -7.392 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.884 -7.054 -7.109 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.559 -7.626 -6.928 1.00 0.00 H new ATOM 634 N ALA A 41 3.327 -11.378 -9.224 1.00 0.00 N ATOM 635 CA ALA A 41 4.521 -12.069 -8.751 1.00 0.00 C ATOM 636 C ALA A 41 5.608 -12.082 -9.821 1.00 0.00 C ATOM 637 O ALA A 41 6.794 -11.965 -9.514 1.00 0.00 O ATOM 638 CB ALA A 41 4.175 -13.489 -8.329 1.00 0.00 C ATOM 0 H ALA A 41 2.453 -11.872 -9.042 1.00 0.00 H new ATOM 0 HA ALA A 41 4.906 -11.528 -7.887 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.075 -13.994 -7.978 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.438 -13.461 -7.526 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.763 -14.031 -9.180 1.00 0.00 H new ATOM 644 N ALA A 42 5.195 -12.226 -11.075 1.00 0.00 N ATOM 645 CA ALA A 42 6.134 -12.253 -12.190 1.00 0.00 C ATOM 646 C ALA A 42 6.340 -10.857 -12.768 1.00 0.00 C ATOM 647 O ALA A 42 7.301 -10.612 -13.497 1.00 0.00 O ATOM 648 CB ALA A 42 5.645 -13.206 -13.269 1.00 0.00 C ATOM 0 H ALA A 42 4.216 -12.326 -11.345 1.00 0.00 H new ATOM 0 HA ALA A 42 7.094 -12.608 -11.816 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.356 -13.216 -14.095 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.556 -14.210 -12.855 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.672 -12.876 -13.632 1.00 0.00 H new ATOM 654 N LYS A 43 5.431 -9.945 -12.439 1.00 0.00 N ATOM 655 CA LYS A 43 5.512 -8.573 -12.926 1.00 0.00 C ATOM 656 C LYS A 43 6.617 -7.806 -12.206 1.00 0.00 C ATOM 657 O LYS A 43 7.200 -6.874 -12.760 1.00 0.00 O ATOM 658 CB LYS A 43 4.172 -7.861 -12.732 1.00 0.00 C ATOM 659 CG LYS A 43 4.163 -6.432 -13.245 1.00 0.00 C ATOM 660 CD LYS A 43 2.769 -6.004 -13.677 1.00 0.00 C ATOM 661 CE LYS A 43 2.637 -4.488 -13.707 1.00 0.00 C ATOM 662 NZ LYS A 43 3.143 -3.913 -14.983 1.00 0.00 N ATOM 0 H LYS A 43 4.629 -10.132 -11.837 1.00 0.00 H new ATOM 0 HA LYS A 43 5.748 -8.604 -13.990 1.00 0.00 H new ATOM 0 HB2 LYS A 43 3.392 -8.426 -13.243 1.00 0.00 H new ATOM 0 HB3 LYS A 43 3.921 -7.859 -11.671 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.525 -5.762 -12.465 1.00 0.00 H new ATOM 0 HG3 LYS A 43 4.850 -6.342 -14.087 1.00 0.00 H new ATOM 0 HD2 LYS A 43 2.553 -6.409 -14.666 1.00 0.00 H new ATOM 0 HD3 LYS A 43 2.030 -6.421 -12.993 1.00 0.00 H new ATOM 0 HE2 LYS A 43 1.591 -4.212 -13.574 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.189 -4.059 -12.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.036 -2.879 -14.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.148 -4.155 -15.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.599 -4.303 -15.779 1.00 0.00 H new ATOM 676 N ILE A 44 6.899 -8.204 -10.970 1.00 0.00 N ATOM 677 CA ILE A 44 7.934 -7.555 -10.177 1.00 0.00 C ATOM 678 C ILE A 44 8.965 -8.566 -9.685 1.00 0.00 C ATOM 679 O ILE A 44 9.914 -8.211 -8.986 1.00 0.00 O ATOM 680 CB ILE A 44 7.336 -6.816 -8.965 1.00 0.00 C ATOM 681 CG1 ILE A 44 6.295 -7.695 -8.268 1.00 0.00 C ATOM 682 CG2 ILE A 44 6.718 -5.497 -9.401 1.00 0.00 C ATOM 683 CD1 ILE A 44 5.534 -6.979 -7.175 1.00 0.00 C ATOM 0 H ILE A 44 6.425 -8.973 -10.497 1.00 0.00 H new ATOM 0 HA ILE A 44 8.422 -6.830 -10.829 1.00 0.00 H new ATOM 0 HB ILE A 44 8.136 -6.602 -8.257 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.587 -8.064 -9.010 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.793 -8.566 -7.842 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.300 -4.987 -8.533 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.484 -4.869 -9.857 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.927 -5.688 -10.126 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.814 -7.663 -6.725 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.232 -6.634 -6.412 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.007 -6.124 -7.599 1.00 0.00 H new ATOM 695 N ASP A 45 8.772 -9.827 -10.055 1.00 0.00 N ATOM 696 CA ASP A 45 9.686 -10.891 -9.653 1.00 0.00 C ATOM 697 C ASP A 45 9.670 -11.077 -8.139 1.00 0.00 C ATOM 698 O ASP A 45 10.720 -11.107 -7.496 1.00 0.00 O ATOM 699 CB ASP A 45 11.106 -10.577 -10.126 1.00 0.00 C ATOM 700 CG ASP A 45 11.926 -11.830 -10.362 1.00 0.00 C ATOM 701 OD1 ASP A 45 11.446 -12.728 -11.086 1.00 0.00 O ATOM 702 OD2 ASP A 45 13.049 -11.912 -9.825 1.00 0.00 O ATOM 0 H ASP A 45 7.991 -10.138 -10.633 1.00 0.00 H new ATOM 0 HA ASP A 45 9.353 -11.819 -10.118 1.00 0.00 H new ATOM 0 HB2 ASP A 45 11.059 -9.997 -11.048 1.00 0.00 H new ATOM 0 HB3 ASP A 45 11.604 -9.954 -9.383 1.00 0.00 H new ATOM 707 N LEU A 46 8.472 -11.201 -7.576 1.00 0.00 N ATOM 708 CA LEU A 46 8.320 -11.384 -6.137 1.00 0.00 C ATOM 709 C LEU A 46 7.436 -12.589 -5.832 1.00 0.00 C ATOM 710 O LEU A 46 6.529 -12.933 -6.591 1.00 0.00 O ATOM 711 CB LEU A 46 7.723 -10.125 -5.504 1.00 0.00 C ATOM 712 CG LEU A 46 8.716 -9.021 -5.139 1.00 0.00 C ATOM 713 CD1 LEU A 46 7.983 -7.727 -4.822 1.00 0.00 C ATOM 714 CD2 LEU A 46 9.581 -9.449 -3.962 1.00 0.00 C ATOM 0 H LEU A 46 7.593 -11.178 -8.094 1.00 0.00 H new ATOM 0 HA LEU A 46 9.307 -11.564 -5.711 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.987 -9.711 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 46 7.186 -10.416 -4.601 1.00 0.00 H new ATOM 0 HG LEU A 46 9.366 -8.845 -5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.706 -6.953 -4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.408 -7.412 -5.693 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.308 -7.888 -3.981 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.282 -8.651 -3.716 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.947 -9.653 -3.100 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.135 -10.350 -4.226 1.00 0.00 H new ATOM 726 N PRO A 47 7.703 -13.245 -4.693 1.00 0.00 N ATOM 727 CA PRO A 47 6.941 -14.421 -4.261 1.00 0.00 C ATOM 728 C PRO A 47 5.520 -14.066 -3.838 1.00 0.00 C ATOM 729 O PRO A 47 5.295 -13.062 -3.164 1.00 0.00 O ATOM 730 CB PRO A 47 7.741 -14.940 -3.064 1.00 0.00 C ATOM 731 CG PRO A 47 8.462 -13.746 -2.542 1.00 0.00 C ATOM 732 CD PRO A 47 8.769 -12.892 -3.740 1.00 0.00 C ATOM 0 HA PRO A 47 6.825 -15.150 -5.063 1.00 0.00 H new ATOM 0 HB2 PRO A 47 7.085 -15.369 -2.306 1.00 0.00 H new ATOM 0 HB3 PRO A 47 8.438 -15.723 -3.363 1.00 0.00 H new ATOM 0 HG2 PRO A 47 7.849 -13.203 -1.823 1.00 0.00 H new ATOM 0 HG3 PRO A 47 9.377 -14.037 -2.026 1.00 0.00 H new ATOM 0 HD2 PRO A 47 8.751 -11.831 -3.492 1.00 0.00 H new ATOM 0 HD3 PRO A 47 9.758 -13.108 -4.145 1.00 0.00 H new ATOM 740 N GLU A 48 4.563 -14.899 -4.237 1.00 0.00 N ATOM 741 CA GLU A 48 3.163 -14.671 -3.900 1.00 0.00 C ATOM 742 C GLU A 48 2.999 -14.418 -2.404 1.00 0.00 C ATOM 743 O GLU A 48 1.983 -13.880 -1.963 1.00 0.00 O ATOM 744 CB GLU A 48 2.312 -15.872 -4.322 1.00 0.00 C ATOM 745 CG GLU A 48 0.885 -15.506 -4.691 1.00 0.00 C ATOM 746 CD GLU A 48 -0.059 -16.690 -4.617 1.00 0.00 C ATOM 747 OE1 GLU A 48 -0.097 -17.479 -5.585 1.00 0.00 O ATOM 748 OE2 GLU A 48 -0.759 -16.829 -3.592 1.00 0.00 O ATOM 0 H GLU A 48 4.732 -15.737 -4.793 1.00 0.00 H new ATOM 0 HA GLU A 48 2.824 -13.787 -4.440 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.785 -16.360 -5.174 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.294 -16.597 -3.509 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.531 -14.721 -4.022 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.869 -15.096 -5.701 1.00 0.00 H new ATOM 755 N ALA A 49 4.004 -14.811 -1.629 1.00 0.00 N ATOM 756 CA ALA A 49 3.973 -14.626 -0.184 1.00 0.00 C ATOM 757 C ALA A 49 4.340 -13.195 0.194 1.00 0.00 C ATOM 758 O ALA A 49 3.781 -12.628 1.133 1.00 0.00 O ATOM 759 CB ALA A 49 4.912 -15.611 0.495 1.00 0.00 C ATOM 0 H ALA A 49 4.851 -15.260 -1.978 1.00 0.00 H new ATOM 0 HA ALA A 49 2.956 -14.815 0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.878 -15.461 1.574 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.603 -16.629 0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.929 -15.449 0.138 1.00 0.00 H new ATOM 765 N ARG A 50 5.284 -12.618 -0.541 1.00 0.00 N ATOM 766 CA ARG A 50 5.728 -11.253 -0.282 1.00 0.00 C ATOM 767 C ARG A 50 4.604 -10.256 -0.547 1.00 0.00 C ATOM 768 O ARG A 50 4.297 -9.414 0.296 1.00 0.00 O ATOM 769 CB ARG A 50 6.941 -10.915 -1.150 1.00 0.00 C ATOM 770 CG ARG A 50 8.272 -11.245 -0.495 1.00 0.00 C ATOM 771 CD ARG A 50 8.784 -10.083 0.342 1.00 0.00 C ATOM 772 NE ARG A 50 9.927 -10.466 1.168 1.00 0.00 N ATOM 773 CZ ARG A 50 9.832 -11.249 2.235 1.00 0.00 C ATOM 774 NH1 ARG A 50 8.653 -11.732 2.605 1.00 0.00 N ATOM 775 NH2 ARG A 50 10.917 -11.553 2.936 1.00 0.00 N ATOM 0 H ARG A 50 5.757 -13.074 -1.321 1.00 0.00 H new ATOM 0 HA ARG A 50 6.011 -11.183 0.768 1.00 0.00 H new ATOM 0 HB2 ARG A 50 6.865 -11.458 -2.092 1.00 0.00 H new ATOM 0 HB3 ARG A 50 6.919 -9.852 -1.392 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.160 -12.127 0.135 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.005 -11.493 -1.263 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.070 -9.261 -0.315 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.981 -9.715 0.981 1.00 0.00 H new ATOM 0 HE ARG A 50 10.848 -10.112 0.910 1.00 0.00 H new ATOM 0 HH11 ARG A 50 7.816 -11.502 2.069 1.00 0.00 H new ATOM 0 HH12 ARG A 50 8.583 -12.334 3.426 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.826 -11.185 2.655 1.00 0.00 H new ATOM 0 HH22 ARG A 50 10.842 -12.155 3.756 1.00 0.00 H new ATOM 789 N ILE A 51 3.995 -10.358 -1.724 1.00 0.00 N ATOM 790 CA ILE A 51 2.905 -9.466 -2.100 1.00 0.00 C ATOM 791 C ILE A 51 1.896 -9.324 -0.967 1.00 0.00 C ATOM 792 O ILE A 51 1.534 -8.214 -0.581 1.00 0.00 O ATOM 793 CB ILE A 51 2.179 -9.965 -3.362 1.00 0.00 C ATOM 794 CG1 ILE A 51 3.120 -9.932 -4.567 1.00 0.00 C ATOM 795 CG2 ILE A 51 0.939 -9.125 -3.627 1.00 0.00 C ATOM 796 CD1 ILE A 51 2.684 -10.834 -5.700 1.00 0.00 C ATOM 0 H ILE A 51 4.238 -11.049 -2.433 1.00 0.00 H new ATOM 0 HA ILE A 51 3.351 -8.494 -2.309 1.00 0.00 H new ATOM 0 HB ILE A 51 1.867 -10.996 -3.199 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.190 -8.908 -4.935 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.120 -10.224 -4.245 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.437 -9.490 -4.523 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.262 -9.197 -2.776 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.229 -8.084 -3.772 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.398 -10.759 -6.520 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.641 -11.865 -5.349 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.698 -10.529 -6.049 1.00 0.00 H new ATOM 808 N GLN A 52 1.446 -10.458 -0.437 1.00 0.00 N ATOM 809 CA GLN A 52 0.479 -10.459 0.654 1.00 0.00 C ATOM 810 C GLN A 52 0.918 -9.523 1.774 1.00 0.00 C ATOM 811 O GLN A 52 0.126 -8.730 2.282 1.00 0.00 O ATOM 812 CB GLN A 52 0.296 -11.876 1.199 1.00 0.00 C ATOM 813 CG GLN A 52 0.435 -12.959 0.141 1.00 0.00 C ATOM 814 CD GLN A 52 -0.406 -14.184 0.444 1.00 0.00 C ATOM 815 OE1 GLN A 52 -1.635 -14.137 0.380 1.00 0.00 O ATOM 816 NE2 GLN A 52 0.253 -15.287 0.775 1.00 0.00 N ATOM 0 H GLN A 52 1.736 -11.386 -0.745 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.473 -10.102 0.261 1.00 0.00 H new ATOM 0 HB2 GLN A 52 1.031 -12.051 1.985 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -0.689 -11.954 1.660 1.00 0.00 H new ATOM 0 HG2 GLN A 52 0.144 -12.554 -0.828 1.00 0.00 H new ATOM 0 HG3 GLN A 52 1.482 -13.252 0.062 1.00 0.00 H new ATOM 0 HE21 GLN A 52 1.272 -15.279 0.815 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -0.260 -16.142 0.989 1.00 0.00 H new ATOM 825 N VAL A 53 2.188 -9.620 2.155 1.00 0.00 N ATOM 826 CA VAL A 53 2.734 -8.781 3.215 1.00 0.00 C ATOM 827 C VAL A 53 2.728 -7.312 2.811 1.00 0.00 C ATOM 828 O VAL A 53 2.081 -6.484 3.453 1.00 0.00 O ATOM 829 CB VAL A 53 4.174 -9.198 3.575 1.00 0.00 C ATOM 830 CG1 VAL A 53 4.653 -8.450 4.810 1.00 0.00 C ATOM 831 CG2 VAL A 53 4.255 -10.701 3.786 1.00 0.00 C ATOM 0 H VAL A 53 2.858 -10.271 1.745 1.00 0.00 H new ATOM 0 HA VAL A 53 2.095 -8.917 4.088 1.00 0.00 H new ATOM 0 HB VAL A 53 4.829 -8.935 2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 53 5.671 -8.757 5.049 1.00 0.00 H new ATOM 0 HG12 VAL A 53 4.633 -7.378 4.616 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.998 -8.679 5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.278 -10.978 4.039 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.589 -10.991 4.599 1.00 0.00 H new ATOM 0 HG23 VAL A 53 3.956 -11.213 2.872 1.00 0.00 H new ATOM 841 N TRP A 54 3.453 -6.994 1.744 1.00 0.00 N ATOM 842 CA TRP A 54 3.530 -5.622 1.254 1.00 0.00 C ATOM 843 C TRP A 54 2.158 -4.956 1.281 1.00 0.00 C ATOM 844 O TRP A 54 2.021 -3.814 1.721 1.00 0.00 O ATOM 845 CB TRP A 54 4.094 -5.599 -0.168 1.00 0.00 C ATOM 846 CG TRP A 54 4.394 -4.216 -0.665 1.00 0.00 C ATOM 847 CD1 TRP A 54 5.610 -3.595 -0.675 1.00 0.00 C ATOM 848 CD2 TRP A 54 3.459 -3.285 -1.222 1.00 0.00 C ATOM 849 NE1 TRP A 54 5.488 -2.333 -1.205 1.00 0.00 N ATOM 850 CE2 TRP A 54 4.179 -2.119 -1.549 1.00 0.00 C ATOM 851 CE3 TRP A 54 2.087 -3.323 -1.477 1.00 0.00 C ATOM 852 CZ2 TRP A 54 3.570 -1.003 -2.117 1.00 0.00 C ATOM 853 CZ3 TRP A 54 1.483 -2.214 -2.040 1.00 0.00 C ATOM 854 CH2 TRP A 54 2.224 -1.068 -2.355 1.00 0.00 C ATOM 0 H TRP A 54 3.995 -7.667 1.202 1.00 0.00 H new ATOM 0 HA TRP A 54 4.196 -5.064 1.912 1.00 0.00 H new ATOM 0 HB2 TRP A 54 5.006 -6.195 -0.199 1.00 0.00 H new ATOM 0 HB3 TRP A 54 3.381 -6.073 -0.842 1.00 0.00 H new ATOM 0 HD1 TRP A 54 6.532 -4.031 -0.319 1.00 0.00 H new ATOM 0 HE1 TRP A 54 6.249 -1.664 -1.323 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.508 -4.203 -1.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 4.139 -0.118 -2.361 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 0.422 -2.232 -2.240 1.00 0.00 H new ATOM 0 HH2 TRP A 54 1.723 -0.218 -2.795 1.00 0.00 H new ATOM 865 N PHE A 55 1.146 -5.676 0.809 1.00 0.00 N ATOM 866 CA PHE A 55 -0.214 -5.153 0.779 1.00 0.00 C ATOM 867 C PHE A 55 -0.770 -5.001 2.192 1.00 0.00 C ATOM 868 O PHE A 55 -1.436 -4.014 2.505 1.00 0.00 O ATOM 869 CB PHE A 55 -1.119 -6.076 -0.039 1.00 0.00 C ATOM 870 CG PHE A 55 -1.158 -5.736 -1.502 1.00 0.00 C ATOM 871 CD1 PHE A 55 -0.070 -6.002 -2.317 1.00 0.00 C ATOM 872 CD2 PHE A 55 -2.282 -5.150 -2.062 1.00 0.00 C ATOM 873 CE1 PHE A 55 -0.102 -5.688 -3.663 1.00 0.00 C ATOM 874 CE2 PHE A 55 -2.320 -4.835 -3.407 1.00 0.00 C ATOM 875 CZ PHE A 55 -1.229 -5.106 -4.209 1.00 0.00 C ATOM 0 H PHE A 55 1.242 -6.623 0.442 1.00 0.00 H new ATOM 0 HA PHE A 55 -0.188 -4.170 0.310 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -0.776 -7.104 0.078 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -2.131 -6.030 0.364 1.00 0.00 H new ATOM 0 HD1 PHE A 55 0.813 -6.460 -1.896 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -3.139 -4.937 -1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 55 0.754 -5.898 -4.287 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -3.202 -4.377 -3.830 1.00 0.00 H new ATOM 0 HZ PHE A 55 -1.257 -4.863 -5.261 1.00 0.00 H new ATOM 885 N SER A 56 -0.490 -5.984 3.041 1.00 0.00 N ATOM 886 CA SER A 56 -0.964 -5.962 4.420 1.00 0.00 C ATOM 887 C SER A 56 -0.558 -4.665 5.113 1.00 0.00 C ATOM 888 O SER A 56 -1.362 -4.041 5.804 1.00 0.00 O ATOM 889 CB SER A 56 -0.410 -7.161 5.192 1.00 0.00 C ATOM 890 OG SER A 56 -0.788 -7.109 6.556 1.00 0.00 O ATOM 0 H SER A 56 0.063 -6.806 2.798 1.00 0.00 H new ATOM 0 HA SER A 56 -2.052 -6.021 4.405 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.776 -8.085 4.745 1.00 0.00 H new ATOM 0 HB3 SER A 56 0.677 -7.177 5.113 1.00 0.00 H new ATOM 0 HG SER A 56 -0.423 -7.887 7.027 1.00 0.00 H new ATOM 896 N ASN A 57 0.694 -4.266 4.921 1.00 0.00 N ATOM 897 CA ASN A 57 1.209 -3.043 5.529 1.00 0.00 C ATOM 898 C ASN A 57 0.485 -1.817 4.979 1.00 0.00 C ATOM 899 O ASN A 57 0.208 -0.866 5.710 1.00 0.00 O ATOM 900 CB ASN A 57 2.713 -2.918 5.278 1.00 0.00 C ATOM 901 CG ASN A 57 3.526 -3.842 6.164 1.00 0.00 C ATOM 902 OD1 ASN A 57 3.674 -3.598 7.362 1.00 0.00 O ATOM 903 ND2 ASN A 57 4.057 -4.907 5.577 1.00 0.00 N ATOM 0 H ASN A 57 1.372 -4.771 4.350 1.00 0.00 H new ATOM 0 HA ASN A 57 1.031 -3.097 6.603 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.924 -3.143 4.233 1.00 0.00 H new ATOM 0 HB3 ASN A 57 3.023 -1.887 5.451 1.00 0.00 H new ATOM 0 HD21 ASN A 57 4.615 -5.565 6.122 1.00 0.00 H new ATOM 0 HD22 ASN A 57 3.907 -5.068 4.581 1.00 0.00 H new ATOM 910 N ARG A 58 0.183 -1.847 3.684 1.00 0.00 N ATOM 911 CA ARG A 58 -0.507 -0.739 3.035 1.00 0.00 C ATOM 912 C ARG A 58 -1.865 -0.488 3.686 1.00 0.00 C ATOM 913 O ARG A 58 -2.153 0.621 4.135 1.00 0.00 O ATOM 914 CB ARG A 58 -0.689 -1.026 1.545 1.00 0.00 C ATOM 915 CG ARG A 58 0.490 -0.585 0.691 1.00 0.00 C ATOM 916 CD ARG A 58 0.485 0.918 0.467 1.00 0.00 C ATOM 917 NE ARG A 58 -0.504 1.319 -0.531 1.00 0.00 N ATOM 918 CZ ARG A 58 -0.696 2.577 -0.910 1.00 0.00 C ATOM 919 NH1 ARG A 58 0.029 3.552 -0.379 1.00 0.00 N ATOM 920 NH2 ARG A 58 -1.616 2.863 -1.824 1.00 0.00 N ATOM 0 H ARG A 58 0.405 -2.626 3.065 1.00 0.00 H new ATOM 0 HA ARG A 58 0.104 0.156 3.153 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -0.847 -2.095 1.406 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -1.590 -0.522 1.194 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.421 -0.878 1.175 1.00 0.00 H new ATOM 0 HG3 ARG A 58 0.456 -1.097 -0.271 1.00 0.00 H new ATOM 0 HD2 ARG A 58 0.275 1.424 1.409 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.476 1.240 0.146 1.00 0.00 H new ATOM 0 HE ARG A 58 -1.078 0.593 -0.960 1.00 0.00 H new ATOM 0 HH11 ARG A 58 0.737 3.337 0.323 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -0.121 4.517 -0.673 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -2.176 2.116 -2.235 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -1.763 3.830 -2.115 1.00 0.00 H new ATOM 934 N ARG A 59 -2.694 -1.526 3.730 1.00 0.00 N ATOM 935 CA ARG A 59 -4.021 -1.418 4.322 1.00 0.00 C ATOM 936 C ARG A 59 -3.988 -0.546 5.574 1.00 0.00 C ATOM 937 O ARG A 59 -4.848 0.313 5.768 1.00 0.00 O ATOM 938 CB ARG A 59 -4.563 -2.805 4.668 1.00 0.00 C ATOM 939 CG ARG A 59 -4.653 -3.740 3.473 1.00 0.00 C ATOM 940 CD ARG A 59 -4.790 -5.190 3.907 1.00 0.00 C ATOM 941 NE ARG A 59 -4.778 -6.106 2.770 1.00 0.00 N ATOM 942 CZ ARG A 59 -4.426 -7.383 2.859 1.00 0.00 C ATOM 943 NH1 ARG A 59 -4.058 -7.894 4.026 1.00 0.00 N ATOM 944 NH2 ARG A 59 -4.440 -8.154 1.779 1.00 0.00 N ATOM 0 H ARG A 59 -2.470 -2.451 3.363 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.680 -0.950 3.591 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.922 -3.257 5.425 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.553 -2.699 5.111 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.507 -3.462 2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -3.763 -3.627 2.854 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.975 -5.444 4.585 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.719 -5.315 4.464 1.00 0.00 H new ATOM 0 HE ARG A 59 -5.055 -5.745 1.857 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.045 -7.306 4.859 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.788 -8.876 4.091 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -4.721 -7.766 0.879 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -4.169 -9.135 1.849 1.00 0.00 H new ATOM 958 N ALA A 60 -2.991 -0.775 6.422 1.00 0.00 N ATOM 959 CA ALA A 60 -2.845 -0.011 7.655 1.00 0.00 C ATOM 960 C ALA A 60 -2.542 1.454 7.360 1.00 0.00 C ATOM 961 O ALA A 60 -3.008 2.350 8.065 1.00 0.00 O ATOM 962 CB ALA A 60 -1.751 -0.614 8.524 1.00 0.00 C ATOM 0 H ALA A 60 -2.272 -1.484 6.278 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.790 -0.058 8.196 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.653 -0.033 9.441 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.009 -1.643 8.772 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.805 -0.598 7.982 1.00 0.00 H new ATOM 968 N LYS A 61 -1.757 1.691 6.314 1.00 0.00 N ATOM 969 CA LYS A 61 -1.391 3.049 5.925 1.00 0.00 C ATOM 970 C LYS A 61 -2.549 3.742 5.213 1.00 0.00 C ATOM 971 O LYS A 61 -2.671 4.965 5.253 1.00 0.00 O ATOM 972 CB LYS A 61 -0.161 3.025 5.014 1.00 0.00 C ATOM 973 CG LYS A 61 0.060 4.322 4.256 1.00 0.00 C ATOM 974 CD LYS A 61 1.449 4.381 3.644 1.00 0.00 C ATOM 975 CE LYS A 61 1.808 5.794 3.211 1.00 0.00 C ATOM 976 NZ LYS A 61 2.390 6.587 4.330 1.00 0.00 N ATOM 0 H LYS A 61 -1.362 0.961 5.721 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.156 3.609 6.830 1.00 0.00 H new ATOM 0 HB2 LYS A 61 0.722 2.811 5.616 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.265 2.209 4.299 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.689 4.417 3.470 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -0.077 5.167 4.931 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.182 4.024 4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.498 3.713 2.784 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.521 5.751 2.387 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.916 6.296 2.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.621 7.544 3.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.701 6.650 5.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.255 6.122 4.672 1.00 0.00 H new ATOM 990 N TRP A 62 -3.397 2.951 4.566 1.00 0.00 N ATOM 991 CA TRP A 62 -4.547 3.490 3.847 1.00 0.00 C ATOM 992 C TRP A 62 -5.692 3.798 4.806 1.00 0.00 C ATOM 993 O TRP A 62 -6.247 4.897 4.791 1.00 0.00 O ATOM 994 CB TRP A 62 -5.014 2.502 2.776 1.00 0.00 C ATOM 995 CG TRP A 62 -6.231 2.962 2.033 1.00 0.00 C ATOM 996 CD1 TRP A 62 -6.264 3.790 0.949 1.00 0.00 C ATOM 997 CD2 TRP A 62 -7.591 2.622 2.324 1.00 0.00 C ATOM 998 NE1 TRP A 62 -7.564 3.986 0.546 1.00 0.00 N ATOM 999 CE2 TRP A 62 -8.396 3.279 1.373 1.00 0.00 C ATOM 1000 CE3 TRP A 62 -8.207 1.825 3.291 1.00 0.00 C ATOM 1001 CZ2 TRP A 62 -9.784 3.163 1.365 1.00 0.00 C ATOM 1002 CZ3 TRP A 62 -9.584 1.710 3.283 1.00 0.00 C ATOM 1003 CH2 TRP A 62 -10.361 2.375 2.325 1.00 0.00 C ATOM 0 H TRP A 62 -3.311 1.936 4.524 1.00 0.00 H new ATOM 0 HA TRP A 62 -4.241 4.419 3.365 1.00 0.00 H new ATOM 0 HB2 TRP A 62 -4.204 2.338 2.065 1.00 0.00 H new ATOM 0 HB3 TRP A 62 -5.225 1.541 3.246 1.00 0.00 H new ATOM 0 HD1 TRP A 62 -5.397 4.227 0.477 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -7.860 4.564 -0.241 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -7.617 1.307 4.033 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -10.384 3.676 0.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -10.070 1.097 4.028 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -11.435 2.264 2.344 1.00 0.00 H new ATOM 1014 N ARG A 63 -6.040 2.823 5.638 1.00 0.00 N ATOM 1015 CA ARG A 63 -7.121 2.990 6.601 1.00 0.00 C ATOM 1016 C ARG A 63 -6.838 4.163 7.537 1.00 0.00 C ATOM 1017 O ARG A 63 -7.722 4.972 7.820 1.00 0.00 O ATOM 1018 CB ARG A 63 -7.310 1.709 7.416 1.00 0.00 C ATOM 1019 CG ARG A 63 -7.829 0.539 6.598 1.00 0.00 C ATOM 1020 CD ARG A 63 -8.044 -0.693 7.463 1.00 0.00 C ATOM 1021 NE ARG A 63 -9.348 -0.679 8.121 1.00 0.00 N ATOM 1022 CZ ARG A 63 -9.834 -1.706 8.811 1.00 0.00 C ATOM 1023 NH1 ARG A 63 -9.128 -2.822 8.932 1.00 0.00 N ATOM 1024 NH2 ARG A 63 -11.028 -1.617 9.381 1.00 0.00 N ATOM 0 H ARG A 63 -5.589 1.909 5.665 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.037 3.199 6.048 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.357 1.432 7.868 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.004 1.907 8.233 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.768 0.817 6.119 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.121 0.307 5.802 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.959 -1.588 6.847 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.258 -0.749 8.216 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.917 0.165 8.047 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.209 -2.894 8.495 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.504 -3.608 9.462 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.574 -0.760 9.290 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.400 -2.405 9.910 1.00 0.00 H new ATOM 1038 N ARG A 64 -5.599 4.249 8.011 1.00 0.00 N ATOM 1039 CA ARG A 64 -5.201 5.321 8.915 1.00 0.00 C ATOM 1040 C ARG A 64 -5.282 6.677 8.219 1.00 0.00 C ATOM 1041 O ARG A 64 -5.754 7.654 8.799 1.00 0.00 O ATOM 1042 CB ARG A 64 -3.779 5.083 9.426 1.00 0.00 C ATOM 1043 CG ARG A 64 -2.703 5.690 8.541 1.00 0.00 C ATOM 1044 CD ARG A 64 -1.330 5.592 9.186 1.00 0.00 C ATOM 1045 NE ARG A 64 -1.059 6.721 10.071 1.00 0.00 N ATOM 1046 CZ ARG A 64 -0.889 7.967 9.643 1.00 0.00 C ATOM 1047 NH1 ARG A 64 -0.963 8.242 8.348 1.00 0.00 N ATOM 1048 NH2 ARG A 64 -0.646 8.941 10.510 1.00 0.00 N ATOM 0 H ARG A 64 -4.854 3.590 7.784 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.889 5.324 9.761 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -3.689 5.498 10.430 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.607 4.010 9.508 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.691 5.179 7.578 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.940 6.736 8.344 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -1.261 4.663 9.752 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.567 5.549 8.409 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.997 6.543 11.073 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -1.151 7.496 7.678 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.832 9.199 8.022 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.589 8.734 11.507 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -0.516 9.897 10.180 1.00 0.00 H new ATOM 1062 N GLU A 65 -4.818 6.726 6.975 1.00 0.00 N ATOM 1063 CA GLU A 65 -4.838 7.963 6.202 1.00 0.00 C ATOM 1064 C GLU A 65 -6.271 8.420 5.944 1.00 0.00 C ATOM 1065 O GLU A 65 -6.643 9.544 6.278 1.00 0.00 O ATOM 1066 CB GLU A 65 -4.105 7.771 4.873 1.00 0.00 C ATOM 1067 CG GLU A 65 -2.615 8.059 4.952 1.00 0.00 C ATOM 1068 CD GLU A 65 -2.022 8.438 3.609 1.00 0.00 C ATOM 1069 OE1 GLU A 65 -2.221 9.594 3.179 1.00 0.00 O ATOM 1070 OE2 GLU A 65 -1.360 7.581 2.989 1.00 0.00 O ATOM 0 H GLU A 65 -4.424 5.925 6.481 1.00 0.00 H new ATOM 0 HA GLU A 65 -4.329 8.733 6.782 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.251 6.746 4.532 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.553 8.423 4.123 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.442 8.867 5.662 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.099 7.180 5.338 1.00 0.00 H new ATOM 1077 N GLU A 66 -7.068 7.540 5.347 1.00 0.00 N ATOM 1078 CA GLU A 66 -8.459 7.855 5.042 1.00 0.00 C ATOM 1079 C GLU A 66 -9.165 8.437 6.264 1.00 0.00 C ATOM 1080 O GLU A 66 -10.016 9.318 6.142 1.00 0.00 O ATOM 1081 CB GLU A 66 -9.195 6.602 4.563 1.00 0.00 C ATOM 1082 CG GLU A 66 -9.123 6.391 3.060 1.00 0.00 C ATOM 1083 CD GLU A 66 -7.797 6.833 2.472 1.00 0.00 C ATOM 1084 OE1 GLU A 66 -6.830 6.043 2.533 1.00 0.00 O ATOM 1085 OE2 GLU A 66 -7.724 7.965 1.952 1.00 0.00 O ATOM 0 H GLU A 66 -6.775 6.604 5.065 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.471 8.601 4.247 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.775 5.730 5.064 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -10.241 6.669 4.862 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.281 5.336 2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -9.931 6.943 2.580 1.00 0.00 H new ATOM 1092 N LYS A 67 -8.806 7.936 7.441 1.00 0.00 N ATOM 1093 CA LYS A 67 -9.404 8.404 8.687 1.00 0.00 C ATOM 1094 C LYS A 67 -9.074 9.874 8.929 1.00 0.00 C ATOM 1095 O LYS A 67 -9.965 10.691 9.158 1.00 0.00 O ATOM 1096 CB LYS A 67 -8.910 7.559 9.863 1.00 0.00 C ATOM 1097 CG LYS A 67 -9.879 7.518 11.031 1.00 0.00 C ATOM 1098 CD LYS A 67 -10.875 6.379 10.890 1.00 0.00 C ATOM 1099 CE LYS A 67 -11.535 6.049 12.220 1.00 0.00 C ATOM 1100 NZ LYS A 67 -10.633 5.264 13.107 1.00 0.00 N ATOM 0 H LYS A 67 -8.104 7.206 7.559 1.00 0.00 H new ATOM 0 HA LYS A 67 -10.486 8.301 8.603 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.728 6.542 9.517 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.955 7.955 10.208 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -9.324 7.404 11.962 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.415 8.465 11.094 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -11.639 6.650 10.161 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -10.366 5.495 10.505 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.823 6.973 12.721 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.450 5.484 12.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.152 4.972 13.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -10.297 4.420 12.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -9.819 5.851 13.381 1.00 0.00 H new ATOM 1114 N LEU A 68 -7.788 10.204 8.875 1.00 0.00 N ATOM 1115 CA LEU A 68 -7.340 11.576 9.088 1.00 0.00 C ATOM 1116 C LEU A 68 -8.300 12.568 8.440 1.00 0.00 C ATOM 1117 O LEU A 68 -8.466 13.689 8.919 1.00 0.00 O ATOM 1118 CB LEU A 68 -5.932 11.766 8.520 1.00 0.00 C ATOM 1119 CG LEU A 68 -4.864 10.799 9.035 1.00 0.00 C ATOM 1120 CD1 LEU A 68 -3.537 11.052 8.338 1.00 0.00 C ATOM 1121 CD2 LEU A 68 -4.710 10.928 10.543 1.00 0.00 C ATOM 0 H LEU A 68 -7.037 9.540 8.686 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.321 11.765 10.161 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -5.984 11.674 7.435 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.608 12.784 8.738 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.182 9.781 8.809 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -2.789 10.356 8.716 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.657 10.908 7.264 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.213 12.074 8.533 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -3.946 10.233 10.892 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.414 11.947 10.793 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.659 10.697 11.027 1.00 0.00 H new ATOM 1133 N ARG A 69 -8.933 12.146 7.349 1.00 0.00 N ATOM 1134 CA ARG A 69 -9.878 12.998 6.636 1.00 0.00 C ATOM 1135 C ARG A 69 -11.278 12.870 7.228 1.00 0.00 C ATOM 1136 O ARG A 69 -11.992 13.860 7.377 1.00 0.00 O ATOM 1137 CB ARG A 69 -9.904 12.633 5.151 1.00 0.00 C ATOM 1138 CG ARG A 69 -10.732 13.588 4.305 1.00 0.00 C ATOM 1139 CD ARG A 69 -11.340 12.883 3.102 1.00 0.00 C ATOM 1140 NE ARG A 69 -12.334 13.711 2.427 1.00 0.00 N ATOM 1141 CZ ARG A 69 -12.702 13.534 1.163 1.00 0.00 C ATOM 1142 NH1 ARG A 69 -12.161 12.562 0.442 1.00 0.00 N ATOM 1143 NH2 ARG A 69 -13.614 14.330 0.618 1.00 0.00 N ATOM 0 H ARG A 69 -8.808 11.220 6.940 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.551 14.032 6.743 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -8.882 12.617 4.771 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.302 11.624 5.040 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -11.526 14.020 4.914 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -10.105 14.413 3.966 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -10.550 12.620 2.399 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -11.804 11.951 3.424 1.00 0.00 H new ATOM 0 HE ARG A 69 -12.770 14.467 2.955 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -11.461 11.948 0.858 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -12.445 12.428 -0.528 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -14.033 15.078 1.170 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -13.896 14.193 -0.353 1.00 0.00 H new ATOM 1157 N ASN A 70 -11.663 11.643 7.563 1.00 0.00 N ATOM 1158 CA ASN A 70 -12.979 11.384 8.137 1.00 0.00 C ATOM 1159 C ASN A 70 -13.128 12.077 9.488 1.00 0.00 C ATOM 1160 O ASN A 70 -14.240 12.362 9.930 1.00 0.00 O ATOM 1161 CB ASN A 70 -13.202 9.879 8.296 1.00 0.00 C ATOM 1162 CG ASN A 70 -13.728 9.235 7.028 1.00 0.00 C ATOM 1163 OD1 ASN A 70 -14.561 9.809 6.327 1.00 0.00 O ATOM 1164 ND2 ASN A 70 -13.241 8.037 6.727 1.00 0.00 N ATOM 0 H ASN A 70 -11.083 10.812 7.447 1.00 0.00 H new ATOM 0 HA ASN A 70 -13.730 11.786 7.457 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -12.263 9.403 8.579 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.906 9.703 9.109 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -13.556 7.555 5.885 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -12.551 7.599 7.338 1.00 0.00 H new ATOM 1171 N GLN A 71 -12.000 12.346 10.137 1.00 0.00 N ATOM 1172 CA GLN A 71 -12.005 13.006 11.437 1.00 0.00 C ATOM 1173 C GLN A 71 -12.244 14.504 11.287 1.00 0.00 C ATOM 1174 O GLN A 71 -12.935 15.117 12.099 1.00 0.00 O ATOM 1175 CB GLN A 71 -10.683 12.758 12.165 1.00 0.00 C ATOM 1176 CG GLN A 71 -10.399 11.288 12.427 1.00 0.00 C ATOM 1177 CD GLN A 71 -11.113 10.767 13.659 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -11.057 11.376 14.728 1.00 0.00 O ATOM 1179 NE2 GLN A 71 -11.790 9.634 13.516 1.00 0.00 N ATOM 0 H GLN A 71 -11.071 12.117 9.784 1.00 0.00 H new ATOM 0 HA GLN A 71 -12.820 12.585 12.026 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -9.868 13.177 11.574 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -10.695 13.292 13.115 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -10.704 10.703 11.560 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -9.325 11.145 12.546 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -11.810 9.162 12.612 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -12.290 9.235 14.310 1.00 0.00 H new ATOM 1188 N ARG A 72 -11.666 15.088 10.241 1.00 0.00 N ATOM 1189 CA ARG A 72 -11.814 16.515 9.985 1.00 0.00 C ATOM 1190 C ARG A 72 -13.287 16.895 9.856 1.00 0.00 C ATOM 1191 O ARG A 72 -13.679 18.019 10.170 1.00 0.00 O ATOM 1192 CB ARG A 72 -11.063 16.908 8.712 1.00 0.00 C ATOM 1193 CG ARG A 72 -10.852 18.406 8.566 1.00 0.00 C ATOM 1194 CD ARG A 72 -9.626 18.716 7.721 1.00 0.00 C ATOM 1195 NE ARG A 72 -8.384 18.381 8.414 1.00 0.00 N ATOM 1196 CZ ARG A 72 -7.198 18.343 7.819 1.00 0.00 C ATOM 1197 NH1 ARG A 72 -7.091 18.619 6.527 1.00 0.00 N ATOM 1198 NH2 ARG A 72 -6.113 18.031 8.517 1.00 0.00 N ATOM 0 H ARG A 72 -11.091 14.594 9.558 1.00 0.00 H new ATOM 0 HA ARG A 72 -11.389 17.055 10.831 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -10.093 16.411 8.705 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -11.616 16.542 7.847 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -11.733 18.856 8.109 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -10.739 18.856 9.552 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -9.680 18.159 6.785 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -9.622 19.775 7.462 1.00 0.00 H new ATOM 0 HE ARG A 72 -8.431 18.164 9.410 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -7.922 18.862 5.987 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -6.178 18.589 6.073 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -6.190 17.820 9.512 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -5.202 18.002 8.058 1.00 0.00 H new ATOM 1212 N ARG A 73 -14.097 15.949 9.391 1.00 0.00 N ATOM 1213 CA ARG A 73 -15.526 16.184 9.219 1.00 0.00 C ATOM 1214 C ARG A 73 -16.227 16.290 10.571 1.00 0.00 C ATOM 1215 O ARG A 73 -15.833 15.637 11.537 1.00 0.00 O ATOM 1216 CB ARG A 73 -16.154 15.060 8.394 1.00 0.00 C ATOM 1217 CG ARG A 73 -17.619 15.292 8.064 1.00 0.00 C ATOM 1218 CD ARG A 73 -17.781 16.132 6.807 1.00 0.00 C ATOM 1219 NE ARG A 73 -17.691 17.561 7.090 1.00 0.00 N ATOM 1220 CZ ARG A 73 -17.787 18.502 6.156 1.00 0.00 C ATOM 1221 NH1 ARG A 73 -17.976 18.166 4.888 1.00 0.00 N ATOM 1222 NH2 ARG A 73 -17.694 19.783 6.492 1.00 0.00 N ATOM 0 H ARG A 73 -13.788 15.013 9.127 1.00 0.00 H new ATOM 0 HA ARG A 73 -15.652 17.128 8.689 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -15.595 14.946 7.465 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -16.058 14.122 8.941 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -18.119 14.333 7.929 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -18.107 15.791 8.901 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -17.012 15.856 6.085 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -18.744 15.913 6.346 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.547 17.853 8.056 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -18.048 17.183 4.626 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -18.049 18.891 4.174 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -17.549 20.045 7.467 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -17.768 20.505 5.775 1.00 0.00 H new ATOM 1236 N GLN A 74 -17.265 17.117 10.630 1.00 0.00 N ATOM 1237 CA GLN A 74 -18.019 17.309 11.863 1.00 0.00 C ATOM 1238 C GLN A 74 -19.092 16.236 12.018 1.00 0.00 C ATOM 1239 O GLN A 74 -20.218 16.525 12.423 1.00 0.00 O ATOM 1240 CB GLN A 74 -18.662 18.697 11.883 1.00 0.00 C ATOM 1241 CG GLN A 74 -17.657 19.832 11.992 1.00 0.00 C ATOM 1242 CD GLN A 74 -16.796 19.730 13.236 1.00 0.00 C ATOM 1243 OE1 GLN A 74 -17.283 19.399 14.316 1.00 0.00 O ATOM 1244 NE2 GLN A 74 -15.508 20.017 13.089 1.00 0.00 N ATOM 0 H GLN A 74 -17.603 17.665 9.839 1.00 0.00 H new ATOM 0 HA GLN A 74 -17.325 17.226 12.699 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -19.249 18.829 10.974 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -19.355 18.755 12.722 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -17.016 19.831 11.110 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -18.188 20.784 11.999 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -15.147 20.287 12.174 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -14.880 19.967 13.891 1.00 0.00 H new ATOM 1253 N SER A 75 -18.735 14.997 11.693 1.00 0.00 N ATOM 1254 CA SER A 75 -19.668 13.881 11.792 1.00 0.00 C ATOM 1255 C SER A 75 -20.463 13.953 13.092 1.00 0.00 C ATOM 1256 O SER A 75 -21.688 13.846 13.090 1.00 0.00 O ATOM 1257 CB SER A 75 -18.917 12.552 11.712 1.00 0.00 C ATOM 1258 OG SER A 75 -18.070 12.512 10.575 1.00 0.00 O ATOM 0 H SER A 75 -17.806 14.741 11.359 1.00 0.00 H new ATOM 0 HA SER A 75 -20.365 13.946 10.956 1.00 0.00 H new ATOM 0 HB2 SER A 75 -18.324 12.411 12.616 1.00 0.00 H new ATOM 0 HB3 SER A 75 -19.631 11.729 11.667 1.00 0.00 H new ATOM 0 HG SER A 75 -17.600 11.653 10.548 1.00 0.00 H new ATOM 1264 N GLY A 76 -19.754 14.133 14.203 1.00 0.00 N ATOM 1265 CA GLY A 76 -20.409 14.214 15.495 1.00 0.00 C ATOM 1266 C GLY A 76 -19.436 14.494 16.622 1.00 0.00 C ATOM 1267 O GLY A 76 -19.124 15.645 16.932 1.00 0.00 O ATOM 0 H GLY A 76 -18.738 14.224 14.231 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -21.164 15.000 15.467 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -20.931 13.278 15.694 1.00 0.00 H new ATOM 1271 N PRO A 77 -18.936 13.423 17.257 1.00 0.00 N ATOM 1272 CA PRO A 77 -17.985 13.533 18.367 1.00 0.00 C ATOM 1273 C PRO A 77 -16.615 14.022 17.910 1.00 0.00 C ATOM 1274 O PRO A 77 -15.822 13.256 17.364 1.00 0.00 O ATOM 1275 CB PRO A 77 -17.891 12.100 18.897 1.00 0.00 C ATOM 1276 CG PRO A 77 -18.251 11.241 17.734 1.00 0.00 C ATOM 1277 CD PRO A 77 -19.262 12.022 16.940 1.00 0.00 C ATOM 0 HA PRO A 77 -18.312 14.258 19.113 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -16.887 11.877 19.258 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -18.573 11.941 19.732 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -17.372 11.013 17.130 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -18.666 10.289 18.065 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -19.176 11.821 15.872 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -20.282 11.771 17.231 1.00 0.00 H new ATOM 1285 N SER A 78 -16.343 15.304 18.138 1.00 0.00 N ATOM 1286 CA SER A 78 -15.069 15.896 17.746 1.00 0.00 C ATOM 1287 C SER A 78 -14.410 16.597 18.930 1.00 0.00 C ATOM 1288 O SER A 78 -14.992 17.495 19.537 1.00 0.00 O ATOM 1289 CB SER A 78 -15.275 16.890 16.602 1.00 0.00 C ATOM 1290 OG SER A 78 -15.535 16.215 15.382 1.00 0.00 O ATOM 0 H SER A 78 -16.987 15.952 18.592 1.00 0.00 H new ATOM 0 HA SER A 78 -14.412 15.094 17.408 1.00 0.00 H new ATOM 0 HB2 SER A 78 -16.106 17.554 16.838 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.388 17.515 16.494 1.00 0.00 H new ATOM 0 HG SER A 78 -15.665 16.872 14.666 1.00 0.00 H new ATOM 1296 N SER A 79 -13.190 16.178 19.253 1.00 0.00 N ATOM 1297 CA SER A 79 -12.451 16.761 20.366 1.00 0.00 C ATOM 1298 C SER A 79 -12.545 18.284 20.342 1.00 0.00 C ATOM 1299 O SER A 79 -12.944 18.908 21.324 1.00 0.00 O ATOM 1300 CB SER A 79 -10.984 16.329 20.314 1.00 0.00 C ATOM 1301 OG SER A 79 -10.287 16.748 21.475 1.00 0.00 O ATOM 0 H SER A 79 -12.693 15.437 18.759 1.00 0.00 H new ATOM 0 HA SER A 79 -12.896 16.401 21.294 1.00 0.00 H new ATOM 0 HB2 SER A 79 -10.924 15.245 20.222 1.00 0.00 H new ATOM 0 HB3 SER A 79 -10.509 16.751 19.429 1.00 0.00 H new ATOM 0 HG SER A 79 -9.353 16.458 21.418 1.00 0.00 H new ATOM 1307 N GLY A 80 -12.175 18.876 19.210 1.00 0.00 N ATOM 1308 CA GLY A 80 -12.224 20.320 19.079 1.00 0.00 C ATOM 1309 C GLY A 80 -13.555 20.897 19.520 1.00 0.00 C ATOM 1310 O GLY A 80 -14.160 21.697 18.806 1.00 0.00 O ATOM 0 H GLY A 80 -11.843 18.381 18.382 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -11.425 20.763 19.673 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.039 20.594 18.040 1.00 0.00 H new TER 1314 GLY A 80