USER MOD reduce.3.24.130724 H: found=0, std=0, add=670, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 666 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 51 LYS NZ :NH3+ -178:sc= -0.108 (180deg=0) USER MOD Set 1.2: A 61 GLN : amide:sc= -2.6 K(o=-2.7,f=-2.1) USER MOD Set 2.1: A 24 MET CE :methyl -143:sc= -2.33 (180deg=0) USER MOD Set 2.2: A 27 TYR OH : rot 174:sc= 1.26 USER MOD Set 2.3: A 60 HIS : no HD1:sc= -2.04 K(o=-3.1,f=-12!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -86:sc= 0.453 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= -0.0409 K(o=-0.041,f=-1.7!) USER MOD Single : A 28 THR OG1 : rot 109:sc= -0.531 USER MOD Single : A 30 HIS : no HD1:sc= -0.196 K(o=-0.2,f=-0.84) USER MOD Single : A 32 MET CE :methyl -127:sc= -0.277 (180deg=-2.13!) USER MOD Single : A 36 TYR OH : rot -108:sc= 0.425 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.0354 K(o=-0.035,f=-0.73) USER MOD Single : A 45 MET CE :methyl 178:sc= -0.725 (180deg=-0.749) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 47 ASN : amide:sc= -0.249 K(o=-0.25,f=-1.8!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -170:sc=-0.00368 USER MOD Single : A 72 LYS NZ :NH3+ -145:sc= 0.306 (180deg=0.0298) USER MOD Single : A 74 GLN : amide:sc= -2.34 X(o=-2.3,f=-2.1!) USER MOD Single : A 76 ASN : amide:sc= -0.0845 K(o=-0.084,f=-1.8!) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.360 -8.124 -12.281 1.00 0.00 N ATOM 2 CA GLY A 1 7.360 -8.798 -13.089 1.00 0.00 C ATOM 3 C GLY A 1 8.163 -7.835 -13.941 1.00 0.00 C ATOM 4 O GLY A 1 7.599 -7.061 -14.714 1.00 0.00 O ATOM 0 H1 GLY A 1 5.839 -8.826 -11.717 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.827 -7.447 -11.645 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.697 -7.616 -12.901 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.036 -9.352 -12.437 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.870 -9.527 -13.734 1.00 0.00 H new ATOM 8 N SER A 2 9.483 -7.881 -13.798 1.00 0.00 N ATOM 9 CA SER A 2 10.365 -7.002 -14.557 1.00 0.00 C ATOM 10 C SER A 2 11.213 -7.802 -15.542 1.00 0.00 C ATOM 11 O SER A 2 11.818 -8.811 -15.181 1.00 0.00 O ATOM 12 CB SER A 2 11.272 -6.213 -13.610 1.00 0.00 C ATOM 13 OG SER A 2 11.135 -6.669 -12.275 1.00 0.00 O ATOM 0 H SER A 2 9.966 -8.517 -13.164 1.00 0.00 H new ATOM 0 HA SER A 2 9.745 -6.305 -15.120 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.310 -6.314 -13.927 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.024 -5.153 -13.663 1.00 0.00 H new ATOM 0 HG SER A 2 11.726 -6.150 -11.690 1.00 0.00 H new ATOM 19 N SER A 3 11.250 -7.343 -16.789 1.00 0.00 N ATOM 20 CA SER A 3 12.020 -8.016 -17.829 1.00 0.00 C ATOM 21 C SER A 3 13.075 -7.083 -18.414 1.00 0.00 C ATOM 22 O SER A 3 14.207 -7.491 -18.672 1.00 0.00 O ATOM 23 CB SER A 3 11.091 -8.514 -18.938 1.00 0.00 C ATOM 24 OG SER A 3 11.527 -9.764 -19.445 1.00 0.00 O ATOM 0 H SER A 3 10.756 -6.508 -17.104 1.00 0.00 H new ATOM 0 HA SER A 3 12.526 -8.869 -17.378 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.076 -8.609 -18.552 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.058 -7.782 -19.745 1.00 0.00 H new ATOM 0 HG SER A 3 10.916 -10.062 -20.151 1.00 0.00 H new ATOM 30 N GLY A 4 12.695 -5.826 -18.621 1.00 0.00 N ATOM 31 CA GLY A 4 13.619 -4.853 -19.174 1.00 0.00 C ATOM 32 C GLY A 4 14.417 -4.136 -18.103 1.00 0.00 C ATOM 33 O GLY A 4 14.068 -4.184 -16.923 1.00 0.00 O ATOM 0 H GLY A 4 11.764 -5.464 -18.416 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.304 -5.355 -19.858 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.063 -4.121 -19.760 1.00 0.00 H new ATOM 37 N SER A 5 15.492 -3.471 -18.513 1.00 0.00 N ATOM 38 CA SER A 5 16.345 -2.746 -17.579 1.00 0.00 C ATOM 39 C SER A 5 16.793 -3.652 -16.437 1.00 0.00 C ATOM 40 O SER A 5 16.163 -3.697 -15.380 1.00 0.00 O ATOM 41 CB SER A 5 15.605 -1.529 -17.019 1.00 0.00 C ATOM 42 OG SER A 5 16.110 -0.326 -17.572 1.00 0.00 O ATOM 0 H SER A 5 15.793 -3.419 -19.486 1.00 0.00 H new ATOM 0 HA SER A 5 17.229 -2.408 -18.120 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.541 -1.615 -17.237 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.707 -1.505 -15.934 1.00 0.00 H new ATOM 0 HG SER A 5 15.620 0.436 -17.200 1.00 0.00 H new ATOM 48 N SER A 6 17.887 -4.374 -16.657 1.00 0.00 N ATOM 49 CA SER A 6 18.419 -5.284 -15.649 1.00 0.00 C ATOM 50 C SER A 6 19.180 -4.516 -14.572 1.00 0.00 C ATOM 51 O SER A 6 19.380 -3.307 -14.681 1.00 0.00 O ATOM 52 CB SER A 6 19.339 -6.319 -16.300 1.00 0.00 C ATOM 53 OG SER A 6 18.631 -7.507 -16.610 1.00 0.00 O ATOM 0 H SER A 6 18.423 -4.347 -17.525 1.00 0.00 H new ATOM 0 HA SER A 6 17.580 -5.798 -15.180 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.774 -5.903 -17.209 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.166 -6.549 -15.628 1.00 0.00 H new ATOM 0 HG SER A 6 19.240 -8.152 -17.026 1.00 0.00 H new ATOM 59 N GLY A 7 19.601 -5.229 -13.532 1.00 0.00 N ATOM 60 CA GLY A 7 20.335 -4.599 -12.450 1.00 0.00 C ATOM 61 C GLY A 7 20.647 -5.564 -11.323 1.00 0.00 C ATOM 62 O GLY A 7 20.758 -6.769 -11.543 1.00 0.00 O ATOM 0 H GLY A 7 19.447 -6.231 -13.419 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.266 -4.186 -12.839 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.754 -3.764 -12.059 1.00 0.00 H new ATOM 66 N GLU A 8 20.790 -5.031 -10.113 1.00 0.00 N ATOM 67 CA GLU A 8 21.094 -5.854 -8.948 1.00 0.00 C ATOM 68 C GLU A 8 19.891 -6.706 -8.555 1.00 0.00 C ATOM 69 O GLU A 8 18.747 -6.260 -8.638 1.00 0.00 O ATOM 70 CB GLU A 8 21.517 -4.974 -7.770 1.00 0.00 C ATOM 71 CG GLU A 8 23.022 -4.888 -7.584 1.00 0.00 C ATOM 72 CD GLU A 8 23.417 -4.614 -6.146 1.00 0.00 C ATOM 73 OE1 GLU A 8 23.334 -3.442 -5.721 1.00 0.00 O ATOM 74 OE2 GLU A 8 23.810 -5.570 -5.445 1.00 0.00 O ATOM 0 H GLU A 8 20.700 -4.035 -9.914 1.00 0.00 H new ATOM 0 HA GLU A 8 21.918 -6.518 -9.209 1.00 0.00 H new ATOM 0 HB2 GLU A 8 21.120 -3.970 -7.917 1.00 0.00 H new ATOM 0 HB3 GLU A 8 21.068 -5.364 -6.856 1.00 0.00 H new ATOM 0 HG2 GLU A 8 23.479 -5.822 -7.911 1.00 0.00 H new ATOM 0 HG3 GLU A 8 23.419 -4.099 -8.223 1.00 0.00 H new ATOM 81 N GLY A 9 20.158 -7.936 -8.127 1.00 0.00 N ATOM 82 CA GLY A 9 19.088 -8.832 -7.728 1.00 0.00 C ATOM 83 C GLY A 9 19.589 -10.225 -7.404 1.00 0.00 C ATOM 84 O GLY A 9 19.211 -10.808 -6.388 1.00 0.00 O ATOM 0 H GLY A 9 21.096 -8.328 -8.049 1.00 0.00 H new ATOM 0 HA2 GLY A 9 18.580 -8.420 -6.856 1.00 0.00 H new ATOM 0 HA3 GLY A 9 18.351 -8.891 -8.528 1.00 0.00 H new ATOM 88 N VAL A 10 20.441 -10.763 -8.271 1.00 0.00 N ATOM 89 CA VAL A 10 20.994 -12.097 -8.072 1.00 0.00 C ATOM 90 C VAL A 10 22.517 -12.059 -8.020 1.00 0.00 C ATOM 91 O VAL A 10 23.176 -11.434 -8.851 1.00 0.00 O ATOM 92 CB VAL A 10 20.553 -13.060 -9.191 1.00 0.00 C ATOM 93 CG1 VAL A 10 20.979 -12.528 -10.551 1.00 0.00 C ATOM 94 CG2 VAL A 10 21.121 -14.450 -8.952 1.00 0.00 C ATOM 0 H VAL A 10 20.763 -10.295 -9.118 1.00 0.00 H new ATOM 0 HA VAL A 10 20.610 -12.460 -7.118 1.00 0.00 H new ATOM 0 HB VAL A 10 19.465 -13.130 -9.179 1.00 0.00 H new ATOM 0 HG11 VAL A 10 20.659 -13.221 -11.329 1.00 0.00 H new ATOM 0 HG12 VAL A 10 20.520 -11.554 -10.721 1.00 0.00 H new ATOM 0 HG13 VAL A 10 22.064 -12.427 -10.579 1.00 0.00 H new ATOM 0 HG21 VAL A 10 20.799 -15.117 -9.752 1.00 0.00 H new ATOM 0 HG22 VAL A 10 22.210 -14.400 -8.937 1.00 0.00 H new ATOM 0 HG23 VAL A 10 20.762 -14.830 -7.996 1.00 0.00 H new ATOM 104 N PRO A 11 23.092 -12.744 -7.021 1.00 0.00 N ATOM 105 CA PRO A 11 24.545 -12.805 -6.837 1.00 0.00 C ATOM 106 C PRO A 11 25.234 -13.623 -7.924 1.00 0.00 C ATOM 107 O PRO A 11 26.299 -13.248 -8.416 1.00 0.00 O ATOM 108 CB PRO A 11 24.702 -13.487 -5.475 1.00 0.00 C ATOM 109 CG PRO A 11 23.458 -14.290 -5.308 1.00 0.00 C ATOM 110 CD PRO A 11 22.369 -13.512 -5.994 1.00 0.00 C ATOM 0 HA PRO A 11 25.004 -11.818 -6.891 1.00 0.00 H new ATOM 0 HB2 PRO A 11 25.589 -14.121 -5.449 1.00 0.00 H new ATOM 0 HB3 PRO A 11 24.811 -12.754 -4.675 1.00 0.00 H new ATOM 0 HG2 PRO A 11 23.570 -15.279 -5.751 1.00 0.00 H new ATOM 0 HG3 PRO A 11 23.227 -14.438 -4.253 1.00 0.00 H new ATOM 0 HD2 PRO A 11 21.622 -14.171 -6.437 1.00 0.00 H new ATOM 0 HD3 PRO A 11 21.844 -12.857 -5.298 1.00 0.00 H new ATOM 118 N PHE A 12 24.619 -14.741 -8.296 1.00 0.00 N ATOM 119 CA PHE A 12 25.173 -15.612 -9.326 1.00 0.00 C ATOM 120 C PHE A 12 24.285 -15.620 -10.567 1.00 0.00 C ATOM 121 O PHE A 12 23.113 -15.989 -10.503 1.00 0.00 O ATOM 122 CB PHE A 12 25.331 -17.036 -8.789 1.00 0.00 C ATOM 123 CG PHE A 12 25.962 -17.096 -7.428 1.00 0.00 C ATOM 124 CD1 PHE A 12 27.311 -16.827 -7.262 1.00 0.00 C ATOM 125 CD2 PHE A 12 25.206 -17.422 -6.313 1.00 0.00 C ATOM 126 CE1 PHE A 12 27.894 -16.883 -6.011 1.00 0.00 C ATOM 127 CE2 PHE A 12 25.784 -17.479 -5.058 1.00 0.00 C ATOM 128 CZ PHE A 12 27.130 -17.208 -4.907 1.00 0.00 C ATOM 0 H PHE A 12 23.737 -15.065 -7.899 1.00 0.00 H new ATOM 0 HA PHE A 12 26.153 -15.225 -9.605 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.351 -17.511 -8.748 1.00 0.00 H new ATOM 0 HB3 PHE A 12 25.936 -17.614 -9.487 1.00 0.00 H new ATOM 0 HD1 PHE A 12 27.914 -16.571 -8.121 1.00 0.00 H new ATOM 0 HD2 PHE A 12 24.153 -17.634 -6.426 1.00 0.00 H new ATOM 0 HE1 PHE A 12 28.947 -16.673 -5.896 1.00 0.00 H new ATOM 0 HE2 PHE A 12 25.184 -17.735 -4.197 1.00 0.00 H new ATOM 0 HZ PHE A 12 27.584 -17.250 -3.928 1.00 0.00 H new ATOM 138 N ARG A 13 24.853 -15.208 -11.696 1.00 0.00 N ATOM 139 CA ARG A 13 24.114 -15.166 -12.952 1.00 0.00 C ATOM 140 C ARG A 13 24.093 -16.539 -13.617 1.00 0.00 C ATOM 141 O ARG A 13 23.180 -16.858 -14.380 1.00 0.00 O ATOM 142 CB ARG A 13 24.735 -14.138 -13.900 1.00 0.00 C ATOM 143 CG ARG A 13 26.221 -14.349 -14.137 1.00 0.00 C ATOM 144 CD ARG A 13 26.675 -13.703 -15.437 1.00 0.00 C ATOM 145 NE ARG A 13 28.025 -13.155 -15.334 1.00 0.00 N ATOM 146 CZ ARG A 13 28.538 -12.296 -16.207 1.00 0.00 C ATOM 147 NH1 ARG A 13 27.818 -11.889 -17.243 1.00 0.00 N ATOM 148 NH2 ARG A 13 29.774 -11.842 -16.045 1.00 0.00 N ATOM 0 H ARG A 13 25.822 -14.899 -11.766 1.00 0.00 H new ATOM 0 HA ARG A 13 23.088 -14.873 -12.731 1.00 0.00 H new ATOM 0 HB2 ARG A 13 24.214 -14.177 -14.857 1.00 0.00 H new ATOM 0 HB3 ARG A 13 24.579 -13.139 -13.492 1.00 0.00 H new ATOM 0 HG2 ARG A 13 26.786 -13.930 -13.304 1.00 0.00 H new ATOM 0 HG3 ARG A 13 26.438 -15.417 -14.165 1.00 0.00 H new ATOM 0 HD2 ARG A 13 26.644 -14.441 -16.239 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.981 -12.908 -15.708 1.00 0.00 H new ATOM 0 HE ARG A 13 28.606 -13.448 -14.548 1.00 0.00 H new ATOM 0 HH11 ARG A 13 26.867 -12.236 -17.371 1.00 0.00 H new ATOM 0 HH12 ARG A 13 28.215 -11.229 -17.912 1.00 0.00 H new ATOM 0 HH21 ARG A 13 30.331 -12.153 -15.249 1.00 0.00 H new ATOM 0 HH22 ARG A 13 30.167 -11.182 -16.716 1.00 0.00 H new ATOM 162 N THR A 14 25.105 -17.350 -13.323 1.00 0.00 N ATOM 163 CA THR A 14 25.204 -18.687 -13.893 1.00 0.00 C ATOM 164 C THR A 14 25.376 -19.738 -12.802 1.00 0.00 C ATOM 165 O THR A 14 25.729 -19.418 -11.667 1.00 0.00 O ATOM 166 CB THR A 14 26.381 -18.791 -14.881 1.00 0.00 C ATOM 167 OG1 THR A 14 27.622 -18.774 -14.167 1.00 0.00 O ATOM 168 CG2 THR A 14 26.349 -17.646 -15.882 1.00 0.00 C ATOM 0 H THR A 14 25.868 -17.103 -12.693 1.00 0.00 H new ATOM 0 HA THR A 14 24.273 -18.872 -14.429 1.00 0.00 H new ATOM 0 HB THR A 14 26.289 -19.731 -15.425 1.00 0.00 H new ATOM 0 HG1 THR A 14 28.366 -18.842 -14.802 1.00 0.00 H new ATOM 0 HG21 THR A 14 27.190 -17.740 -16.570 1.00 0.00 H new ATOM 0 HG22 THR A 14 25.415 -17.680 -16.443 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.419 -16.697 -15.351 1.00 0.00 H new ATOM 176 N VAL A 15 25.126 -20.996 -13.153 1.00 0.00 N ATOM 177 CA VAL A 15 25.255 -22.095 -12.204 1.00 0.00 C ATOM 178 C VAL A 15 26.708 -22.290 -11.785 1.00 0.00 C ATOM 179 O VAL A 15 26.988 -22.814 -10.707 1.00 0.00 O ATOM 180 CB VAL A 15 24.722 -23.413 -12.796 1.00 0.00 C ATOM 181 CG1 VAL A 15 24.891 -24.552 -11.802 1.00 0.00 C ATOM 182 CG2 VAL A 15 23.264 -23.262 -13.203 1.00 0.00 C ATOM 0 H VAL A 15 24.833 -21.279 -14.088 1.00 0.00 H new ATOM 0 HA VAL A 15 24.659 -21.831 -11.330 1.00 0.00 H new ATOM 0 HB VAL A 15 25.302 -23.652 -13.687 1.00 0.00 H new ATOM 0 HG11 VAL A 15 24.509 -25.475 -12.238 1.00 0.00 H new ATOM 0 HG12 VAL A 15 25.948 -24.673 -11.564 1.00 0.00 H new ATOM 0 HG13 VAL A 15 24.338 -24.325 -10.891 1.00 0.00 H new ATOM 0 HG21 VAL A 15 22.903 -24.203 -13.619 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.668 -22.999 -12.329 1.00 0.00 H new ATOM 0 HG23 VAL A 15 23.175 -22.476 -13.953 1.00 0.00 H new ATOM 192 N SER A 16 27.629 -21.864 -12.643 1.00 0.00 N ATOM 193 CA SER A 16 29.054 -21.995 -12.364 1.00 0.00 C ATOM 194 C SER A 16 29.463 -21.100 -11.198 1.00 0.00 C ATOM 195 O SER A 16 30.071 -21.561 -10.232 1.00 0.00 O ATOM 196 CB SER A 16 29.874 -21.641 -13.606 1.00 0.00 C ATOM 197 OG SER A 16 31.226 -21.384 -13.268 1.00 0.00 O ATOM 0 H SER A 16 27.414 -21.425 -13.538 1.00 0.00 H new ATOM 0 HA SER A 16 29.252 -23.032 -12.091 1.00 0.00 H new ATOM 0 HB2 SER A 16 29.825 -22.460 -14.324 1.00 0.00 H new ATOM 0 HB3 SER A 16 29.444 -20.765 -14.092 1.00 0.00 H new ATOM 0 HG SER A 16 31.729 -21.162 -14.079 1.00 0.00 H new ATOM 203 N GLU A 17 29.125 -19.818 -11.297 1.00 0.00 N ATOM 204 CA GLU A 17 29.458 -18.858 -10.251 1.00 0.00 C ATOM 205 C GLU A 17 28.803 -19.246 -8.928 1.00 0.00 C ATOM 206 O GLU A 17 29.294 -18.894 -7.855 1.00 0.00 O ATOM 207 CB GLU A 17 29.014 -17.452 -10.659 1.00 0.00 C ATOM 208 CG GLU A 17 29.558 -17.009 -12.007 1.00 0.00 C ATOM 209 CD GLU A 17 30.642 -15.956 -11.881 1.00 0.00 C ATOM 210 OE1 GLU A 17 31.559 -16.145 -11.054 1.00 0.00 O ATOM 211 OE2 GLU A 17 30.573 -14.942 -12.607 1.00 0.00 O ATOM 0 H GLU A 17 28.621 -19.421 -12.090 1.00 0.00 H new ATOM 0 HA GLU A 17 30.540 -18.865 -10.117 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.925 -17.418 -10.687 1.00 0.00 H new ATOM 0 HB3 GLU A 17 29.335 -16.743 -9.896 1.00 0.00 H new ATOM 0 HG2 GLU A 17 29.957 -17.875 -12.536 1.00 0.00 H new ATOM 0 HG3 GLU A 17 28.742 -16.614 -12.612 1.00 0.00 H new ATOM 218 N TRP A 18 27.694 -19.971 -9.014 1.00 0.00 N ATOM 219 CA TRP A 18 26.972 -20.406 -7.824 1.00 0.00 C ATOM 220 C TRP A 18 27.639 -21.626 -7.198 1.00 0.00 C ATOM 221 O TRP A 18 27.983 -21.619 -6.015 1.00 0.00 O ATOM 222 CB TRP A 18 25.518 -20.728 -8.174 1.00 0.00 C ATOM 223 CG TRP A 18 24.765 -21.374 -7.050 1.00 0.00 C ATOM 224 CD1 TRP A 18 24.521 -20.843 -5.816 1.00 0.00 C ATOM 225 CD2 TRP A 18 24.162 -22.672 -7.057 1.00 0.00 C ATOM 226 NE1 TRP A 18 23.801 -21.732 -5.055 1.00 0.00 N ATOM 227 CE2 TRP A 18 23.567 -22.862 -5.794 1.00 0.00 C ATOM 228 CE3 TRP A 18 24.063 -23.691 -8.008 1.00 0.00 C ATOM 229 CZ2 TRP A 18 22.887 -24.030 -5.460 1.00 0.00 C ATOM 230 CZ3 TRP A 18 23.388 -24.850 -7.675 1.00 0.00 C ATOM 231 CH2 TRP A 18 22.806 -25.011 -6.410 1.00 0.00 C ATOM 0 H TRP A 18 27.275 -20.270 -9.895 1.00 0.00 H new ATOM 0 HA TRP A 18 26.992 -19.592 -7.099 1.00 0.00 H new ATOM 0 HB2 TRP A 18 25.009 -19.808 -8.461 1.00 0.00 H new ATOM 0 HB3 TRP A 18 25.498 -21.388 -9.041 1.00 0.00 H new ATOM 0 HD1 TRP A 18 24.846 -19.867 -5.486 1.00 0.00 H new ATOM 0 HE1 TRP A 18 23.491 -21.576 -4.096 1.00 0.00 H new ATOM 0 HE3 TRP A 18 24.506 -23.575 -8.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 22.439 -24.157 -4.485 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 23.308 -25.645 -8.402 1.00 0.00 H new ATOM 0 HH2 TRP A 18 22.283 -25.928 -6.181 1.00 0.00 H new ATOM 242 N LEU A 19 27.820 -22.671 -7.997 1.00 0.00 N ATOM 243 CA LEU A 19 28.447 -23.899 -7.520 1.00 0.00 C ATOM 244 C LEU A 19 29.886 -23.642 -7.084 1.00 0.00 C ATOM 245 O LEU A 19 30.298 -24.050 -5.999 1.00 0.00 O ATOM 246 CB LEU A 19 28.417 -24.968 -8.613 1.00 0.00 C ATOM 247 CG LEU A 19 27.129 -25.785 -8.718 1.00 0.00 C ATOM 248 CD1 LEU A 19 26.957 -26.332 -10.127 1.00 0.00 C ATOM 249 CD2 LEU A 19 27.131 -26.917 -7.701 1.00 0.00 C ATOM 0 H LEU A 19 27.542 -22.693 -8.978 1.00 0.00 H new ATOM 0 HA LEU A 19 27.883 -24.254 -6.657 1.00 0.00 H new ATOM 0 HB2 LEU A 19 28.595 -24.483 -9.573 1.00 0.00 H new ATOM 0 HB3 LEU A 19 29.246 -25.655 -8.444 1.00 0.00 H new ATOM 0 HG LEU A 19 26.286 -25.129 -8.500 1.00 0.00 H new ATOM 0 HD11 LEU A 19 26.035 -26.911 -10.183 1.00 0.00 H new ATOM 0 HD12 LEU A 19 26.909 -25.505 -10.835 1.00 0.00 H new ATOM 0 HD13 LEU A 19 27.803 -26.973 -10.374 1.00 0.00 H new ATOM 0 HD21 LEU A 19 26.207 -27.488 -7.790 1.00 0.00 H new ATOM 0 HD22 LEU A 19 27.982 -27.572 -7.888 1.00 0.00 H new ATOM 0 HD23 LEU A 19 27.206 -26.503 -6.696 1.00 0.00 H new ATOM 261 N GLU A 20 30.645 -22.960 -7.936 1.00 0.00 N ATOM 262 CA GLU A 20 32.037 -22.647 -7.637 1.00 0.00 C ATOM 263 C GLU A 20 32.163 -21.974 -6.274 1.00 0.00 C ATOM 264 O GLU A 20 33.161 -22.146 -5.574 1.00 0.00 O ATOM 265 CB GLU A 20 32.624 -21.741 -8.722 1.00 0.00 C ATOM 266 CG GLU A 20 32.142 -20.302 -8.639 1.00 0.00 C ATOM 267 CD GLU A 20 32.978 -19.460 -7.694 1.00 0.00 C ATOM 268 OE1 GLU A 20 34.209 -19.392 -7.893 1.00 0.00 O ATOM 269 OE2 GLU A 20 32.402 -18.870 -6.757 1.00 0.00 O ATOM 0 H GLU A 20 30.319 -22.614 -8.838 1.00 0.00 H new ATOM 0 HA GLU A 20 32.596 -23.583 -7.614 1.00 0.00 H new ATOM 0 HB2 GLU A 20 33.711 -21.756 -8.647 1.00 0.00 H new ATOM 0 HB3 GLU A 20 32.366 -22.146 -9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 20 32.166 -19.857 -9.634 1.00 0.00 H new ATOM 0 HG3 GLU A 20 31.103 -20.289 -8.309 1.00 0.00 H new ATOM 276 N SER A 21 31.143 -21.207 -5.903 1.00 0.00 N ATOM 277 CA SER A 21 31.141 -20.504 -4.625 1.00 0.00 C ATOM 278 C SER A 21 31.169 -21.491 -3.462 1.00 0.00 C ATOM 279 O SER A 21 31.762 -21.218 -2.417 1.00 0.00 O ATOM 280 CB SER A 21 29.907 -19.605 -4.516 1.00 0.00 C ATOM 281 OG SER A 21 28.921 -20.192 -3.684 1.00 0.00 O ATOM 0 H SER A 21 30.308 -21.056 -6.469 1.00 0.00 H new ATOM 0 HA SER A 21 32.038 -19.886 -4.576 1.00 0.00 H new ATOM 0 HB2 SER A 21 30.195 -18.634 -4.114 1.00 0.00 H new ATOM 0 HB3 SER A 21 29.492 -19.429 -5.509 1.00 0.00 H new ATOM 0 HG SER A 21 28.365 -20.800 -4.215 1.00 0.00 H new ATOM 287 N ILE A 22 30.525 -22.637 -3.651 1.00 0.00 N ATOM 288 CA ILE A 22 30.478 -23.666 -2.619 1.00 0.00 C ATOM 289 C ILE A 22 31.435 -24.809 -2.938 1.00 0.00 C ATOM 290 O ILE A 22 31.243 -25.939 -2.487 1.00 0.00 O ATOM 291 CB ILE A 22 29.055 -24.232 -2.455 1.00 0.00 C ATOM 292 CG1 ILE A 22 28.564 -24.828 -3.776 1.00 0.00 C ATOM 293 CG2 ILE A 22 28.105 -23.147 -1.971 1.00 0.00 C ATOM 294 CD1 ILE A 22 27.184 -25.442 -3.686 1.00 0.00 C ATOM 0 H ILE A 22 30.028 -22.877 -4.509 1.00 0.00 H new ATOM 0 HA ILE A 22 30.782 -23.192 -1.686 1.00 0.00 H new ATOM 0 HB ILE A 22 29.080 -25.025 -1.708 1.00 0.00 H new ATOM 0 HG12 ILE A 22 28.557 -24.048 -4.537 1.00 0.00 H new ATOM 0 HG13 ILE A 22 29.271 -25.589 -4.107 1.00 0.00 H new ATOM 0 HG21 ILE A 22 27.104 -23.563 -1.860 1.00 0.00 H new ATOM 0 HG22 ILE A 22 28.448 -22.766 -1.009 1.00 0.00 H new ATOM 0 HG23 ILE A 22 28.082 -22.334 -2.696 1.00 0.00 H new ATOM 0 HD11 ILE A 22 26.901 -25.845 -4.659 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.190 -26.245 -2.949 1.00 0.00 H new ATOM 0 HD13 ILE A 22 26.465 -24.679 -3.386 1.00 0.00 H new ATOM 306 N LYS A 23 32.469 -24.508 -3.716 1.00 0.00 N ATOM 307 CA LYS A 23 33.459 -25.509 -4.094 1.00 0.00 C ATOM 308 C LYS A 23 32.787 -26.745 -4.685 1.00 0.00 C ATOM 309 O LYS A 23 33.130 -27.875 -4.339 1.00 0.00 O ATOM 310 CB LYS A 23 34.302 -25.906 -2.880 1.00 0.00 C ATOM 311 CG LYS A 23 35.292 -24.837 -2.451 1.00 0.00 C ATOM 312 CD LYS A 23 36.677 -25.098 -3.018 1.00 0.00 C ATOM 313 CE LYS A 23 37.715 -25.232 -1.915 1.00 0.00 C ATOM 314 NZ LYS A 23 39.103 -25.128 -2.444 1.00 0.00 N ATOM 0 H LYS A 23 32.643 -23.578 -4.097 1.00 0.00 H new ATOM 0 HA LYS A 23 34.108 -25.072 -4.853 1.00 0.00 H new ATOM 0 HB2 LYS A 23 33.638 -26.131 -2.045 1.00 0.00 H new ATOM 0 HB3 LYS A 23 34.846 -26.822 -3.110 1.00 0.00 H new ATOM 0 HG2 LYS A 23 34.940 -23.860 -2.783 1.00 0.00 H new ATOM 0 HG3 LYS A 23 35.344 -24.804 -1.363 1.00 0.00 H new ATOM 0 HD2 LYS A 23 36.661 -26.009 -3.616 1.00 0.00 H new ATOM 0 HD3 LYS A 23 36.957 -24.283 -3.686 1.00 0.00 H new ATOM 0 HE2 LYS A 23 37.552 -24.456 -1.167 1.00 0.00 H new ATOM 0 HE3 LYS A 23 37.589 -26.191 -1.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 39.781 -25.224 -1.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 39.267 -25.884 -3.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 39.232 -24.203 -2.902 1.00 0.00 H new ATOM 328 N MET A 24 31.829 -26.521 -5.579 1.00 0.00 N ATOM 329 CA MET A 24 31.112 -27.617 -6.219 1.00 0.00 C ATOM 330 C MET A 24 30.927 -27.348 -7.709 1.00 0.00 C ATOM 331 O MET A 24 29.975 -27.831 -8.322 1.00 0.00 O ATOM 332 CB MET A 24 29.750 -27.821 -5.553 1.00 0.00 C ATOM 333 CG MET A 24 29.843 -28.214 -4.088 1.00 0.00 C ATOM 334 SD MET A 24 29.589 -29.980 -3.825 1.00 0.00 S ATOM 335 CE MET A 24 31.261 -30.513 -3.468 1.00 0.00 C ATOM 0 H MET A 24 31.532 -25.592 -5.876 1.00 0.00 H new ATOM 0 HA MET A 24 31.705 -28.524 -6.102 1.00 0.00 H new ATOM 0 HB2 MET A 24 29.172 -26.901 -5.638 1.00 0.00 H new ATOM 0 HB3 MET A 24 29.202 -28.593 -6.094 1.00 0.00 H new ATOM 0 HG2 MET A 24 30.822 -27.930 -3.701 1.00 0.00 H new ATOM 0 HG3 MET A 24 29.101 -27.655 -3.518 1.00 0.00 H new ATOM 0 HE1 MET A 24 31.431 -31.496 -3.907 1.00 0.00 H new ATOM 0 HE2 MET A 24 31.968 -29.799 -3.890 1.00 0.00 H new ATOM 0 HE3 MET A 24 31.403 -30.569 -2.389 1.00 0.00 H new ATOM 345 N GLN A 25 31.842 -26.574 -8.285 1.00 0.00 N ATOM 346 CA GLN A 25 31.777 -26.241 -9.703 1.00 0.00 C ATOM 347 C GLN A 25 31.926 -27.492 -10.563 1.00 0.00 C ATOM 348 O GLN A 25 31.365 -27.575 -11.655 1.00 0.00 O ATOM 349 CB GLN A 25 32.867 -25.229 -10.060 1.00 0.00 C ATOM 350 CG GLN A 25 34.268 -25.688 -9.692 1.00 0.00 C ATOM 351 CD GLN A 25 35.331 -24.670 -10.057 1.00 0.00 C ATOM 352 OE1 GLN A 25 35.863 -24.681 -11.167 1.00 0.00 O ATOM 353 NE2 GLN A 25 35.646 -23.782 -9.121 1.00 0.00 N ATOM 0 H GLN A 25 32.636 -26.166 -7.792 1.00 0.00 H new ATOM 0 HA GLN A 25 30.801 -25.799 -9.903 1.00 0.00 H new ATOM 0 HB2 GLN A 25 32.829 -25.029 -11.131 1.00 0.00 H new ATOM 0 HB3 GLN A 25 32.657 -24.287 -9.552 1.00 0.00 H new ATOM 0 HG2 GLN A 25 34.312 -25.885 -8.621 1.00 0.00 H new ATOM 0 HG3 GLN A 25 34.483 -26.629 -10.198 1.00 0.00 H new ATOM 0 HE21 GLN A 25 35.180 -23.810 -8.214 1.00 0.00 H new ATOM 0 HE22 GLN A 25 36.354 -23.072 -9.309 1.00 0.00 H new ATOM 362 N GLN A 26 32.686 -28.461 -10.063 1.00 0.00 N ATOM 363 CA GLN A 26 32.909 -29.707 -10.787 1.00 0.00 C ATOM 364 C GLN A 26 31.587 -30.408 -11.083 1.00 0.00 C ATOM 365 O GLN A 26 31.482 -31.179 -12.038 1.00 0.00 O ATOM 366 CB GLN A 26 33.822 -30.633 -9.982 1.00 0.00 C ATOM 367 CG GLN A 26 33.142 -31.262 -8.777 1.00 0.00 C ATOM 368 CD GLN A 26 34.132 -31.800 -7.763 1.00 0.00 C ATOM 369 OE1 GLN A 26 35.331 -31.532 -7.846 1.00 0.00 O ATOM 370 NE2 GLN A 26 33.634 -32.564 -6.797 1.00 0.00 N ATOM 0 H GLN A 26 33.157 -28.407 -9.160 1.00 0.00 H new ATOM 0 HA GLN A 26 33.392 -29.466 -11.734 1.00 0.00 H new ATOM 0 HB2 GLN A 26 34.190 -31.424 -10.635 1.00 0.00 H new ATOM 0 HB3 GLN A 26 34.691 -30.069 -9.644 1.00 0.00 H new ATOM 0 HG2 GLN A 26 32.503 -30.521 -8.297 1.00 0.00 H new ATOM 0 HG3 GLN A 26 32.494 -32.072 -9.112 1.00 0.00 H new ATOM 0 HE21 GLN A 26 32.634 -32.760 -6.767 1.00 0.00 H new ATOM 0 HE22 GLN A 26 34.252 -32.954 -6.086 1.00 0.00 H new ATOM 379 N TYR A 27 30.582 -30.137 -10.259 1.00 0.00 N ATOM 380 CA TYR A 27 29.268 -30.745 -10.430 1.00 0.00 C ATOM 381 C TYR A 27 28.447 -29.984 -11.467 1.00 0.00 C ATOM 382 O TYR A 27 27.431 -30.478 -11.957 1.00 0.00 O ATOM 383 CB TYR A 27 28.520 -30.779 -9.096 1.00 0.00 C ATOM 384 CG TYR A 27 28.902 -31.949 -8.218 1.00 0.00 C ATOM 385 CD1 TYR A 27 28.876 -33.249 -8.709 1.00 0.00 C ATOM 386 CD2 TYR A 27 29.289 -31.755 -6.898 1.00 0.00 C ATOM 387 CE1 TYR A 27 29.223 -34.321 -7.909 1.00 0.00 C ATOM 388 CE2 TYR A 27 29.639 -32.821 -6.092 1.00 0.00 C ATOM 389 CZ TYR A 27 29.604 -34.102 -6.602 1.00 0.00 C ATOM 390 OH TYR A 27 29.952 -35.167 -5.803 1.00 0.00 O ATOM 0 H TYR A 27 30.652 -29.500 -9.465 1.00 0.00 H new ATOM 0 HA TYR A 27 29.412 -31.766 -10.784 1.00 0.00 H new ATOM 0 HB2 TYR A 27 28.714 -29.852 -8.556 1.00 0.00 H new ATOM 0 HB3 TYR A 27 27.448 -30.816 -9.291 1.00 0.00 H new ATOM 0 HD1 TYR A 27 28.580 -33.424 -9.733 1.00 0.00 H new ATOM 0 HD2 TYR A 27 29.317 -30.753 -6.495 1.00 0.00 H new ATOM 0 HE1 TYR A 27 29.196 -35.325 -8.305 1.00 0.00 H new ATOM 0 HE2 TYR A 27 29.938 -32.652 -5.068 1.00 0.00 H new ATOM 0 HH TYR A 27 30.285 -34.836 -4.943 1.00 0.00 H new ATOM 400 N THR A 28 28.895 -28.777 -11.797 1.00 0.00 N ATOM 401 CA THR A 28 28.204 -27.945 -12.774 1.00 0.00 C ATOM 402 C THR A 28 27.948 -28.713 -14.066 1.00 0.00 C ATOM 403 O THR A 28 26.865 -28.628 -14.644 1.00 0.00 O ATOM 404 CB THR A 28 29.008 -26.672 -13.098 1.00 0.00 C ATOM 405 OG1 THR A 28 29.327 -25.973 -11.889 1.00 0.00 O ATOM 406 CG2 THR A 28 28.223 -25.758 -14.027 1.00 0.00 C ATOM 0 H THR A 28 29.734 -28.353 -11.401 1.00 0.00 H new ATOM 0 HA THR A 28 27.251 -27.660 -12.328 1.00 0.00 H new ATOM 0 HB THR A 28 29.929 -26.968 -13.599 1.00 0.00 H new ATOM 0 HG1 THR A 28 30.285 -26.060 -11.704 1.00 0.00 H new ATOM 0 HG21 THR A 28 28.811 -24.866 -14.242 1.00 0.00 H new ATOM 0 HG22 THR A 28 28.008 -26.283 -14.958 1.00 0.00 H new ATOM 0 HG23 THR A 28 27.287 -25.469 -13.548 1.00 0.00 H new ATOM 414 N GLU A 29 28.951 -29.463 -14.512 1.00 0.00 N ATOM 415 CA GLU A 29 28.832 -30.246 -15.737 1.00 0.00 C ATOM 416 C GLU A 29 27.605 -31.151 -15.687 1.00 0.00 C ATOM 417 O GLU A 29 27.023 -31.484 -16.720 1.00 0.00 O ATOM 418 CB GLU A 29 30.092 -31.087 -15.955 1.00 0.00 C ATOM 419 CG GLU A 29 31.347 -30.258 -16.172 1.00 0.00 C ATOM 420 CD GLU A 29 32.585 -30.909 -15.587 1.00 0.00 C ATOM 421 OE1 GLU A 29 32.695 -32.151 -15.663 1.00 0.00 O ATOM 422 OE2 GLU A 29 33.444 -30.176 -15.053 1.00 0.00 O ATOM 0 H GLU A 29 29.854 -29.545 -14.044 1.00 0.00 H new ATOM 0 HA GLU A 29 28.717 -29.554 -16.571 1.00 0.00 H new ATOM 0 HB2 GLU A 29 30.240 -31.735 -15.091 1.00 0.00 H new ATOM 0 HB3 GLU A 29 29.941 -31.735 -16.818 1.00 0.00 H new ATOM 0 HG2 GLU A 29 31.494 -30.101 -17.241 1.00 0.00 H new ATOM 0 HG3 GLU A 29 31.211 -29.275 -15.721 1.00 0.00 H new ATOM 429 N HIS A 30 27.217 -31.546 -14.479 1.00 0.00 N ATOM 430 CA HIS A 30 26.059 -32.414 -14.293 1.00 0.00 C ATOM 431 C HIS A 30 24.771 -31.598 -14.249 1.00 0.00 C ATOM 432 O HIS A 30 23.763 -31.977 -14.846 1.00 0.00 O ATOM 433 CB HIS A 30 26.206 -33.227 -13.007 1.00 0.00 C ATOM 434 CG HIS A 30 27.281 -34.267 -13.075 1.00 0.00 C ATOM 435 ND1 HIS A 30 28.550 -34.009 -13.550 1.00 0.00 N ATOM 436 CD2 HIS A 30 27.272 -35.575 -12.724 1.00 0.00 C ATOM 437 CE1 HIS A 30 29.274 -35.112 -13.489 1.00 0.00 C ATOM 438 NE2 HIS A 30 28.522 -36.077 -12.991 1.00 0.00 N ATOM 0 H HIS A 30 27.687 -31.279 -13.614 1.00 0.00 H new ATOM 0 HA HIS A 30 26.007 -33.097 -15.141 1.00 0.00 H new ATOM 0 HB2 HIS A 30 26.420 -32.549 -12.181 1.00 0.00 H new ATOM 0 HB3 HIS A 30 25.256 -33.712 -12.783 1.00 0.00 H new ATOM 0 HD2 HIS A 30 26.437 -36.122 -12.311 1.00 0.00 H new ATOM 0 HE1 HIS A 30 30.305 -35.208 -13.794 1.00 0.00 H new ATOM 0 HE2 HIS A 30 28.821 -37.039 -12.831 1.00 0.00 H new ATOM 446 N PHE A 31 24.811 -30.476 -13.537 1.00 0.00 N ATOM 447 CA PHE A 31 23.646 -29.607 -13.414 1.00 0.00 C ATOM 448 C PHE A 31 23.076 -29.263 -14.786 1.00 0.00 C ATOM 449 O PHE A 31 21.860 -29.227 -14.974 1.00 0.00 O ATOM 450 CB PHE A 31 24.017 -28.324 -12.667 1.00 0.00 C ATOM 451 CG PHE A 31 23.870 -28.435 -11.176 1.00 0.00 C ATOM 452 CD1 PHE A 31 24.904 -28.931 -10.399 1.00 0.00 C ATOM 453 CD2 PHE A 31 22.697 -28.041 -10.552 1.00 0.00 C ATOM 454 CE1 PHE A 31 24.770 -29.034 -9.027 1.00 0.00 C ATOM 455 CE2 PHE A 31 22.558 -28.141 -9.180 1.00 0.00 C ATOM 456 CZ PHE A 31 23.596 -28.638 -8.417 1.00 0.00 C ATOM 0 H PHE A 31 25.637 -30.148 -13.037 1.00 0.00 H new ATOM 0 HA PHE A 31 22.884 -30.142 -12.848 1.00 0.00 H new ATOM 0 HB2 PHE A 31 25.048 -28.060 -12.904 1.00 0.00 H new ATOM 0 HB3 PHE A 31 23.389 -27.509 -13.026 1.00 0.00 H new ATOM 0 HD1 PHE A 31 25.825 -29.241 -10.870 1.00 0.00 H new ATOM 0 HD2 PHE A 31 21.882 -27.651 -11.144 1.00 0.00 H new ATOM 0 HE1 PHE A 31 25.583 -29.424 -8.432 1.00 0.00 H new ATOM 0 HE2 PHE A 31 21.639 -27.831 -8.706 1.00 0.00 H new ATOM 0 HZ PHE A 31 23.490 -28.717 -7.345 1.00 0.00 H new ATOM 466 N MET A 32 23.964 -29.010 -15.743 1.00 0.00 N ATOM 467 CA MET A 32 23.550 -28.669 -17.099 1.00 0.00 C ATOM 468 C MET A 32 22.874 -29.857 -17.776 1.00 0.00 C ATOM 469 O MET A 32 21.830 -29.710 -18.411 1.00 0.00 O ATOM 470 CB MET A 32 24.755 -28.215 -17.924 1.00 0.00 C ATOM 471 CG MET A 32 25.646 -27.218 -17.201 1.00 0.00 C ATOM 472 SD MET A 32 26.023 -25.768 -18.205 1.00 0.00 S ATOM 473 CE MET A 32 25.561 -24.450 -17.083 1.00 0.00 C ATOM 0 H MET A 32 24.974 -29.035 -15.604 1.00 0.00 H new ATOM 0 HA MET A 32 22.832 -27.851 -17.038 1.00 0.00 H new ATOM 0 HB2 MET A 32 25.348 -29.088 -18.197 1.00 0.00 H new ATOM 0 HB3 MET A 32 24.401 -27.767 -18.852 1.00 0.00 H new ATOM 0 HG2 MET A 32 25.157 -26.900 -16.280 1.00 0.00 H new ATOM 0 HG3 MET A 32 26.576 -27.709 -16.915 1.00 0.00 H new ATOM 0 HE1 MET A 32 24.866 -23.774 -17.582 1.00 0.00 H new ATOM 0 HE2 MET A 32 25.083 -24.875 -16.200 1.00 0.00 H new ATOM 0 HE3 MET A 32 26.452 -23.898 -16.783 1.00 0.00 H new ATOM 483 N ALA A 33 23.475 -31.034 -17.635 1.00 0.00 N ATOM 484 CA ALA A 33 22.930 -32.247 -18.232 1.00 0.00 C ATOM 485 C ALA A 33 21.554 -32.569 -17.660 1.00 0.00 C ATOM 486 O ALA A 33 20.738 -33.221 -18.311 1.00 0.00 O ATOM 487 CB ALA A 33 23.880 -33.415 -18.015 1.00 0.00 C ATOM 0 H ALA A 33 24.340 -31.173 -17.112 1.00 0.00 H new ATOM 0 HA ALA A 33 22.819 -32.077 -19.303 1.00 0.00 H new ATOM 0 HB1 ALA A 33 23.460 -34.314 -18.466 1.00 0.00 H new ATOM 0 HB2 ALA A 33 24.842 -33.192 -18.477 1.00 0.00 H new ATOM 0 HB3 ALA A 33 24.020 -33.577 -16.946 1.00 0.00 H new ATOM 493 N ALA A 34 21.302 -32.108 -16.439 1.00 0.00 N ATOM 494 CA ALA A 34 20.024 -32.346 -15.781 1.00 0.00 C ATOM 495 C ALA A 34 18.977 -31.332 -16.231 1.00 0.00 C ATOM 496 O ALA A 34 17.777 -31.598 -16.176 1.00 0.00 O ATOM 497 CB ALA A 34 20.192 -32.298 -14.269 1.00 0.00 C ATOM 0 H ALA A 34 21.967 -31.567 -15.886 1.00 0.00 H new ATOM 0 HA ALA A 34 19.676 -33.339 -16.066 1.00 0.00 H new ATOM 0 HB1 ALA A 34 19.229 -32.477 -13.790 1.00 0.00 H new ATOM 0 HB2 ALA A 34 20.901 -33.065 -13.957 1.00 0.00 H new ATOM 0 HB3 ALA A 34 20.566 -31.317 -13.975 1.00 0.00 H new ATOM 503 N GLY A 35 19.440 -30.168 -16.677 1.00 0.00 N ATOM 504 CA GLY A 35 18.530 -29.132 -17.130 1.00 0.00 C ATOM 505 C GLY A 35 18.528 -27.923 -16.216 1.00 0.00 C ATOM 506 O GLY A 35 17.531 -27.205 -16.127 1.00 0.00 O ATOM 0 H GLY A 35 20.429 -29.924 -16.733 1.00 0.00 H new ATOM 0 HA2 GLY A 35 18.809 -28.822 -18.137 1.00 0.00 H new ATOM 0 HA3 GLY A 35 17.521 -29.540 -17.190 1.00 0.00 H new ATOM 510 N TYR A 36 19.645 -27.697 -15.533 1.00 0.00 N ATOM 511 CA TYR A 36 19.766 -26.569 -14.618 1.00 0.00 C ATOM 512 C TYR A 36 20.929 -25.666 -15.018 1.00 0.00 C ATOM 513 O TYR A 36 21.945 -25.596 -14.325 1.00 0.00 O ATOM 514 CB TYR A 36 19.962 -27.066 -13.185 1.00 0.00 C ATOM 515 CG TYR A 36 18.912 -28.059 -12.740 1.00 0.00 C ATOM 516 CD1 TYR A 36 17.563 -27.827 -12.978 1.00 0.00 C ATOM 517 CD2 TYR A 36 19.269 -29.229 -12.081 1.00 0.00 C ATOM 518 CE1 TYR A 36 16.600 -28.731 -12.572 1.00 0.00 C ATOM 519 CE2 TYR A 36 18.313 -30.139 -11.673 1.00 0.00 C ATOM 520 CZ TYR A 36 16.980 -29.885 -11.921 1.00 0.00 C ATOM 521 OH TYR A 36 16.025 -30.789 -11.515 1.00 0.00 O ATOM 0 H TYR A 36 20.479 -28.280 -15.596 1.00 0.00 H new ATOM 0 HA TYR A 36 18.844 -25.990 -14.672 1.00 0.00 H new ATOM 0 HB2 TYR A 36 20.946 -27.528 -13.101 1.00 0.00 H new ATOM 0 HB3 TYR A 36 19.952 -26.212 -12.508 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.262 -26.925 -13.489 1.00 0.00 H new ATOM 0 HD2 TYR A 36 20.312 -29.430 -11.884 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.555 -28.534 -12.764 1.00 0.00 H new ATOM 0 HE2 TYR A 36 18.608 -31.044 -11.163 1.00 0.00 H new ATOM 0 HH TYR A 36 15.936 -30.755 -10.540 1.00 0.00 H new ATOM 531 N THR A 37 20.772 -24.973 -16.142 1.00 0.00 N ATOM 532 CA THR A 37 21.807 -24.074 -16.637 1.00 0.00 C ATOM 533 C THR A 37 21.644 -22.675 -16.054 1.00 0.00 C ATOM 534 O THR A 37 22.608 -21.916 -15.958 1.00 0.00 O ATOM 535 CB THR A 37 21.786 -23.984 -18.174 1.00 0.00 C ATOM 536 OG1 THR A 37 20.654 -23.219 -18.604 1.00 0.00 O ATOM 537 CG2 THR A 37 21.733 -25.371 -18.797 1.00 0.00 C ATOM 0 H THR A 37 19.937 -25.017 -16.727 1.00 0.00 H new ATOM 0 HA THR A 37 22.764 -24.488 -16.319 1.00 0.00 H new ATOM 0 HB THR A 37 22.702 -23.492 -18.500 1.00 0.00 H new ATOM 0 HG1 THR A 37 20.648 -23.165 -19.582 1.00 0.00 H new ATOM 0 HG21 THR A 37 21.719 -25.282 -19.883 1.00 0.00 H new ATOM 0 HG22 THR A 37 22.610 -25.941 -18.491 1.00 0.00 H new ATOM 0 HG23 THR A 37 20.832 -25.885 -18.464 1.00 0.00 H new ATOM 545 N ALA A 38 20.418 -22.340 -15.667 1.00 0.00 N ATOM 546 CA ALA A 38 20.130 -21.032 -15.091 1.00 0.00 C ATOM 547 C ALA A 38 19.625 -21.162 -13.658 1.00 0.00 C ATOM 548 O ALA A 38 18.988 -22.155 -13.302 1.00 0.00 O ATOM 549 CB ALA A 38 19.112 -20.292 -15.946 1.00 0.00 C ATOM 0 H ALA A 38 19.608 -22.956 -15.742 1.00 0.00 H new ATOM 0 HA ALA A 38 21.057 -20.459 -15.071 1.00 0.00 H new ATOM 0 HB1 ALA A 38 18.906 -19.317 -15.504 1.00 0.00 H new ATOM 0 HB2 ALA A 38 19.510 -20.158 -16.952 1.00 0.00 H new ATOM 0 HB3 ALA A 38 18.189 -20.870 -15.995 1.00 0.00 H new ATOM 555 N ILE A 39 19.913 -20.155 -12.840 1.00 0.00 N ATOM 556 CA ILE A 39 19.487 -20.158 -11.446 1.00 0.00 C ATOM 557 C ILE A 39 17.966 -20.179 -11.336 1.00 0.00 C ATOM 558 O ILE A 39 17.413 -20.649 -10.342 1.00 0.00 O ATOM 559 CB ILE A 39 20.029 -18.931 -10.690 1.00 0.00 C ATOM 560 CG1 ILE A 39 21.547 -18.833 -10.853 1.00 0.00 C ATOM 561 CG2 ILE A 39 19.653 -19.008 -9.217 1.00 0.00 C ATOM 562 CD1 ILE A 39 22.287 -20.062 -10.373 1.00 0.00 C ATOM 0 H ILE A 39 20.439 -19.327 -13.119 1.00 0.00 H new ATOM 0 HA ILE A 39 19.894 -21.062 -10.993 1.00 0.00 H new ATOM 0 HB ILE A 39 19.579 -18.034 -11.114 1.00 0.00 H new ATOM 0 HG12 ILE A 39 21.781 -18.665 -11.904 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.908 -17.964 -10.303 1.00 0.00 H new ATOM 0 HG21 ILE A 39 20.043 -18.134 -8.696 1.00 0.00 H new ATOM 0 HG22 ILE A 39 18.568 -19.034 -9.119 1.00 0.00 H new ATOM 0 HG23 ILE A 39 20.079 -19.911 -8.780 1.00 0.00 H new ATOM 0 HD11 ILE A 39 23.358 -19.922 -10.519 1.00 0.00 H new ATOM 0 HD12 ILE A 39 22.083 -20.219 -9.314 1.00 0.00 H new ATOM 0 HD13 ILE A 39 21.954 -20.932 -10.940 1.00 0.00 H new ATOM 574 N GLU A 40 17.297 -19.669 -12.364 1.00 0.00 N ATOM 575 CA GLU A 40 15.839 -19.630 -12.383 1.00 0.00 C ATOM 576 C GLU A 40 15.256 -21.036 -12.268 1.00 0.00 C ATOM 577 O GLU A 40 14.193 -21.234 -11.679 1.00 0.00 O ATOM 578 CB GLU A 40 15.340 -18.962 -13.666 1.00 0.00 C ATOM 579 CG GLU A 40 16.045 -17.654 -13.985 1.00 0.00 C ATOM 580 CD GLU A 40 15.213 -16.743 -14.867 1.00 0.00 C ATOM 581 OE1 GLU A 40 14.813 -17.183 -15.965 1.00 0.00 O ATOM 582 OE2 GLU A 40 14.963 -15.590 -14.458 1.00 0.00 O ATOM 0 H GLU A 40 17.740 -19.277 -13.195 1.00 0.00 H new ATOM 0 HA GLU A 40 15.506 -19.045 -11.525 1.00 0.00 H new ATOM 0 HB2 GLU A 40 15.475 -19.651 -14.500 1.00 0.00 H new ATOM 0 HB3 GLU A 40 14.270 -18.776 -13.576 1.00 0.00 H new ATOM 0 HG2 GLU A 40 16.281 -17.137 -13.055 1.00 0.00 H new ATOM 0 HG3 GLU A 40 16.992 -17.867 -14.480 1.00 0.00 H new ATOM 589 N LYS A 41 15.959 -22.009 -12.837 1.00 0.00 N ATOM 590 CA LYS A 41 15.514 -23.397 -12.799 1.00 0.00 C ATOM 591 C LYS A 41 16.181 -24.152 -11.654 1.00 0.00 C ATOM 592 O LYS A 41 15.596 -25.070 -11.078 1.00 0.00 O ATOM 593 CB LYS A 41 15.823 -24.089 -14.129 1.00 0.00 C ATOM 594 CG LYS A 41 15.246 -23.372 -15.337 1.00 0.00 C ATOM 595 CD LYS A 41 16.336 -22.937 -16.301 1.00 0.00 C ATOM 596 CE LYS A 41 16.007 -21.602 -16.950 1.00 0.00 C ATOM 597 NZ LYS A 41 14.797 -21.689 -17.814 1.00 0.00 N ATOM 0 H LYS A 41 16.840 -21.862 -13.330 1.00 0.00 H new ATOM 0 HA LYS A 41 14.436 -23.403 -12.635 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.904 -24.167 -14.246 1.00 0.00 H new ATOM 0 HB3 LYS A 41 15.431 -25.106 -14.099 1.00 0.00 H new ATOM 0 HG2 LYS A 41 14.546 -24.030 -15.851 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.681 -22.500 -15.008 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.284 -22.860 -15.769 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.464 -23.696 -17.073 1.00 0.00 H new ATOM 0 HE2 LYS A 41 15.847 -20.851 -16.176 1.00 0.00 H new ATOM 0 HE3 LYS A 41 16.856 -21.269 -17.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.606 -20.759 -18.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.958 -22.387 -18.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 13.981 -21.982 -17.240 1.00 0.00 H new ATOM 611 N VAL A 42 17.408 -23.758 -11.327 1.00 0.00 N ATOM 612 CA VAL A 42 18.153 -24.396 -10.249 1.00 0.00 C ATOM 613 C VAL A 42 17.390 -24.317 -8.931 1.00 0.00 C ATOM 614 O VAL A 42 17.563 -25.159 -8.050 1.00 0.00 O ATOM 615 CB VAL A 42 19.540 -23.750 -10.066 1.00 0.00 C ATOM 616 CG1 VAL A 42 20.280 -24.393 -8.903 1.00 0.00 C ATOM 617 CG2 VAL A 42 20.350 -23.857 -11.349 1.00 0.00 C ATOM 0 H VAL A 42 17.907 -23.000 -11.793 1.00 0.00 H new ATOM 0 HA VAL A 42 18.281 -25.442 -10.529 1.00 0.00 H new ATOM 0 HB VAL A 42 19.402 -22.693 -9.837 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.257 -23.924 -8.789 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.705 -24.259 -7.987 1.00 0.00 H new ATOM 0 HG13 VAL A 42 20.409 -25.458 -9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 42 21.327 -23.396 -11.202 1.00 0.00 H new ATOM 0 HG22 VAL A 42 20.480 -24.907 -11.611 1.00 0.00 H new ATOM 0 HG23 VAL A 42 19.824 -23.345 -12.155 1.00 0.00 H new ATOM 627 N VAL A 43 16.545 -23.299 -8.804 1.00 0.00 N ATOM 628 CA VAL A 43 15.753 -23.110 -7.595 1.00 0.00 C ATOM 629 C VAL A 43 14.543 -24.038 -7.579 1.00 0.00 C ATOM 630 O VAL A 43 14.016 -24.369 -6.517 1.00 0.00 O ATOM 631 CB VAL A 43 15.270 -21.653 -7.462 1.00 0.00 C ATOM 632 CG1 VAL A 43 16.450 -20.694 -7.503 1.00 0.00 C ATOM 633 CG2 VAL A 43 14.265 -21.323 -8.555 1.00 0.00 C ATOM 0 H VAL A 43 16.391 -22.593 -9.524 1.00 0.00 H new ATOM 0 HA VAL A 43 16.401 -23.349 -6.752 1.00 0.00 H new ATOM 0 HB VAL A 43 14.774 -21.539 -6.498 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.090 -19.670 -7.408 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.129 -20.918 -6.681 1.00 0.00 H new ATOM 0 HG13 VAL A 43 16.978 -20.806 -8.450 1.00 0.00 H new ATOM 0 HG21 VAL A 43 13.935 -20.290 -8.446 1.00 0.00 H new ATOM 0 HG22 VAL A 43 14.733 -21.453 -9.531 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.406 -21.989 -8.473 1.00 0.00 H new ATOM 643 N GLN A 44 14.108 -24.454 -8.764 1.00 0.00 N ATOM 644 CA GLN A 44 12.959 -25.344 -8.886 1.00 0.00 C ATOM 645 C GLN A 44 13.287 -26.732 -8.348 1.00 0.00 C ATOM 646 O GLN A 44 12.472 -27.352 -7.665 1.00 0.00 O ATOM 647 CB GLN A 44 12.517 -25.442 -10.347 1.00 0.00 C ATOM 648 CG GLN A 44 12.046 -24.119 -10.930 1.00 0.00 C ATOM 649 CD GLN A 44 11.019 -24.299 -12.031 1.00 0.00 C ATOM 650 OE1 GLN A 44 10.903 -25.375 -12.617 1.00 0.00 O ATOM 651 NE2 GLN A 44 10.267 -23.242 -12.318 1.00 0.00 N ATOM 0 H GLN A 44 14.533 -24.189 -9.653 1.00 0.00 H new ATOM 0 HA GLN A 44 12.144 -24.928 -8.294 1.00 0.00 H new ATOM 0 HB2 GLN A 44 13.347 -25.818 -10.945 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.711 -26.172 -10.426 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.618 -23.508 -10.135 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.904 -23.574 -11.324 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.397 -22.369 -11.806 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.559 -23.303 -13.050 1.00 0.00 H new ATOM 660 N MET A 45 14.485 -27.215 -8.660 1.00 0.00 N ATOM 661 CA MET A 45 14.921 -28.531 -8.206 1.00 0.00 C ATOM 662 C MET A 45 14.880 -28.622 -6.684 1.00 0.00 C ATOM 663 O MET A 45 15.078 -27.626 -5.986 1.00 0.00 O ATOM 664 CB MET A 45 16.335 -28.825 -8.709 1.00 0.00 C ATOM 665 CG MET A 45 17.416 -28.052 -7.970 1.00 0.00 C ATOM 666 SD MET A 45 18.504 -29.124 -7.012 1.00 0.00 S ATOM 667 CE MET A 45 19.374 -29.981 -8.322 1.00 0.00 C ATOM 0 H MET A 45 15.171 -26.715 -9.225 1.00 0.00 H new ATOM 0 HA MET A 45 14.237 -29.274 -8.615 1.00 0.00 H new ATOM 0 HB2 MET A 45 16.532 -29.893 -8.611 1.00 0.00 H new ATOM 0 HB3 MET A 45 16.391 -28.587 -9.771 1.00 0.00 H new ATOM 0 HG2 MET A 45 18.010 -27.487 -8.689 1.00 0.00 H new ATOM 0 HG3 MET A 45 16.948 -27.327 -7.304 1.00 0.00 H new ATOM 0 HE1 MET A 45 20.111 -30.657 -7.888 1.00 0.00 H new ATOM 0 HE2 MET A 45 18.663 -30.554 -8.917 1.00 0.00 H new ATOM 0 HE3 MET A 45 19.879 -29.255 -8.959 1.00 0.00 H new ATOM 677 N THR A 46 14.622 -29.822 -6.174 1.00 0.00 N ATOM 678 CA THR A 46 14.555 -30.042 -4.735 1.00 0.00 C ATOM 679 C THR A 46 15.793 -30.775 -4.232 1.00 0.00 C ATOM 680 O THR A 46 16.641 -31.193 -5.019 1.00 0.00 O ATOM 681 CB THR A 46 13.301 -30.851 -4.349 1.00 0.00 C ATOM 682 OG1 THR A 46 13.146 -30.863 -2.925 1.00 0.00 O ATOM 683 CG2 THR A 46 13.397 -32.278 -4.866 1.00 0.00 C ATOM 0 H THR A 46 14.456 -30.657 -6.736 1.00 0.00 H new ATOM 0 HA THR A 46 14.504 -29.059 -4.267 1.00 0.00 H new ATOM 0 HB THR A 46 12.433 -30.375 -4.805 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.346 -31.377 -2.687 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.501 -32.829 -4.581 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.486 -32.266 -5.952 1.00 0.00 H new ATOM 0 HG23 THR A 46 14.273 -32.763 -4.435 1.00 0.00 H new ATOM 691 N ASN A 47 15.890 -30.928 -2.915 1.00 0.00 N ATOM 692 CA ASN A 47 17.026 -31.612 -2.307 1.00 0.00 C ATOM 693 C ASN A 47 17.250 -32.976 -2.954 1.00 0.00 C ATOM 694 O ASN A 47 18.386 -33.430 -3.091 1.00 0.00 O ATOM 695 CB ASN A 47 16.802 -31.779 -0.803 1.00 0.00 C ATOM 696 CG ASN A 47 16.437 -30.472 -0.124 1.00 0.00 C ATOM 697 OD1 ASN A 47 17.287 -29.603 0.070 1.00 0.00 O ATOM 698 ND2 ASN A 47 15.168 -30.330 0.241 1.00 0.00 N ATOM 0 H ASN A 47 15.196 -30.588 -2.249 1.00 0.00 H new ATOM 0 HA ASN A 47 17.915 -31.002 -2.470 1.00 0.00 H new ATOM 0 HB2 ASN A 47 16.008 -32.507 -0.635 1.00 0.00 H new ATOM 0 HB3 ASN A 47 17.706 -32.183 -0.346 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.863 -29.473 0.703 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.498 -31.078 0.059 1.00 0.00 H new ATOM 705 N ASP A 48 16.160 -33.623 -3.349 1.00 0.00 N ATOM 706 CA ASP A 48 16.236 -34.934 -3.983 1.00 0.00 C ATOM 707 C ASP A 48 16.996 -34.855 -5.304 1.00 0.00 C ATOM 708 O ASP A 48 17.869 -35.678 -5.579 1.00 0.00 O ATOM 709 CB ASP A 48 14.832 -35.492 -4.220 1.00 0.00 C ATOM 710 CG ASP A 48 13.898 -35.224 -3.056 1.00 0.00 C ATOM 711 OD1 ASP A 48 14.368 -35.256 -1.899 1.00 0.00 O ATOM 712 OD2 ASP A 48 12.699 -34.981 -3.303 1.00 0.00 O ATOM 0 H ASP A 48 15.212 -33.261 -3.241 1.00 0.00 H new ATOM 0 HA ASP A 48 16.776 -35.604 -3.313 1.00 0.00 H new ATOM 0 HB2 ASP A 48 14.416 -35.049 -5.125 1.00 0.00 H new ATOM 0 HB3 ASP A 48 14.895 -36.567 -4.391 1.00 0.00 H new ATOM 717 N ASP A 49 16.655 -33.862 -6.118 1.00 0.00 N ATOM 718 CA ASP A 49 17.305 -33.676 -7.410 1.00 0.00 C ATOM 719 C ASP A 49 18.819 -33.582 -7.249 1.00 0.00 C ATOM 720 O ASP A 49 19.574 -34.008 -8.123 1.00 0.00 O ATOM 721 CB ASP A 49 16.773 -32.416 -8.095 1.00 0.00 C ATOM 722 CG ASP A 49 15.311 -32.539 -8.479 1.00 0.00 C ATOM 723 OD1 ASP A 49 14.704 -33.587 -8.175 1.00 0.00 O ATOM 724 OD2 ASP A 49 14.775 -31.586 -9.082 1.00 0.00 O ATOM 0 H ASP A 49 15.933 -33.174 -5.906 1.00 0.00 H new ATOM 0 HA ASP A 49 17.078 -34.542 -8.031 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.900 -31.563 -7.429 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.364 -32.214 -8.988 1.00 0.00 H new ATOM 729 N VAL A 50 19.256 -33.020 -6.126 1.00 0.00 N ATOM 730 CA VAL A 50 20.679 -32.869 -5.850 1.00 0.00 C ATOM 731 C VAL A 50 21.370 -34.226 -5.770 1.00 0.00 C ATOM 732 O VAL A 50 22.583 -34.330 -5.954 1.00 0.00 O ATOM 733 CB VAL A 50 20.918 -32.105 -4.535 1.00 0.00 C ATOM 734 CG1 VAL A 50 22.407 -31.996 -4.243 1.00 0.00 C ATOM 735 CG2 VAL A 50 20.276 -30.728 -4.595 1.00 0.00 C ATOM 0 H VAL A 50 18.644 -32.662 -5.393 1.00 0.00 H new ATOM 0 HA VAL A 50 21.103 -32.297 -6.675 1.00 0.00 H new ATOM 0 HB VAL A 50 20.453 -32.662 -3.722 1.00 0.00 H new ATOM 0 HG11 VAL A 50 22.556 -31.453 -3.310 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.834 -32.995 -4.154 1.00 0.00 H new ATOM 0 HG13 VAL A 50 22.899 -31.462 -5.056 1.00 0.00 H new ATOM 0 HG21 VAL A 50 20.455 -30.202 -3.657 1.00 0.00 H new ATOM 0 HG22 VAL A 50 20.710 -30.160 -5.418 1.00 0.00 H new ATOM 0 HG23 VAL A 50 19.203 -30.834 -4.753 1.00 0.00 H new ATOM 745 N LYS A 51 20.590 -35.266 -5.495 1.00 0.00 N ATOM 746 CA LYS A 51 21.124 -36.618 -5.392 1.00 0.00 C ATOM 747 C LYS A 51 21.054 -37.335 -6.736 1.00 0.00 C ATOM 748 O LYS A 51 21.784 -38.297 -6.976 1.00 0.00 O ATOM 749 CB LYS A 51 20.353 -37.414 -4.336 1.00 0.00 C ATOM 750 CG LYS A 51 20.397 -36.791 -2.952 1.00 0.00 C ATOM 751 CD LYS A 51 19.832 -37.731 -1.900 1.00 0.00 C ATOM 752 CE LYS A 51 20.697 -38.972 -1.738 1.00 0.00 C ATOM 753 NZ LYS A 51 21.075 -39.204 -0.316 1.00 0.00 N ATOM 0 H LYS A 51 19.584 -35.198 -5.339 1.00 0.00 H new ATOM 0 HA LYS A 51 22.170 -36.547 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.313 -37.507 -4.651 1.00 0.00 H new ATOM 0 HB3 LYS A 51 20.762 -38.423 -4.284 1.00 0.00 H new ATOM 0 HG2 LYS A 51 21.426 -36.537 -2.699 1.00 0.00 H new ATOM 0 HG3 LYS A 51 19.829 -35.860 -2.952 1.00 0.00 H new ATOM 0 HD2 LYS A 51 19.760 -37.209 -0.946 1.00 0.00 H new ATOM 0 HD3 LYS A 51 18.820 -38.025 -2.179 1.00 0.00 H new ATOM 0 HE2 LYS A 51 20.159 -39.841 -2.117 1.00 0.00 H new ATOM 0 HE3 LYS A 51 21.599 -38.867 -2.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 21.692 -40.039 -0.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 21.580 -38.372 0.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 20.217 -39.364 0.250 1.00 0.00 H new ATOM 767 N ARG A 52 20.173 -36.860 -7.610 1.00 0.00 N ATOM 768 CA ARG A 52 20.008 -37.456 -8.930 1.00 0.00 C ATOM 769 C ARG A 52 20.990 -36.848 -9.927 1.00 0.00 C ATOM 770 O ARG A 52 21.490 -37.535 -10.819 1.00 0.00 O ATOM 771 CB ARG A 52 18.574 -37.260 -9.427 1.00 0.00 C ATOM 772 CG ARG A 52 18.308 -37.891 -10.783 1.00 0.00 C ATOM 773 CD ARG A 52 16.818 -38.060 -11.036 1.00 0.00 C ATOM 774 NE ARG A 52 16.427 -39.466 -11.085 1.00 0.00 N ATOM 775 CZ ARG A 52 15.164 -39.877 -11.134 1.00 0.00 C ATOM 776 NH1 ARG A 52 14.176 -38.993 -11.140 1.00 0.00 N ATOM 777 NH2 ARG A 52 14.888 -41.174 -11.176 1.00 0.00 N ATOM 0 H ARG A 52 19.562 -36.064 -7.428 1.00 0.00 H new ATOM 0 HA ARG A 52 20.214 -38.523 -8.847 1.00 0.00 H new ATOM 0 HB2 ARG A 52 17.884 -37.684 -8.697 1.00 0.00 H new ATOM 0 HB3 ARG A 52 18.361 -36.193 -9.484 1.00 0.00 H new ATOM 0 HG2 ARG A 52 18.743 -37.270 -11.566 1.00 0.00 H new ATOM 0 HG3 ARG A 52 18.800 -38.862 -10.836 1.00 0.00 H new ATOM 0 HD2 ARG A 52 16.257 -37.555 -10.249 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.553 -37.577 -11.977 1.00 0.00 H new ATOM 0 HE ARG A 52 17.164 -40.172 -11.081 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.384 -37.995 -11.107 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.208 -39.311 -11.178 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.646 -41.857 -11.171 1.00 0.00 H new ATOM 0 HH22 ARG A 52 13.918 -41.488 -11.214 1.00 0.00 H new ATOM 791 N ILE A 53 21.262 -35.557 -9.770 1.00 0.00 N ATOM 792 CA ILE A 53 22.184 -34.857 -10.656 1.00 0.00 C ATOM 793 C ILE A 53 23.530 -35.571 -10.724 1.00 0.00 C ATOM 794 O ILE A 53 24.240 -35.486 -11.724 1.00 0.00 O ATOM 795 CB ILE A 53 22.410 -33.403 -10.200 1.00 0.00 C ATOM 796 CG1 ILE A 53 22.831 -33.367 -8.729 1.00 0.00 C ATOM 797 CG2 ILE A 53 21.149 -32.579 -10.416 1.00 0.00 C ATOM 798 CD1 ILE A 53 23.361 -32.022 -8.286 1.00 0.00 C ATOM 0 H ILE A 53 20.857 -34.974 -9.037 1.00 0.00 H new ATOM 0 HA ILE A 53 21.727 -34.852 -11.646 1.00 0.00 H new ATOM 0 HB ILE A 53 23.211 -32.970 -10.799 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.976 -33.634 -8.108 1.00 0.00 H new ATOM 0 HG13 ILE A 53 23.597 -34.124 -8.560 1.00 0.00 H new ATOM 0 HG21 ILE A 53 21.324 -31.554 -10.089 1.00 0.00 H new ATOM 0 HG22 ILE A 53 20.889 -32.583 -11.474 1.00 0.00 H new ATOM 0 HG23 ILE A 53 20.330 -33.009 -9.839 1.00 0.00 H new ATOM 0 HD11 ILE A 53 23.640 -32.070 -7.233 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.236 -31.761 -8.882 1.00 0.00 H new ATOM 0 HD13 ILE A 53 22.590 -31.264 -8.423 1.00 0.00 H new ATOM 810 N GLY A 54 23.873 -36.278 -9.651 1.00 0.00 N ATOM 811 CA GLY A 54 25.132 -36.999 -9.609 1.00 0.00 C ATOM 812 C GLY A 54 25.699 -37.096 -8.207 1.00 0.00 C ATOM 813 O GLY A 54 26.177 -38.152 -7.794 1.00 0.00 O ATOM 0 H GLY A 54 23.302 -36.364 -8.811 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.986 -38.003 -10.008 1.00 0.00 H new ATOM 0 HA3 GLY A 54 25.854 -36.501 -10.256 1.00 0.00 H new ATOM 817 N VAL A 55 25.648 -35.989 -7.472 1.00 0.00 N ATOM 818 CA VAL A 55 26.161 -35.953 -6.108 1.00 0.00 C ATOM 819 C VAL A 55 25.576 -37.085 -5.270 1.00 0.00 C ATOM 820 O VAL A 55 24.358 -37.209 -5.140 1.00 0.00 O ATOM 821 CB VAL A 55 25.846 -34.609 -5.425 1.00 0.00 C ATOM 822 CG1 VAL A 55 26.513 -34.534 -4.060 1.00 0.00 C ATOM 823 CG2 VAL A 55 26.284 -33.449 -6.306 1.00 0.00 C ATOM 0 H VAL A 55 25.257 -35.106 -7.799 1.00 0.00 H new ATOM 0 HA VAL A 55 27.242 -36.075 -6.174 1.00 0.00 H new ATOM 0 HB VAL A 55 24.768 -34.539 -5.280 1.00 0.00 H new ATOM 0 HG11 VAL A 55 26.279 -33.577 -3.593 1.00 0.00 H new ATOM 0 HG12 VAL A 55 26.146 -35.345 -3.431 1.00 0.00 H new ATOM 0 HG13 VAL A 55 27.593 -34.626 -4.177 1.00 0.00 H new ATOM 0 HG21 VAL A 55 26.054 -32.507 -5.808 1.00 0.00 H new ATOM 0 HG22 VAL A 55 27.357 -33.513 -6.484 1.00 0.00 H new ATOM 0 HG23 VAL A 55 25.755 -33.495 -7.258 1.00 0.00 H new ATOM 833 N ARG A 56 26.452 -37.909 -4.705 1.00 0.00 N ATOM 834 CA ARG A 56 26.022 -39.032 -3.880 1.00 0.00 C ATOM 835 C ARG A 56 26.545 -38.890 -2.454 1.00 0.00 C ATOM 836 O ARG A 56 26.083 -39.576 -1.541 1.00 0.00 O ATOM 837 CB ARG A 56 26.508 -40.351 -4.484 1.00 0.00 C ATOM 838 CG ARG A 56 27.991 -40.606 -4.277 1.00 0.00 C ATOM 839 CD ARG A 56 28.229 -41.786 -3.347 1.00 0.00 C ATOM 840 NE ARG A 56 28.655 -42.979 -4.075 1.00 0.00 N ATOM 841 CZ ARG A 56 28.908 -44.145 -3.491 1.00 0.00 C ATOM 842 NH1 ARG A 56 28.777 -44.274 -2.178 1.00 0.00 N ATOM 843 NH2 ARG A 56 29.291 -45.184 -4.221 1.00 0.00 N ATOM 0 H ARG A 56 27.463 -37.820 -4.803 1.00 0.00 H new ATOM 0 HA ARG A 56 24.932 -39.033 -3.851 1.00 0.00 H new ATOM 0 HB2 ARG A 56 25.942 -41.172 -4.044 1.00 0.00 H new ATOM 0 HB3 ARG A 56 26.294 -40.352 -5.553 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.466 -40.798 -5.239 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.460 -39.714 -3.862 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.988 -41.520 -2.611 1.00 0.00 H new ATOM 0 HD3 ARG A 56 27.314 -42.004 -2.797 1.00 0.00 H new ATOM 0 HE ARG A 56 28.764 -42.913 -5.087 1.00 0.00 H new ATOM 0 HH11 ARG A 56 28.481 -43.477 -1.614 1.00 0.00 H new ATOM 0 HH12 ARG A 56 28.972 -45.170 -1.732 1.00 0.00 H new ATOM 0 HH21 ARG A 56 29.391 -45.088 -5.231 1.00 0.00 H new ATOM 0 HH22 ARG A 56 29.485 -46.079 -3.772 1.00 0.00 H new ATOM 857 N LEU A 57 27.512 -37.998 -2.270 1.00 0.00 N ATOM 858 CA LEU A 57 28.099 -37.766 -0.954 1.00 0.00 C ATOM 859 C LEU A 57 27.183 -36.901 -0.094 1.00 0.00 C ATOM 860 O LEU A 57 26.368 -36.127 -0.596 1.00 0.00 O ATOM 861 CB LEU A 57 29.467 -37.097 -1.095 1.00 0.00 C ATOM 862 CG LEU A 57 30.627 -38.015 -1.481 1.00 0.00 C ATOM 863 CD1 LEU A 57 31.866 -37.199 -1.816 1.00 0.00 C ATOM 864 CD2 LEU A 57 30.922 -39.002 -0.361 1.00 0.00 C ATOM 0 H LEU A 57 27.906 -37.423 -3.015 1.00 0.00 H new ATOM 0 HA LEU A 57 28.222 -38.731 -0.463 1.00 0.00 H new ATOM 0 HB2 LEU A 57 29.388 -36.310 -1.845 1.00 0.00 H new ATOM 0 HB3 LEU A 57 29.712 -36.614 -0.149 1.00 0.00 H new ATOM 0 HG LEU A 57 30.339 -38.579 -2.368 1.00 0.00 H new ATOM 0 HD11 LEU A 57 32.681 -37.870 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 57 31.649 -36.534 -2.652 1.00 0.00 H new ATOM 0 HD13 LEU A 57 32.158 -36.607 -0.948 1.00 0.00 H new ATOM 0 HD21 LEU A 57 31.750 -39.647 -0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 57 31.189 -38.456 0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 57 30.038 -39.611 -0.170 1.00 0.00 H new ATOM 876 N PRO A 58 27.320 -37.032 1.234 1.00 0.00 N ATOM 877 CA PRO A 58 26.515 -36.269 2.192 1.00 0.00 C ATOM 878 C PRO A 58 26.878 -34.788 2.203 1.00 0.00 C ATOM 879 O PRO A 58 26.004 -33.924 2.126 1.00 0.00 O ATOM 880 CB PRO A 58 26.859 -36.913 3.537 1.00 0.00 C ATOM 881 CG PRO A 58 28.214 -37.501 3.340 1.00 0.00 C ATOM 882 CD PRO A 58 28.271 -37.936 1.902 1.00 0.00 C ATOM 0 HA PRO A 58 25.453 -36.300 1.948 1.00 0.00 H new ATOM 0 HB2 PRO A 58 26.860 -36.176 4.340 1.00 0.00 H new ATOM 0 HB3 PRO A 58 26.131 -37.678 3.807 1.00 0.00 H new ATOM 0 HG2 PRO A 58 28.992 -36.770 3.558 1.00 0.00 H new ATOM 0 HG3 PRO A 58 28.374 -38.346 4.010 1.00 0.00 H new ATOM 0 HD2 PRO A 58 29.276 -37.836 1.492 1.00 0.00 H new ATOM 0 HD3 PRO A 58 27.981 -38.980 1.786 1.00 0.00 H new ATOM 890 N GLY A 59 28.172 -34.500 2.298 1.00 0.00 N ATOM 891 CA GLY A 59 28.627 -33.122 2.317 1.00 0.00 C ATOM 892 C GLY A 59 28.302 -32.387 1.032 1.00 0.00 C ATOM 893 O GLY A 59 27.657 -31.338 1.054 1.00 0.00 O ATOM 0 H GLY A 59 28.914 -35.197 2.362 1.00 0.00 H new ATOM 0 HA2 GLY A 59 28.166 -32.602 3.156 1.00 0.00 H new ATOM 0 HA3 GLY A 59 29.704 -33.100 2.482 1.00 0.00 H new ATOM 897 N HIS A 60 28.749 -32.937 -0.093 1.00 0.00 N ATOM 898 CA HIS A 60 28.503 -32.325 -1.394 1.00 0.00 C ATOM 899 C HIS A 60 27.019 -32.026 -1.581 1.00 0.00 C ATOM 900 O HIS A 60 26.650 -31.085 -2.284 1.00 0.00 O ATOM 901 CB HIS A 60 28.995 -33.242 -2.513 1.00 0.00 C ATOM 902 CG HIS A 60 30.474 -33.477 -2.488 1.00 0.00 C ATOM 903 ND1 HIS A 60 31.144 -34.162 -3.480 1.00 0.00 N ATOM 904 CD2 HIS A 60 31.413 -33.113 -1.584 1.00 0.00 C ATOM 905 CE1 HIS A 60 32.431 -34.210 -3.187 1.00 0.00 C ATOM 906 NE2 HIS A 60 32.621 -33.580 -2.041 1.00 0.00 N ATOM 0 H HIS A 60 29.283 -33.805 -0.130 1.00 0.00 H new ATOM 0 HA HIS A 60 29.053 -31.385 -1.436 1.00 0.00 H new ATOM 0 HB2 HIS A 60 28.482 -34.201 -2.438 1.00 0.00 H new ATOM 0 HB3 HIS A 60 28.721 -32.808 -3.474 1.00 0.00 H new ATOM 0 HD2 HIS A 60 31.244 -32.558 -0.673 1.00 0.00 H new ATOM 0 HE1 HIS A 60 33.198 -34.683 -3.783 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.519 -33.460 -1.572 1.00 0.00 H new ATOM 914 N GLN A 61 26.173 -32.832 -0.948 1.00 0.00 N ATOM 915 CA GLN A 61 24.729 -32.654 -1.046 1.00 0.00 C ATOM 916 C GLN A 61 24.280 -31.414 -0.280 1.00 0.00 C ATOM 917 O GLN A 61 23.713 -30.485 -0.857 1.00 0.00 O ATOM 918 CB GLN A 61 24.003 -33.889 -0.511 1.00 0.00 C ATOM 919 CG GLN A 61 23.788 -34.970 -1.558 1.00 0.00 C ATOM 920 CD GLN A 61 23.200 -36.239 -0.975 1.00 0.00 C ATOM 921 OE1 GLN A 61 22.511 -36.206 0.045 1.00 0.00 O ATOM 922 NE2 GLN A 61 23.469 -37.368 -1.620 1.00 0.00 N ATOM 0 H GLN A 61 26.463 -33.615 -0.362 1.00 0.00 H new ATOM 0 HA GLN A 61 24.476 -32.521 -2.098 1.00 0.00 H new ATOM 0 HB2 GLN A 61 24.575 -34.306 0.317 1.00 0.00 H new ATOM 0 HB3 GLN A 61 23.036 -33.586 -0.110 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.125 -34.591 -2.335 1.00 0.00 H new ATOM 0 HG3 GLN A 61 24.740 -35.202 -2.036 1.00 0.00 H new ATOM 0 HE21 GLN A 61 24.045 -37.350 -2.462 1.00 0.00 H new ATOM 0 HE22 GLN A 61 23.100 -38.254 -1.274 1.00 0.00 H new ATOM 931 N LYS A 62 24.537 -31.405 1.023 1.00 0.00 N ATOM 932 CA LYS A 62 24.161 -30.279 1.870 1.00 0.00 C ATOM 933 C LYS A 62 24.807 -28.988 1.378 1.00 0.00 C ATOM 934 O LYS A 62 24.181 -27.927 1.388 1.00 0.00 O ATOM 935 CB LYS A 62 24.571 -30.546 3.320 1.00 0.00 C ATOM 936 CG LYS A 62 23.454 -31.124 4.172 1.00 0.00 C ATOM 937 CD LYS A 62 23.703 -30.891 5.652 1.00 0.00 C ATOM 938 CE LYS A 62 24.743 -31.855 6.202 1.00 0.00 C ATOM 939 NZ LYS A 62 25.626 -31.204 7.209 1.00 0.00 N ATOM 0 H LYS A 62 25.005 -32.165 1.516 1.00 0.00 H new ATOM 0 HA LYS A 62 23.078 -30.165 1.820 1.00 0.00 H new ATOM 0 HB2 LYS A 62 25.416 -31.234 3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 62 24.914 -29.614 3.769 1.00 0.00 H new ATOM 0 HG2 LYS A 62 22.505 -30.670 3.886 1.00 0.00 H new ATOM 0 HG3 LYS A 62 23.366 -32.194 3.981 1.00 0.00 H new ATOM 0 HD2 LYS A 62 24.038 -29.865 5.808 1.00 0.00 H new ATOM 0 HD3 LYS A 62 22.769 -31.009 6.202 1.00 0.00 H new ATOM 0 HE2 LYS A 62 24.242 -32.709 6.657 1.00 0.00 H new ATOM 0 HE3 LYS A 62 25.350 -32.241 5.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 26.321 -31.894 7.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 26.124 -30.404 6.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 25.051 -30.858 8.003 1.00 0.00 H new ATOM 953 N ARG A 63 26.060 -29.086 0.946 1.00 0.00 N ATOM 954 CA ARG A 63 26.789 -27.925 0.449 1.00 0.00 C ATOM 955 C ARG A 63 25.992 -27.205 -0.634 1.00 0.00 C ATOM 956 O ARG A 63 26.031 -25.978 -0.735 1.00 0.00 O ATOM 957 CB ARG A 63 28.151 -28.350 -0.103 1.00 0.00 C ATOM 958 CG ARG A 63 29.129 -27.198 -0.265 1.00 0.00 C ATOM 959 CD ARG A 63 30.500 -27.548 0.295 1.00 0.00 C ATOM 960 NE ARG A 63 31.153 -26.393 0.903 1.00 0.00 N ATOM 961 CZ ARG A 63 30.839 -25.919 2.104 1.00 0.00 C ATOM 962 NH1 ARG A 63 29.886 -26.498 2.820 1.00 0.00 N ATOM 963 NH2 ARG A 63 31.480 -24.863 2.590 1.00 0.00 N ATOM 0 H ARG A 63 26.591 -29.957 0.930 1.00 0.00 H new ATOM 0 HA ARG A 63 26.940 -27.238 1.282 1.00 0.00 H new ATOM 0 HB2 ARG A 63 28.587 -29.095 0.563 1.00 0.00 H new ATOM 0 HB3 ARG A 63 28.007 -28.832 -1.070 1.00 0.00 H new ATOM 0 HG2 ARG A 63 29.220 -26.943 -1.321 1.00 0.00 H new ATOM 0 HG3 ARG A 63 28.741 -26.316 0.244 1.00 0.00 H new ATOM 0 HD2 ARG A 63 30.397 -28.339 1.038 1.00 0.00 H new ATOM 0 HD3 ARG A 63 31.129 -27.941 -0.504 1.00 0.00 H new ATOM 0 HE ARG A 63 31.891 -25.924 0.377 1.00 0.00 H new ATOM 0 HH11 ARG A 63 29.392 -27.310 2.449 1.00 0.00 H new ATOM 0 HH12 ARG A 63 29.647 -26.132 3.742 1.00 0.00 H new ATOM 0 HH21 ARG A 63 32.214 -24.415 2.041 1.00 0.00 H new ATOM 0 HH22 ARG A 63 31.238 -24.500 3.512 1.00 0.00 H new ATOM 977 N ILE A 64 25.270 -27.975 -1.441 1.00 0.00 N ATOM 978 CA ILE A 64 24.463 -27.409 -2.515 1.00 0.00 C ATOM 979 C ILE A 64 23.057 -27.075 -2.029 1.00 0.00 C ATOM 980 O ILE A 64 22.563 -25.968 -2.244 1.00 0.00 O ATOM 981 CB ILE A 64 24.365 -28.374 -3.712 1.00 0.00 C ATOM 982 CG1 ILE A 64 25.760 -28.695 -4.252 1.00 0.00 C ATOM 983 CG2 ILE A 64 23.492 -27.774 -4.805 1.00 0.00 C ATOM 984 CD1 ILE A 64 25.749 -29.659 -5.418 1.00 0.00 C ATOM 0 H ILE A 64 25.227 -28.992 -1.372 1.00 0.00 H new ATOM 0 HA ILE A 64 24.960 -26.494 -2.836 1.00 0.00 H new ATOM 0 HB ILE A 64 23.905 -29.303 -3.375 1.00 0.00 H new ATOM 0 HG12 ILE A 64 26.243 -27.768 -4.562 1.00 0.00 H new ATOM 0 HG13 ILE A 64 26.364 -29.116 -3.448 1.00 0.00 H new ATOM 0 HG21 ILE A 64 23.432 -28.467 -5.644 1.00 0.00 H new ATOM 0 HG22 ILE A 64 22.492 -27.592 -4.413 1.00 0.00 H new ATOM 0 HG23 ILE A 64 23.926 -26.833 -5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 64 26.771 -29.841 -5.749 1.00 0.00 H new ATOM 0 HD12 ILE A 64 25.295 -30.600 -5.108 1.00 0.00 H new ATOM 0 HD13 ILE A 64 25.173 -29.231 -6.238 1.00 0.00 H new ATOM 996 N ALA A 65 22.419 -28.037 -1.372 1.00 0.00 N ATOM 997 CA ALA A 65 21.072 -27.844 -0.852 1.00 0.00 C ATOM 998 C ALA A 65 20.985 -26.575 -0.010 1.00 0.00 C ATOM 999 O ALA A 65 20.027 -25.810 -0.119 1.00 0.00 O ATOM 1000 CB ALA A 65 20.643 -29.052 -0.033 1.00 0.00 C ATOM 0 H ALA A 65 22.814 -28.959 -1.187 1.00 0.00 H new ATOM 0 HA ALA A 65 20.395 -27.735 -1.699 1.00 0.00 H new ATOM 0 HB1 ALA A 65 19.635 -28.893 0.349 1.00 0.00 H new ATOM 0 HB2 ALA A 65 20.657 -29.942 -0.662 1.00 0.00 H new ATOM 0 HB3 ALA A 65 21.330 -29.188 0.802 1.00 0.00 H new ATOM 1006 N TYR A 66 21.992 -26.358 0.829 1.00 0.00 N ATOM 1007 CA TYR A 66 22.027 -25.183 1.692 1.00 0.00 C ATOM 1008 C TYR A 66 22.153 -23.905 0.868 1.00 0.00 C ATOM 1009 O TYR A 66 21.673 -22.845 1.269 1.00 0.00 O ATOM 1010 CB TYR A 66 23.192 -25.284 2.678 1.00 0.00 C ATOM 1011 CG TYR A 66 23.032 -24.404 3.897 1.00 0.00 C ATOM 1012 CD1 TYR A 66 21.846 -24.394 4.621 1.00 0.00 C ATOM 1013 CD2 TYR A 66 24.068 -23.582 4.325 1.00 0.00 C ATOM 1014 CE1 TYR A 66 21.696 -23.591 5.734 1.00 0.00 C ATOM 1015 CE2 TYR A 66 23.926 -22.776 5.439 1.00 0.00 C ATOM 1016 CZ TYR A 66 22.738 -22.784 6.139 1.00 0.00 C ATOM 1017 OH TYR A 66 22.592 -21.983 7.249 1.00 0.00 O ATOM 0 H TYR A 66 22.794 -26.980 0.930 1.00 0.00 H new ATOM 0 HA TYR A 66 21.090 -25.144 2.248 1.00 0.00 H new ATOM 0 HB2 TYR A 66 23.296 -26.320 3.000 1.00 0.00 H new ATOM 0 HB3 TYR A 66 24.115 -25.015 2.165 1.00 0.00 H new ATOM 0 HD1 TYR A 66 21.028 -25.025 4.308 1.00 0.00 H new ATOM 0 HD2 TYR A 66 24.999 -23.573 3.778 1.00 0.00 H new ATOM 0 HE1 TYR A 66 20.767 -23.595 6.285 1.00 0.00 H new ATOM 0 HE2 TYR A 66 24.741 -22.144 5.759 1.00 0.00 H new ATOM 0 HH TYR A 66 23.419 -21.478 7.399 1.00 0.00 H new ATOM 1027 N SER A 67 22.801 -24.015 -0.287 1.00 0.00 N ATOM 1028 CA SER A 67 22.994 -22.869 -1.168 1.00 0.00 C ATOM 1029 C SER A 67 21.719 -22.564 -1.949 1.00 0.00 C ATOM 1030 O SER A 67 21.484 -21.426 -2.356 1.00 0.00 O ATOM 1031 CB SER A 67 24.149 -23.132 -2.136 1.00 0.00 C ATOM 1032 OG SER A 67 25.069 -22.054 -2.137 1.00 0.00 O ATOM 0 H SER A 67 23.201 -24.886 -0.635 1.00 0.00 H new ATOM 0 HA SER A 67 23.237 -22.004 -0.551 1.00 0.00 H new ATOM 0 HB2 SER A 67 24.662 -24.052 -1.854 1.00 0.00 H new ATOM 0 HB3 SER A 67 23.758 -23.281 -3.142 1.00 0.00 H new ATOM 0 HG SER A 67 25.708 -22.170 -2.871 1.00 0.00 H new ATOM 1038 N LEU A 68 20.900 -23.589 -2.154 1.00 0.00 N ATOM 1039 CA LEU A 68 19.648 -23.433 -2.887 1.00 0.00 C ATOM 1040 C LEU A 68 18.628 -22.654 -2.062 1.00 0.00 C ATOM 1041 O LEU A 68 17.839 -21.878 -2.602 1.00 0.00 O ATOM 1042 CB LEU A 68 19.079 -24.802 -3.262 1.00 0.00 C ATOM 1043 CG LEU A 68 19.763 -25.517 -4.428 1.00 0.00 C ATOM 1044 CD1 LEU A 68 19.295 -26.961 -4.517 1.00 0.00 C ATOM 1045 CD2 LEU A 68 19.492 -24.785 -5.734 1.00 0.00 C ATOM 0 H LEU A 68 21.080 -24.537 -1.823 1.00 0.00 H new ATOM 0 HA LEU A 68 19.856 -22.872 -3.798 1.00 0.00 H new ATOM 0 HB2 LEU A 68 19.131 -25.447 -2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 68 18.024 -24.680 -3.506 1.00 0.00 H new ATOM 0 HG LEU A 68 20.838 -25.516 -4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 68 19.792 -27.454 -5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 68 19.540 -27.481 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 68 18.216 -26.985 -4.672 1.00 0.00 H new ATOM 0 HD21 LEU A 68 19.986 -25.307 -6.553 1.00 0.00 H new ATOM 0 HD22 LEU A 68 18.418 -24.755 -5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 68 19.877 -23.768 -5.668 1.00 0.00 H new ATOM 1057 N LEU A 69 18.651 -22.865 -0.751 1.00 0.00 N ATOM 1058 CA LEU A 69 17.729 -22.181 0.150 1.00 0.00 C ATOM 1059 C LEU A 69 17.765 -20.673 -0.076 1.00 0.00 C ATOM 1060 O LEU A 69 16.742 -19.997 0.020 1.00 0.00 O ATOM 1061 CB LEU A 69 18.079 -22.498 1.606 1.00 0.00 C ATOM 1062 CG LEU A 69 18.276 -23.977 1.942 1.00 0.00 C ATOM 1063 CD1 LEU A 69 18.492 -24.160 3.436 1.00 0.00 C ATOM 1064 CD2 LEU A 69 17.083 -24.795 1.469 1.00 0.00 C ATOM 0 H LEU A 69 19.297 -23.504 -0.288 1.00 0.00 H new ATOM 0 HA LEU A 69 16.721 -22.538 -0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 69 18.993 -21.963 1.864 1.00 0.00 H new ATOM 0 HB3 LEU A 69 17.288 -22.103 2.243 1.00 0.00 H new ATOM 0 HG LEU A 69 19.165 -24.333 1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 69 18.630 -25.218 3.657 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.378 -23.606 3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 69 17.623 -23.787 3.978 1.00 0.00 H new ATOM 0 HD21 LEU A 69 17.241 -25.845 1.716 1.00 0.00 H new ATOM 0 HD22 LEU A 69 16.179 -24.438 1.962 1.00 0.00 H new ATOM 0 HD23 LEU A 69 16.974 -24.689 0.390 1.00 0.00 H new ATOM 1076 N GLY A 70 18.950 -20.153 -0.380 1.00 0.00 N ATOM 1077 CA GLY A 70 19.097 -18.729 -0.617 1.00 0.00 C ATOM 1078 C GLY A 70 18.546 -18.307 -1.965 1.00 0.00 C ATOM 1079 O GLY A 70 18.051 -17.189 -2.119 1.00 0.00 O ATOM 0 H GLY A 70 19.811 -20.693 -0.466 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.584 -18.178 0.171 1.00 0.00 H new ATOM 0 HA3 GLY A 70 20.152 -18.461 -0.559 1.00 0.00 H new ATOM 1083 N LEU A 71 18.633 -19.200 -2.944 1.00 0.00 N ATOM 1084 CA LEU A 71 18.141 -18.913 -4.287 1.00 0.00 C ATOM 1085 C LEU A 71 16.616 -18.895 -4.316 1.00 0.00 C ATOM 1086 O LEU A 71 16.007 -18.193 -5.123 1.00 0.00 O ATOM 1087 CB LEU A 71 18.668 -19.953 -5.278 1.00 0.00 C ATOM 1088 CG LEU A 71 20.164 -20.259 -5.196 1.00 0.00 C ATOM 1089 CD1 LEU A 71 20.485 -21.550 -5.932 1.00 0.00 C ATOM 1090 CD2 LEU A 71 20.977 -19.104 -5.761 1.00 0.00 C ATOM 0 H LEU A 71 19.040 -20.129 -2.833 1.00 0.00 H new ATOM 0 HA LEU A 71 18.504 -17.927 -4.577 1.00 0.00 H new ATOM 0 HB2 LEU A 71 18.118 -20.882 -5.126 1.00 0.00 H new ATOM 0 HB3 LEU A 71 18.442 -19.611 -6.288 1.00 0.00 H new ATOM 0 HG LEU A 71 20.432 -20.386 -4.147 1.00 0.00 H new ATOM 0 HD11 LEU A 71 21.554 -21.752 -5.863 1.00 0.00 H new ATOM 0 HD12 LEU A 71 19.930 -22.373 -5.482 1.00 0.00 H new ATOM 0 HD13 LEU A 71 20.201 -21.452 -6.980 1.00 0.00 H new ATOM 0 HD21 LEU A 71 22.039 -19.340 -5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 71 20.706 -18.944 -6.805 1.00 0.00 H new ATOM 0 HD23 LEU A 71 20.770 -18.199 -5.190 1.00 0.00 H new ATOM 1102 N LYS A 72 16.003 -19.671 -3.427 1.00 0.00 N ATOM 1103 CA LYS A 72 14.549 -19.742 -3.347 1.00 0.00 C ATOM 1104 C LYS A 72 14.005 -18.691 -2.384 1.00 0.00 C ATOM 1105 O LYS A 72 12.805 -18.416 -2.364 1.00 0.00 O ATOM 1106 CB LYS A 72 14.111 -21.137 -2.896 1.00 0.00 C ATOM 1107 CG LYS A 72 14.499 -22.240 -3.867 1.00 0.00 C ATOM 1108 CD LYS A 72 14.210 -23.616 -3.291 1.00 0.00 C ATOM 1109 CE LYS A 72 15.453 -24.493 -3.295 1.00 0.00 C ATOM 1110 NZ LYS A 72 15.149 -25.883 -3.736 1.00 0.00 N ATOM 0 H LYS A 72 16.491 -20.259 -2.752 1.00 0.00 H new ATOM 0 HA LYS A 72 14.145 -19.544 -4.340 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.552 -21.350 -1.922 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.029 -21.144 -2.764 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.952 -22.113 -4.801 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.560 -22.160 -4.106 1.00 0.00 H new ATOM 0 HD2 LYS A 72 13.838 -23.514 -2.271 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.422 -24.097 -3.871 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.202 -24.058 -3.956 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.885 -24.516 -2.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.749 -26.552 -3.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.148 -26.096 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.337 -25.973 -4.755 1.00 0.00 H new ATOM 1124 N ASP A 73 14.895 -18.107 -1.589 1.00 0.00 N ATOM 1125 CA ASP A 73 14.504 -17.084 -0.626 1.00 0.00 C ATOM 1126 C ASP A 73 14.767 -15.687 -1.179 1.00 0.00 C ATOM 1127 O ASP A 73 14.005 -14.755 -0.923 1.00 0.00 O ATOM 1128 CB ASP A 73 15.261 -17.276 0.689 1.00 0.00 C ATOM 1129 CG ASP A 73 14.522 -16.686 1.874 1.00 0.00 C ATOM 1130 OD1 ASP A 73 14.536 -15.446 2.025 1.00 0.00 O ATOM 1131 OD2 ASP A 73 13.930 -17.464 2.651 1.00 0.00 O ATOM 0 H ASP A 73 15.892 -18.324 -1.592 1.00 0.00 H new ATOM 0 HA ASP A 73 13.435 -17.186 -0.440 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.424 -18.340 0.859 1.00 0.00 H new ATOM 0 HB3 ASP A 73 16.244 -16.812 0.610 1.00 0.00 H new ATOM 1136 N GLN A 74 15.850 -15.551 -1.938 1.00 0.00 N ATOM 1137 CA GLN A 74 16.214 -14.267 -2.525 1.00 0.00 C ATOM 1138 C GLN A 74 15.039 -13.666 -3.290 1.00 0.00 C ATOM 1139 O GLN A 74 14.879 -12.447 -3.345 1.00 0.00 O ATOM 1140 CB GLN A 74 17.415 -14.431 -3.458 1.00 0.00 C ATOM 1141 CG GLN A 74 17.064 -15.062 -4.796 1.00 0.00 C ATOM 1142 CD GLN A 74 18.262 -15.179 -5.718 1.00 0.00 C ATOM 1143 OE1 GLN A 74 18.584 -16.265 -6.202 1.00 0.00 O ATOM 1144 NE2 GLN A 74 18.929 -14.058 -5.967 1.00 0.00 N ATOM 0 H GLN A 74 16.490 -16.314 -2.161 1.00 0.00 H new ATOM 0 HA GLN A 74 16.482 -13.588 -1.715 1.00 0.00 H new ATOM 0 HB2 GLN A 74 17.864 -13.454 -3.633 1.00 0.00 H new ATOM 0 HB3 GLN A 74 18.168 -15.044 -2.963 1.00 0.00 H new ATOM 0 HG2 GLN A 74 16.642 -16.053 -4.627 1.00 0.00 H new ATOM 0 HG3 GLN A 74 16.292 -14.466 -5.283 1.00 0.00 H new ATOM 0 HE21 GLN A 74 18.627 -13.180 -5.544 1.00 0.00 H new ATOM 0 HE22 GLN A 74 19.743 -14.075 -6.581 1.00 0.00 H new ATOM 1153 N VAL A 75 14.219 -14.530 -3.881 1.00 0.00 N ATOM 1154 CA VAL A 75 13.058 -14.085 -4.642 1.00 0.00 C ATOM 1155 C VAL A 75 12.095 -13.296 -3.763 1.00 0.00 C ATOM 1156 O VAL A 75 11.446 -12.357 -4.223 1.00 0.00 O ATOM 1157 CB VAL A 75 12.308 -15.275 -5.268 1.00 0.00 C ATOM 1158 CG1 VAL A 75 11.894 -16.271 -4.195 1.00 0.00 C ATOM 1159 CG2 VAL A 75 11.097 -14.789 -6.051 1.00 0.00 C ATOM 0 H VAL A 75 14.338 -15.542 -3.847 1.00 0.00 H new ATOM 0 HA VAL A 75 13.429 -13.440 -5.439 1.00 0.00 H new ATOM 0 HB VAL A 75 12.981 -15.782 -5.960 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.365 -17.105 -4.657 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.781 -16.643 -3.682 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.239 -15.780 -3.476 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.579 -15.643 -6.487 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.421 -14.257 -5.382 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.423 -14.118 -6.846 1.00 0.00 H new ATOM 1169 N ASN A 76 12.006 -13.684 -2.495 1.00 0.00 N ATOM 1170 CA ASN A 76 11.121 -13.012 -1.550 1.00 0.00 C ATOM 1171 C ASN A 76 11.896 -12.527 -0.329 1.00 0.00 C ATOM 1172 O ASN A 76 11.634 -12.953 0.796 1.00 0.00 O ATOM 1173 CB ASN A 76 9.997 -13.954 -1.114 1.00 0.00 C ATOM 1174 CG ASN A 76 8.818 -13.929 -2.068 1.00 0.00 C ATOM 1175 OD1 ASN A 76 8.799 -13.158 -3.028 1.00 0.00 O ATOM 1176 ND2 ASN A 76 7.827 -14.773 -1.807 1.00 0.00 N ATOM 0 H ASN A 76 12.536 -14.460 -2.098 1.00 0.00 H new ATOM 0 HA ASN A 76 10.687 -12.146 -2.050 1.00 0.00 H new ATOM 0 HB2 ASN A 76 10.384 -14.971 -1.046 1.00 0.00 H new ATOM 0 HB3 ASN A 76 9.659 -13.675 -0.116 1.00 0.00 H new ATOM 0 HD21 ASN A 76 7.007 -14.800 -2.413 1.00 0.00 H new ATOM 0 HD22 ASN A 76 7.885 -15.394 -1.000 1.00 0.00 H new ATOM 1183 N THR A 77 12.852 -11.632 -0.558 1.00 0.00 N ATOM 1184 CA THR A 77 13.666 -11.089 0.522 1.00 0.00 C ATOM 1185 C THR A 77 12.863 -10.118 1.380 1.00 0.00 C ATOM 1186 O THR A 77 11.975 -9.424 0.884 1.00 0.00 O ATOM 1187 CB THR A 77 14.912 -10.366 -0.023 1.00 0.00 C ATOM 1188 OG1 THR A 77 15.792 -10.028 1.055 1.00 0.00 O ATOM 1189 CG2 THR A 77 14.520 -9.106 -0.779 1.00 0.00 C ATOM 0 H THR A 77 13.081 -11.268 -1.483 1.00 0.00 H new ATOM 0 HA THR A 77 13.984 -11.933 1.134 1.00 0.00 H new ATOM 0 HB THR A 77 15.423 -11.039 -0.712 1.00 0.00 H new ATOM 0 HG1 THR A 77 16.583 -9.570 0.701 1.00 0.00 H new ATOM 0 HG21 THR A 77 15.417 -8.613 -1.154 1.00 0.00 H new ATOM 0 HG22 THR A 77 13.874 -9.370 -1.616 1.00 0.00 H new ATOM 0 HG23 THR A 77 13.988 -8.430 -0.109 1.00 0.00 H new ATOM 1197 N VAL A 78 13.181 -10.072 2.670 1.00 0.00 N ATOM 1198 CA VAL A 78 12.491 -9.184 3.597 1.00 0.00 C ATOM 1199 C VAL A 78 13.114 -7.792 3.592 1.00 0.00 C ATOM 1200 O VAL A 78 12.432 -6.795 3.822 1.00 0.00 O ATOM 1201 CB VAL A 78 12.517 -9.741 5.033 1.00 0.00 C ATOM 1202 CG1 VAL A 78 11.867 -11.115 5.084 1.00 0.00 C ATOM 1203 CG2 VAL A 78 13.944 -9.797 5.556 1.00 0.00 C ATOM 0 H VAL A 78 13.913 -10.640 3.097 1.00 0.00 H new ATOM 0 HA VAL A 78 11.457 -9.117 3.260 1.00 0.00 H new ATOM 0 HB VAL A 78 11.945 -9.071 5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 78 11.894 -11.493 6.106 1.00 0.00 H new ATOM 0 HG12 VAL A 78 10.831 -11.040 4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 78 12.409 -11.798 4.430 1.00 0.00 H new ATOM 0 HG21 VAL A 78 13.944 -10.193 6.572 1.00 0.00 H new ATOM 0 HG22 VAL A 78 14.542 -10.444 4.914 1.00 0.00 H new ATOM 0 HG23 VAL A 78 14.371 -8.794 5.558 1.00 0.00 H new ATOM 1213 N GLY A 79 14.416 -7.733 3.326 1.00 0.00 N ATOM 1214 CA GLY A 79 15.109 -6.459 3.295 1.00 0.00 C ATOM 1215 C GLY A 79 14.988 -5.765 1.953 1.00 0.00 C ATOM 1216 O GLY A 79 15.833 -5.945 1.076 1.00 0.00 O ATOM 0 H GLY A 79 15.002 -8.545 3.132 1.00 0.00 H new ATOM 0 HA2 GLY A 79 14.706 -5.811 4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.163 -6.616 3.525 1.00 0.00 H new ATOM 1220 N ILE A 80 13.934 -4.972 1.792 1.00 0.00 N ATOM 1221 CA ILE A 80 13.706 -4.250 0.547 1.00 0.00 C ATOM 1222 C ILE A 80 13.961 -2.757 0.722 1.00 0.00 C ATOM 1223 O ILE A 80 13.825 -2.203 1.813 1.00 0.00 O ATOM 1224 CB ILE A 80 12.270 -4.457 0.031 1.00 0.00 C ATOM 1225 CG1 ILE A 80 11.258 -4.152 1.138 1.00 0.00 C ATOM 1226 CG2 ILE A 80 12.090 -5.879 -0.481 1.00 0.00 C ATOM 1227 CD1 ILE A 80 10.180 -3.177 0.719 1.00 0.00 C ATOM 0 H ILE A 80 13.225 -4.813 2.508 1.00 0.00 H new ATOM 0 HA ILE A 80 14.408 -4.653 -0.184 1.00 0.00 H new ATOM 0 HB ILE A 80 12.095 -3.769 -0.796 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.790 -5.083 1.458 1.00 0.00 H new ATOM 0 HG13 ILE A 80 11.787 -3.748 2.001 1.00 0.00 H new ATOM 0 HG21 ILE A 80 11.070 -6.009 -0.842 1.00 0.00 H new ATOM 0 HG22 ILE A 80 12.790 -6.064 -1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.281 -6.584 0.328 1.00 0.00 H new ATOM 0 HD11 ILE A 80 9.499 -3.008 1.553 1.00 0.00 H new ATOM 0 HD12 ILE A 80 10.638 -2.232 0.427 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.626 -3.588 -0.125 1.00 0.00 H new ATOM 1239 N PRO A 81 14.337 -2.088 -0.377 1.00 0.00 N ATOM 1240 CA PRO A 81 14.616 -0.648 -0.371 1.00 0.00 C ATOM 1241 C PRO A 81 13.355 0.186 -0.176 1.00 0.00 C ATOM 1242 O PRO A 81 12.464 0.188 -1.026 1.00 0.00 O ATOM 1243 CB PRO A 81 15.214 -0.397 -1.758 1.00 0.00 C ATOM 1244 CG PRO A 81 14.664 -1.487 -2.611 1.00 0.00 C ATOM 1245 CD PRO A 81 14.519 -2.684 -1.711 1.00 0.00 C ATOM 0 HA PRO A 81 15.274 -0.364 0.450 1.00 0.00 H new ATOM 0 HB2 PRO A 81 14.932 0.584 -2.139 1.00 0.00 H new ATOM 0 HB3 PRO A 81 16.303 -0.427 -1.731 1.00 0.00 H new ATOM 0 HG2 PRO A 81 13.703 -1.201 -3.038 1.00 0.00 H new ATOM 0 HG3 PRO A 81 15.331 -1.704 -3.445 1.00 0.00 H new ATOM 0 HD2 PRO A 81 13.666 -3.300 -1.996 1.00 0.00 H new ATOM 0 HD3 PRO A 81 15.401 -3.324 -1.748 1.00 0.00 H new ATOM 1253 N ILE A 82 13.287 0.893 0.947 1.00 0.00 N ATOM 1254 CA ILE A 82 12.135 1.732 1.252 1.00 0.00 C ATOM 1255 C ILE A 82 11.972 2.839 0.216 1.00 0.00 C ATOM 1256 O ILE A 82 10.880 3.057 -0.308 1.00 0.00 O ATOM 1257 CB ILE A 82 12.254 2.367 2.650 1.00 0.00 C ATOM 1258 CG1 ILE A 82 12.482 1.284 3.707 1.00 0.00 C ATOM 1259 CG2 ILE A 82 11.007 3.176 2.973 1.00 0.00 C ATOM 1260 CD1 ILE A 82 12.627 1.831 5.110 1.00 0.00 C ATOM 0 H ILE A 82 14.016 0.901 1.660 1.00 0.00 H new ATOM 0 HA ILE A 82 11.259 1.084 1.230 1.00 0.00 H new ATOM 0 HB ILE A 82 13.111 3.041 2.655 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.648 0.583 3.683 1.00 0.00 H new ATOM 0 HG13 ILE A 82 13.379 0.720 3.451 1.00 0.00 H new ATOM 0 HG21 ILE A 82 11.107 3.618 3.964 1.00 0.00 H new ATOM 0 HG22 ILE A 82 10.885 3.967 2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 82 10.134 2.523 2.953 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.786 1.008 5.807 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.479 2.510 5.150 1.00 0.00 H new ATOM 0 HD13 ILE A 82 11.721 2.370 5.386 1.00 0.00 H new ATOM 1272 N SER A 83 13.066 3.535 -0.076 1.00 0.00 N ATOM 1273 CA SER A 83 13.045 4.622 -1.048 1.00 0.00 C ATOM 1274 C SER A 83 12.752 4.092 -2.448 1.00 0.00 C ATOM 1275 O SER A 83 12.642 2.885 -2.657 1.00 0.00 O ATOM 1276 CB SER A 83 14.381 5.367 -1.041 1.00 0.00 C ATOM 1277 OG SER A 83 15.458 4.485 -1.311 1.00 0.00 O ATOM 0 H SER A 83 13.979 3.365 0.347 1.00 0.00 H new ATOM 0 HA SER A 83 12.251 5.313 -0.766 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.362 6.162 -1.787 1.00 0.00 H new ATOM 0 HB3 SER A 83 14.531 5.843 -0.072 1.00 0.00 H new ATOM 0 HG SER A 83 16.301 4.985 -1.303 1.00 0.00 H new ATOM 1283 N GLY A 84 12.626 5.006 -3.406 1.00 0.00 N ATOM 1284 CA GLY A 84 12.347 4.613 -4.775 1.00 0.00 C ATOM 1285 C GLY A 84 12.969 5.555 -5.787 1.00 0.00 C ATOM 1286 O GLY A 84 12.275 6.273 -6.506 1.00 0.00 O ATOM 0 H GLY A 84 12.712 6.012 -3.258 1.00 0.00 H new ATOM 0 HA2 GLY A 84 12.723 3.604 -4.944 1.00 0.00 H new ATOM 0 HA3 GLY A 84 11.268 4.581 -4.928 1.00 0.00 H new ATOM 1290 N PRO A 85 14.309 5.561 -5.850 1.00 0.00 N ATOM 1291 CA PRO A 85 15.053 6.418 -6.777 1.00 0.00 C ATOM 1292 C PRO A 85 14.889 5.982 -8.229 1.00 0.00 C ATOM 1293 O PRO A 85 15.134 6.759 -9.152 1.00 0.00 O ATOM 1294 CB PRO A 85 16.507 6.246 -6.329 1.00 0.00 C ATOM 1295 CG PRO A 85 16.545 4.911 -5.669 1.00 0.00 C ATOM 1296 CD PRO A 85 15.200 4.730 -5.022 1.00 0.00 C ATOM 0 HA PRO A 85 14.702 7.450 -6.749 1.00 0.00 H new ATOM 0 HB2 PRO A 85 17.190 6.288 -7.177 1.00 0.00 H new ATOM 0 HB3 PRO A 85 16.805 7.037 -5.640 1.00 0.00 H new ATOM 0 HG2 PRO A 85 16.738 4.122 -6.396 1.00 0.00 H new ATOM 0 HG3 PRO A 85 17.344 4.864 -4.929 1.00 0.00 H new ATOM 0 HD2 PRO A 85 14.891 3.685 -5.023 1.00 0.00 H new ATOM 0 HD3 PRO A 85 15.206 5.059 -3.983 1.00 0.00 H new ATOM 1304 N SER A 86 14.472 4.735 -8.424 1.00 0.00 N ATOM 1305 CA SER A 86 14.278 4.195 -9.765 1.00 0.00 C ATOM 1306 C SER A 86 12.792 4.071 -10.091 1.00 0.00 C ATOM 1307 O SER A 86 12.375 4.286 -11.229 1.00 0.00 O ATOM 1308 CB SER A 86 14.955 2.829 -9.890 1.00 0.00 C ATOM 1309 OG SER A 86 14.627 2.208 -11.122 1.00 0.00 O ATOM 0 H SER A 86 14.262 4.080 -7.671 1.00 0.00 H new ATOM 0 HA SER A 86 14.732 4.884 -10.477 1.00 0.00 H new ATOM 0 HB2 SER A 86 16.036 2.947 -9.815 1.00 0.00 H new ATOM 0 HB3 SER A 86 14.646 2.189 -9.063 1.00 0.00 H new ATOM 0 HG SER A 86 15.073 1.337 -11.178 1.00 0.00 H new ATOM 1315 N SER A 87 11.999 3.723 -9.083 1.00 0.00 N ATOM 1316 CA SER A 87 10.560 3.566 -9.261 1.00 0.00 C ATOM 1317 C SER A 87 9.903 4.905 -9.578 1.00 0.00 C ATOM 1318 O SER A 87 9.689 5.730 -8.691 1.00 0.00 O ATOM 1319 CB SER A 87 9.932 2.961 -8.004 1.00 0.00 C ATOM 1320 OG SER A 87 9.809 1.554 -8.122 1.00 0.00 O ATOM 0 H SER A 87 12.328 3.544 -8.134 1.00 0.00 H new ATOM 0 HA SER A 87 10.394 2.892 -10.101 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.543 3.204 -7.135 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.950 3.402 -7.836 1.00 0.00 H new ATOM 0 HG SER A 87 9.407 1.191 -7.305 1.00 0.00 H new ATOM 1326 N GLY A 88 9.585 5.115 -10.852 1.00 0.00 N ATOM 1327 CA GLY A 88 8.955 6.356 -11.265 1.00 0.00 C ATOM 1328 C GLY A 88 7.459 6.211 -11.456 1.00 0.00 C ATOM 1329 O GLY A 88 6.887 5.162 -11.159 1.00 0.00 O ATOM 0 H GLY A 88 9.752 4.448 -11.605 1.00 0.00 H new ATOM 0 HA2 GLY A 88 9.150 7.125 -10.518 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.406 6.696 -12.197 1.00 0.00 H new TER 1333 GLY A 88