USER MOD reduce.3.24.130724 H: found=0, std=0, add=670, rem=0, adj=25 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+ -177:sc= -0.0586 (180deg=0) USER MOD Set 1.2: A 61 GLN : amide:sc= -2.15 K(o=-2.2,f=-2.7) USER MOD Set 2.1: A 46 THR OG1 : rot 180:sc= -0.175 USER MOD Set 2.2: A 47 ASN : amide:sc= 0.406 K(o=0.23,f=-2.8!) USER MOD Set 3.1: A 24 MET CE :methyl -141:sc= -1.22 (180deg=-0.0187) USER MOD Set 3.2: A 27 TYR OH : rot 180:sc= 1.29 USER MOD Set 3.3: A 60 HIS : no HD1:sc= -0.339 K(o=-0.28,f=-9.7!) 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= 0.0164 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0.031 USER MOD Single : A 14 THR OG1 : rot 150:sc= -0.883 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -85:sc= 0.759 USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0665) USER MOD Single : A 25 GLN : amide:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 26 GLN : amide:sc= -0.0231 X(o=-0.023,f=-0.15) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.9 USER MOD Single : A 30 HIS : no HD1:sc= -0.211 X(o=-0.21,f=-0.59) USER MOD Single : A 32 MET CE :methyl -109:sc= -0.0629 (180deg=-0.948) USER MOD Single : A 36 TYR OH : rot -67:sc= 0.528 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00142) USER MOD Single : A 44 GLN : amide:sc= -0.0466 X(o=-0.047,f=-0.25) USER MOD Single : A 45 MET CE :methyl 163:sc= -1.52 (180deg=-3.1) 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 -117:sc= 0.0581 USER MOD Single : A 72 LYS NZ :NH3+ -179:sc= 0.153 (180deg=0.153) USER MOD Single : A 74 GLN : amide:sc= -1.17 X(o=-1.2,f=-1.7) USER MOD Single : A 76 ASN : amide:sc= -0.0648 K(o=-0.065,f=-0.79) USER MOD Single : A 77 THR OG1 : rot 88:sc= 0.652 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 -4.150 -16.901 -13.966 1.00 0.00 N ATOM 2 CA GLY A 1 -3.383 -16.738 -12.745 1.00 0.00 C ATOM 3 C GLY A 1 -2.253 -15.741 -12.898 1.00 0.00 C ATOM 4 O GLY A 1 -1.133 -16.111 -13.250 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.910 -17.593 -13.809 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.565 -15.987 -14.240 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.526 -17.240 -14.726 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.046 -16.410 -11.944 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.974 -17.703 -12.445 1.00 0.00 H new ATOM 8 N SER A 2 -2.546 -14.471 -12.636 1.00 0.00 N ATOM 9 CA SER A 2 -1.547 -13.416 -12.753 1.00 0.00 C ATOM 10 C SER A 2 -1.227 -12.817 -11.387 1.00 0.00 C ATOM 11 O SER A 2 -1.111 -11.600 -11.241 1.00 0.00 O ATOM 12 CB SER A 2 -2.040 -12.320 -13.700 1.00 0.00 C ATOM 13 OG SER A 2 -2.643 -12.877 -14.855 1.00 0.00 O ATOM 0 H SER A 2 -3.468 -14.148 -12.341 1.00 0.00 H new ATOM 0 HA SER A 2 -0.636 -13.856 -13.160 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.758 -11.684 -13.182 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.204 -11.685 -13.993 1.00 0.00 H new ATOM 0 HG SER A 2 -2.951 -12.156 -15.443 1.00 0.00 H new ATOM 19 N SER A 3 -1.086 -13.682 -10.387 1.00 0.00 N ATOM 20 CA SER A 3 -0.783 -13.239 -9.031 1.00 0.00 C ATOM 21 C SER A 3 0.695 -13.441 -8.711 1.00 0.00 C ATOM 22 O SER A 3 1.408 -12.490 -8.393 1.00 0.00 O ATOM 23 CB SER A 3 -1.644 -14.000 -8.020 1.00 0.00 C ATOM 24 OG SER A 3 -1.935 -15.308 -8.480 1.00 0.00 O ATOM 0 H SER A 3 -1.177 -14.693 -10.490 1.00 0.00 H new ATOM 0 HA SER A 3 -1.009 -12.175 -8.963 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.124 -14.055 -7.063 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.573 -13.457 -7.847 1.00 0.00 H new ATOM 0 HG SER A 3 -2.485 -15.774 -7.816 1.00 0.00 H new ATOM 30 N GLY A 4 1.148 -14.688 -8.797 1.00 0.00 N ATOM 31 CA GLY A 4 2.538 -14.993 -8.513 1.00 0.00 C ATOM 32 C GLY A 4 3.464 -14.577 -9.639 1.00 0.00 C ATOM 33 O GLY A 4 3.061 -14.538 -10.801 1.00 0.00 O ATOM 0 H GLY A 4 0.577 -15.492 -9.058 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.837 -14.488 -7.595 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.643 -16.063 -8.337 1.00 0.00 H new ATOM 37 N SER A 5 4.708 -14.262 -9.293 1.00 0.00 N ATOM 38 CA SER A 5 5.693 -13.840 -10.283 1.00 0.00 C ATOM 39 C SER A 5 7.111 -14.107 -9.786 1.00 0.00 C ATOM 40 O SER A 5 7.319 -14.441 -8.620 1.00 0.00 O ATOM 41 CB SER A 5 5.523 -12.353 -10.601 1.00 0.00 C ATOM 42 OG SER A 5 5.083 -12.164 -11.934 1.00 0.00 O ATOM 0 H SER A 5 5.058 -14.291 -8.335 1.00 0.00 H new ATOM 0 HA SER A 5 5.530 -14.419 -11.192 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.804 -11.910 -9.911 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.470 -11.835 -10.450 1.00 0.00 H new ATOM 0 HG SER A 5 4.980 -11.206 -12.112 1.00 0.00 H new ATOM 48 N SER A 6 8.082 -13.957 -10.681 1.00 0.00 N ATOM 49 CA SER A 6 9.481 -14.185 -10.336 1.00 0.00 C ATOM 50 C SER A 6 10.227 -12.863 -10.192 1.00 0.00 C ATOM 51 O SER A 6 10.886 -12.616 -9.182 1.00 0.00 O ATOM 52 CB SER A 6 10.156 -15.051 -11.401 1.00 0.00 C ATOM 53 OG SER A 6 9.439 -15.007 -12.623 1.00 0.00 O ATOM 0 H SER A 6 7.926 -13.679 -11.650 1.00 0.00 H new ATOM 0 HA SER A 6 9.513 -14.707 -9.379 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.177 -14.705 -11.562 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.220 -16.081 -11.050 1.00 0.00 H new ATOM 0 HG SER A 6 9.891 -15.567 -13.288 1.00 0.00 H new ATOM 59 N GLY A 7 10.120 -12.015 -11.210 1.00 0.00 N ATOM 60 CA GLY A 7 10.789 -10.728 -11.178 1.00 0.00 C ATOM 61 C GLY A 7 12.299 -10.858 -11.229 1.00 0.00 C ATOM 62 O GLY A 7 12.826 -11.820 -11.787 1.00 0.00 O ATOM 0 H GLY A 7 9.581 -12.197 -12.057 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.451 -10.125 -12.021 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.504 -10.196 -10.270 1.00 0.00 H new ATOM 66 N GLU A 8 12.995 -9.888 -10.645 1.00 0.00 N ATOM 67 CA GLU A 8 14.453 -9.898 -10.629 1.00 0.00 C ATOM 68 C GLU A 8 14.982 -9.721 -9.208 1.00 0.00 C ATOM 69 O GLU A 8 14.694 -8.725 -8.546 1.00 0.00 O ATOM 70 CB GLU A 8 15.003 -8.792 -11.532 1.00 0.00 C ATOM 71 CG GLU A 8 15.385 -9.275 -12.921 1.00 0.00 C ATOM 72 CD GLU A 8 15.139 -8.228 -13.990 1.00 0.00 C ATOM 73 OE1 GLU A 8 13.982 -7.779 -14.126 1.00 0.00 O ATOM 74 OE2 GLU A 8 16.104 -7.857 -14.690 1.00 0.00 O ATOM 0 H GLU A 8 12.573 -9.086 -10.177 1.00 0.00 H new ATOM 0 HA GLU A 8 14.789 -10.864 -11.006 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.256 -8.004 -11.623 1.00 0.00 H new ATOM 0 HB3 GLU A 8 15.878 -8.348 -11.057 1.00 0.00 H new ATOM 0 HG2 GLU A 8 16.438 -9.555 -12.927 1.00 0.00 H new ATOM 0 HG3 GLU A 8 14.815 -10.173 -13.159 1.00 0.00 H new ATOM 81 N GLY A 9 15.759 -10.696 -8.747 1.00 0.00 N ATOM 82 CA GLY A 9 16.316 -10.630 -7.408 1.00 0.00 C ATOM 83 C GLY A 9 17.224 -11.804 -7.099 1.00 0.00 C ATOM 84 O GLY A 9 17.075 -12.459 -6.067 1.00 0.00 O ATOM 0 H GLY A 9 16.013 -11.530 -9.276 1.00 0.00 H new ATOM 0 HA2 GLY A 9 16.877 -9.702 -7.296 1.00 0.00 H new ATOM 0 HA3 GLY A 9 15.504 -10.601 -6.681 1.00 0.00 H new ATOM 88 N VAL A 10 18.167 -12.074 -7.997 1.00 0.00 N ATOM 89 CA VAL A 10 19.102 -13.178 -7.816 1.00 0.00 C ATOM 90 C VAL A 10 20.543 -12.680 -7.798 1.00 0.00 C ATOM 91 O VAL A 10 20.962 -11.886 -8.640 1.00 0.00 O ATOM 92 CB VAL A 10 18.948 -14.232 -8.928 1.00 0.00 C ATOM 93 CG1 VAL A 10 19.159 -13.600 -10.295 1.00 0.00 C ATOM 94 CG2 VAL A 10 19.918 -15.383 -8.708 1.00 0.00 C ATOM 0 H VAL A 10 18.303 -11.543 -8.857 1.00 0.00 H new ATOM 0 HA VAL A 10 18.868 -13.637 -6.856 1.00 0.00 H new ATOM 0 HB VAL A 10 17.934 -14.629 -8.891 1.00 0.00 H new ATOM 0 HG11 VAL A 10 19.046 -14.360 -11.068 1.00 0.00 H new ATOM 0 HG12 VAL A 10 18.421 -12.813 -10.450 1.00 0.00 H new ATOM 0 HG13 VAL A 10 20.161 -13.174 -10.348 1.00 0.00 H new ATOM 0 HG21 VAL A 10 19.796 -16.119 -9.503 1.00 0.00 H new ATOM 0 HG22 VAL A 10 20.940 -15.004 -8.718 1.00 0.00 H new ATOM 0 HG23 VAL A 10 19.714 -15.852 -7.745 1.00 0.00 H new ATOM 104 N PRO A 11 21.321 -13.157 -6.815 1.00 0.00 N ATOM 105 CA PRO A 11 22.728 -12.775 -6.664 1.00 0.00 C ATOM 106 C PRO A 11 23.607 -13.348 -7.771 1.00 0.00 C ATOM 107 O PRO A 11 24.419 -12.637 -8.363 1.00 0.00 O ATOM 108 CB PRO A 11 23.115 -13.375 -5.310 1.00 0.00 C ATOM 109 CG PRO A 11 22.177 -14.516 -5.119 1.00 0.00 C ATOM 110 CD PRO A 11 20.888 -14.106 -5.776 1.00 0.00 C ATOM 0 HA PRO A 11 22.865 -11.695 -6.723 1.00 0.00 H new ATOM 0 HB2 PRO A 11 24.152 -13.711 -5.308 1.00 0.00 H new ATOM 0 HB3 PRO A 11 23.015 -12.642 -4.509 1.00 0.00 H new ATOM 0 HG2 PRO A 11 22.573 -15.426 -5.570 1.00 0.00 H new ATOM 0 HG3 PRO A 11 22.026 -14.724 -4.060 1.00 0.00 H new ATOM 0 HD2 PRO A 11 20.366 -14.961 -6.205 1.00 0.00 H new ATOM 0 HD3 PRO A 11 20.205 -13.640 -5.065 1.00 0.00 H new ATOM 118 N PHE A 12 23.439 -14.637 -8.046 1.00 0.00 N ATOM 119 CA PHE A 12 24.217 -15.306 -9.082 1.00 0.00 C ATOM 120 C PHE A 12 23.437 -15.370 -10.392 1.00 0.00 C ATOM 121 O PHE A 12 22.277 -15.783 -10.416 1.00 0.00 O ATOM 122 CB PHE A 12 24.598 -16.718 -8.632 1.00 0.00 C ATOM 123 CG PHE A 12 25.140 -16.775 -7.232 1.00 0.00 C ATOM 124 CD1 PHE A 12 26.413 -16.307 -6.949 1.00 0.00 C ATOM 125 CD2 PHE A 12 24.377 -17.298 -6.201 1.00 0.00 C ATOM 126 CE1 PHE A 12 26.915 -16.358 -5.662 1.00 0.00 C ATOM 127 CE2 PHE A 12 24.874 -17.351 -4.912 1.00 0.00 C ATOM 128 CZ PHE A 12 26.144 -16.882 -4.642 1.00 0.00 C ATOM 0 H PHE A 12 22.771 -15.239 -7.566 1.00 0.00 H new ATOM 0 HA PHE A 12 25.126 -14.728 -9.249 1.00 0.00 H new ATOM 0 HB2 PHE A 12 23.721 -17.362 -8.700 1.00 0.00 H new ATOM 0 HB3 PHE A 12 25.343 -17.121 -9.318 1.00 0.00 H new ATOM 0 HD1 PHE A 12 27.020 -15.898 -7.743 1.00 0.00 H new ATOM 0 HD2 PHE A 12 23.383 -17.668 -6.406 1.00 0.00 H new ATOM 0 HE1 PHE A 12 27.908 -15.989 -5.454 1.00 0.00 H new ATOM 0 HE2 PHE A 12 24.269 -17.759 -4.116 1.00 0.00 H new ATOM 0 HZ PHE A 12 26.534 -16.925 -3.636 1.00 0.00 H new ATOM 138 N ARG A 13 24.082 -14.959 -11.478 1.00 0.00 N ATOM 139 CA ARG A 13 23.449 -14.968 -12.792 1.00 0.00 C ATOM 140 C ARG A 13 23.664 -16.307 -13.490 1.00 0.00 C ATOM 141 O ARG A 13 22.869 -16.713 -14.339 1.00 0.00 O ATOM 142 CB ARG A 13 24.003 -13.835 -13.657 1.00 0.00 C ATOM 143 CG ARG A 13 25.515 -13.872 -13.813 1.00 0.00 C ATOM 144 CD ARG A 13 25.996 -12.838 -14.819 1.00 0.00 C ATOM 145 NE ARG A 13 26.197 -11.529 -14.204 1.00 0.00 N ATOM 146 CZ ARG A 13 27.232 -11.233 -13.426 1.00 0.00 C ATOM 147 NH1 ARG A 13 28.155 -12.150 -13.169 1.00 0.00 N ATOM 148 NH2 ARG A 13 27.346 -10.019 -12.903 1.00 0.00 N ATOM 0 H ARG A 13 25.042 -14.616 -11.475 1.00 0.00 H new ATOM 0 HA ARG A 13 22.378 -14.818 -12.652 1.00 0.00 H new ATOM 0 HB2 ARG A 13 23.543 -13.884 -14.644 1.00 0.00 H new ATOM 0 HB3 ARG A 13 23.715 -12.880 -13.218 1.00 0.00 H new ATOM 0 HG2 ARG A 13 25.986 -13.689 -12.847 1.00 0.00 H new ATOM 0 HG3 ARG A 13 25.825 -14.866 -14.135 1.00 0.00 H new ATOM 0 HD2 ARG A 13 26.931 -13.175 -15.267 1.00 0.00 H new ATOM 0 HD3 ARG A 13 25.269 -12.752 -15.626 1.00 0.00 H new ATOM 0 HE ARG A 13 25.504 -10.802 -14.382 1.00 0.00 H new ATOM 0 HH11 ARG A 13 28.071 -13.084 -13.569 1.00 0.00 H new ATOM 0 HH12 ARG A 13 28.949 -11.921 -12.571 1.00 0.00 H new ATOM 0 HH21 ARG A 13 26.638 -9.311 -13.098 1.00 0.00 H new ATOM 0 HH22 ARG A 13 28.142 -9.794 -12.306 1.00 0.00 H new ATOM 162 N THR A 14 24.745 -16.991 -13.127 1.00 0.00 N ATOM 163 CA THR A 14 25.067 -18.283 -13.720 1.00 0.00 C ATOM 164 C THR A 14 25.185 -19.363 -12.651 1.00 0.00 C ATOM 165 O THR A 14 25.487 -19.075 -11.493 1.00 0.00 O ATOM 166 CB THR A 14 26.382 -18.223 -14.520 1.00 0.00 C ATOM 167 OG1 THR A 14 27.481 -17.966 -13.638 1.00 0.00 O ATOM 168 CG2 THR A 14 26.317 -17.139 -15.586 1.00 0.00 C ATOM 0 H THR A 14 25.412 -16.671 -12.425 1.00 0.00 H new ATOM 0 HA THR A 14 24.250 -18.532 -14.397 1.00 0.00 H new ATOM 0 HB THR A 14 26.528 -19.185 -15.010 1.00 0.00 H new ATOM 0 HG1 THR A 14 28.293 -18.382 -13.997 1.00 0.00 H new ATOM 0 HG21 THR A 14 27.256 -17.115 -16.138 1.00 0.00 H new ATOM 0 HG22 THR A 14 25.498 -17.353 -16.273 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.150 -16.172 -15.112 1.00 0.00 H new ATOM 176 N VAL A 15 24.945 -20.610 -13.047 1.00 0.00 N ATOM 177 CA VAL A 15 25.027 -21.734 -12.122 1.00 0.00 C ATOM 178 C VAL A 15 26.462 -21.968 -11.667 1.00 0.00 C ATOM 179 O VAL A 15 26.702 -22.517 -10.591 1.00 0.00 O ATOM 180 CB VAL A 15 24.485 -23.027 -12.762 1.00 0.00 C ATOM 181 CG1 VAL A 15 24.536 -24.177 -11.768 1.00 0.00 C ATOM 182 CG2 VAL A 15 23.068 -22.815 -13.273 1.00 0.00 C ATOM 0 H VAL A 15 24.692 -20.866 -14.001 1.00 0.00 H new ATOM 0 HA VAL A 15 24.413 -21.479 -11.258 1.00 0.00 H new ATOM 0 HB VAL A 15 25.118 -23.284 -13.611 1.00 0.00 H new ATOM 0 HG11 VAL A 15 24.149 -25.081 -12.238 1.00 0.00 H new ATOM 0 HG12 VAL A 15 25.567 -24.343 -11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.928 -23.932 -10.897 1.00 0.00 H new ATOM 0 HG21 VAL A 15 22.701 -23.738 -13.722 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.420 -22.533 -12.443 1.00 0.00 H new ATOM 0 HG23 VAL A 15 23.066 -22.022 -14.021 1.00 0.00 H new ATOM 192 N SER A 16 27.416 -21.548 -12.492 1.00 0.00 N ATOM 193 CA SER A 16 28.829 -21.714 -12.175 1.00 0.00 C ATOM 194 C SER A 16 29.226 -20.846 -10.985 1.00 0.00 C ATOM 195 O SER A 16 29.855 -21.321 -10.040 1.00 0.00 O ATOM 196 CB SER A 16 29.691 -21.360 -13.389 1.00 0.00 C ATOM 197 OG SER A 16 31.009 -21.859 -13.242 1.00 0.00 O ATOM 0 H SER A 16 27.235 -21.090 -13.385 1.00 0.00 H new ATOM 0 HA SER A 16 28.996 -22.758 -11.911 1.00 0.00 H new ATOM 0 HB2 SER A 16 29.241 -21.774 -14.291 1.00 0.00 H new ATOM 0 HB3 SER A 16 29.721 -20.278 -13.515 1.00 0.00 H new ATOM 0 HG SER A 16 31.539 -21.621 -14.031 1.00 0.00 H new ATOM 203 N GLU A 17 28.852 -19.572 -11.040 1.00 0.00 N ATOM 204 CA GLU A 17 29.169 -18.637 -9.967 1.00 0.00 C ATOM 205 C GLU A 17 28.542 -19.086 -8.650 1.00 0.00 C ATOM 206 O GLU A 17 29.037 -18.761 -7.571 1.00 0.00 O ATOM 207 CB GLU A 17 28.680 -17.231 -10.323 1.00 0.00 C ATOM 208 CG GLU A 17 29.227 -16.714 -11.643 1.00 0.00 C ATOM 209 CD GLU A 17 30.583 -16.050 -11.493 1.00 0.00 C ATOM 210 OE1 GLU A 17 31.412 -16.564 -10.713 1.00 0.00 O ATOM 211 OE2 GLU A 17 30.813 -15.017 -12.155 1.00 0.00 O ATOM 0 H GLU A 17 28.330 -19.164 -11.815 1.00 0.00 H new ATOM 0 HA GLU A 17 30.252 -18.618 -9.846 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.591 -17.234 -10.367 1.00 0.00 H new ATOM 0 HB3 GLU A 17 28.965 -16.543 -9.527 1.00 0.00 H new ATOM 0 HG2 GLU A 17 29.308 -17.542 -12.348 1.00 0.00 H new ATOM 0 HG3 GLU A 17 28.522 -16.000 -12.069 1.00 0.00 H new ATOM 218 N TRP A 18 27.449 -19.835 -8.748 1.00 0.00 N ATOM 219 CA TRP A 18 26.753 -20.329 -7.565 1.00 0.00 C ATOM 220 C TRP A 18 27.466 -21.543 -6.981 1.00 0.00 C ATOM 221 O TRP A 18 27.822 -21.559 -5.802 1.00 0.00 O ATOM 222 CB TRP A 18 25.307 -20.689 -7.913 1.00 0.00 C ATOM 223 CG TRP A 18 24.586 -21.390 -6.801 1.00 0.00 C ATOM 224 CD1 TRP A 18 24.350 -20.907 -5.545 1.00 0.00 C ATOM 225 CD2 TRP A 18 24.010 -22.700 -6.845 1.00 0.00 C ATOM 226 NE1 TRP A 18 23.661 -21.839 -4.806 1.00 0.00 N ATOM 227 CE2 TRP A 18 23.440 -22.947 -5.580 1.00 0.00 C ATOM 228 CE3 TRP A 18 23.919 -23.687 -7.829 1.00 0.00 C ATOM 229 CZ2 TRP A 18 22.790 -24.140 -5.278 1.00 0.00 C ATOM 230 CZ3 TRP A 18 23.274 -24.872 -7.527 1.00 0.00 C ATOM 231 CH2 TRP A 18 22.716 -25.090 -6.260 1.00 0.00 C ATOM 0 H TRP A 18 27.026 -20.113 -9.633 1.00 0.00 H new ATOM 0 HA TRP A 18 26.753 -19.537 -6.816 1.00 0.00 H new ATOM 0 HB2 TRP A 18 24.765 -19.779 -8.171 1.00 0.00 H new ATOM 0 HB3 TRP A 18 25.301 -21.325 -8.798 1.00 0.00 H new ATOM 0 HD1 TRP A 18 24.659 -19.936 -5.186 1.00 0.00 H new ATOM 0 HE1 TRP A 18 23.363 -21.724 -3.837 1.00 0.00 H new ATOM 0 HE3 TRP A 18 24.345 -23.527 -8.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 22.359 -24.310 -4.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 23.199 -25.643 -8.280 1.00 0.00 H new ATOM 0 HH2 TRP A 18 22.218 -26.026 -6.055 1.00 0.00 H new ATOM 242 N LEU A 19 27.672 -22.559 -7.812 1.00 0.00 N ATOM 243 CA LEU A 19 28.344 -23.779 -7.377 1.00 0.00 C ATOM 244 C LEU A 19 29.779 -23.487 -6.949 1.00 0.00 C ATOM 245 O LEU A 19 30.213 -23.904 -5.876 1.00 0.00 O ATOM 246 CB LEU A 19 28.336 -24.817 -8.500 1.00 0.00 C ATOM 247 CG LEU A 19 27.071 -25.668 -8.619 1.00 0.00 C ATOM 248 CD1 LEU A 19 26.924 -26.211 -10.032 1.00 0.00 C ATOM 249 CD2 LEU A 19 27.096 -26.805 -7.608 1.00 0.00 C ATOM 0 H LEU A 19 27.384 -22.562 -8.790 1.00 0.00 H new ATOM 0 HA LEU A 19 27.802 -24.177 -6.519 1.00 0.00 H new ATOM 0 HB2 LEU A 19 28.492 -24.300 -9.447 1.00 0.00 H new ATOM 0 HB3 LEU A 19 29.186 -25.484 -8.357 1.00 0.00 H new ATOM 0 HG LEU A 19 26.209 -25.036 -8.403 1.00 0.00 H new ATOM 0 HD11 LEU A 19 26.018 -26.814 -10.098 1.00 0.00 H new ATOM 0 HD12 LEU A 19 26.859 -25.381 -10.736 1.00 0.00 H new ATOM 0 HD13 LEU A 19 27.789 -26.828 -10.277 1.00 0.00 H new ATOM 0 HD21 LEU A 19 26.188 -27.400 -7.707 1.00 0.00 H new ATOM 0 HD22 LEU A 19 27.965 -27.436 -7.792 1.00 0.00 H new ATOM 0 HD23 LEU A 19 27.152 -26.394 -6.600 1.00 0.00 H new ATOM 261 N GLU A 20 30.509 -22.767 -7.795 1.00 0.00 N ATOM 262 CA GLU A 20 31.894 -22.419 -7.502 1.00 0.00 C ATOM 263 C GLU A 20 32.014 -21.776 -6.124 1.00 0.00 C ATOM 264 O GLU A 20 33.029 -21.925 -5.443 1.00 0.00 O ATOM 265 CB GLU A 20 32.441 -21.468 -8.570 1.00 0.00 C ATOM 266 CG GLU A 20 31.916 -20.048 -8.446 1.00 0.00 C ATOM 267 CD GLU A 20 32.735 -19.204 -7.489 1.00 0.00 C ATOM 268 OE1 GLU A 20 33.980 -19.231 -7.589 1.00 0.00 O ATOM 269 OE2 GLU A 20 32.131 -18.517 -6.639 1.00 0.00 O ATOM 0 H GLU A 20 30.165 -22.414 -8.688 1.00 0.00 H new ATOM 0 HA GLU A 20 32.481 -23.337 -7.508 1.00 0.00 H new ATOM 0 HB2 GLU A 20 33.529 -21.451 -8.507 1.00 0.00 H new ATOM 0 HB3 GLU A 20 32.185 -21.856 -9.556 1.00 0.00 H new ATOM 0 HG2 GLU A 20 31.915 -19.578 -9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 20 30.881 -20.076 -8.105 1.00 0.00 H new ATOM 276 N SER A 21 30.970 -21.059 -5.718 1.00 0.00 N ATOM 277 CA SER A 21 30.959 -20.389 -4.423 1.00 0.00 C ATOM 278 C SER A 21 31.047 -21.403 -3.286 1.00 0.00 C ATOM 279 O SER A 21 31.662 -21.140 -2.252 1.00 0.00 O ATOM 280 CB SER A 21 29.693 -19.545 -4.273 1.00 0.00 C ATOM 281 OG SER A 21 28.707 -20.233 -3.524 1.00 0.00 O ATOM 0 H SER A 21 30.121 -20.928 -6.268 1.00 0.00 H new ATOM 0 HA SER A 21 31.830 -19.736 -4.372 1.00 0.00 H new ATOM 0 HB2 SER A 21 29.936 -18.603 -3.781 1.00 0.00 H new ATOM 0 HB3 SER A 21 29.298 -19.297 -5.258 1.00 0.00 H new ATOM 0 HG SER A 21 28.197 -20.822 -4.118 1.00 0.00 H new ATOM 287 N ILE A 22 30.427 -22.561 -3.486 1.00 0.00 N ATOM 288 CA ILE A 22 30.435 -23.615 -2.479 1.00 0.00 C ATOM 289 C ILE A 22 31.413 -24.723 -2.851 1.00 0.00 C ATOM 290 O ILE A 22 31.268 -25.866 -2.417 1.00 0.00 O ATOM 291 CB ILE A 22 29.033 -24.224 -2.291 1.00 0.00 C ATOM 292 CG1 ILE A 22 28.542 -24.843 -3.601 1.00 0.00 C ATOM 293 CG2 ILE A 22 28.057 -23.166 -1.800 1.00 0.00 C ATOM 294 CD1 ILE A 22 27.174 -25.480 -3.493 1.00 0.00 C ATOM 0 H ILE A 22 29.913 -22.793 -4.336 1.00 0.00 H new ATOM 0 HA ILE A 22 30.751 -23.155 -1.543 1.00 0.00 H new ATOM 0 HB ILE A 22 29.093 -25.011 -1.539 1.00 0.00 H new ATOM 0 HG12 ILE A 22 28.515 -24.071 -4.370 1.00 0.00 H new ATOM 0 HG13 ILE A 22 29.259 -25.595 -3.929 1.00 0.00 H new ATOM 0 HG21 ILE A 22 27.071 -23.612 -1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 22 28.402 -22.768 -0.846 1.00 0.00 H new ATOM 0 HG23 ILE A 22 27.998 -22.359 -2.530 1.00 0.00 H new ATOM 0 HD11 ILE A 22 26.890 -25.898 -4.459 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.200 -26.274 -2.747 1.00 0.00 H new ATOM 0 HD13 ILE A 22 26.444 -24.727 -3.195 1.00 0.00 H new ATOM 306 N LYS A 23 32.412 -24.378 -3.657 1.00 0.00 N ATOM 307 CA LYS A 23 33.418 -25.342 -4.086 1.00 0.00 C ATOM 308 C LYS A 23 32.762 -26.588 -4.672 1.00 0.00 C ATOM 309 O LYS A 23 33.125 -27.712 -4.328 1.00 0.00 O ATOM 310 CB LYS A 23 34.316 -25.731 -2.910 1.00 0.00 C ATOM 311 CG LYS A 23 35.250 -24.619 -2.464 1.00 0.00 C ATOM 312 CD LYS A 23 36.484 -24.540 -3.346 1.00 0.00 C ATOM 313 CE LYS A 23 37.722 -25.044 -2.620 1.00 0.00 C ATOM 314 NZ LYS A 23 37.572 -26.462 -2.189 1.00 0.00 N ATOM 0 H LYS A 23 32.546 -23.437 -4.026 1.00 0.00 H new ATOM 0 HA LYS A 23 34.026 -24.874 -4.860 1.00 0.00 H new ATOM 0 HB2 LYS A 23 33.690 -26.028 -2.068 1.00 0.00 H new ATOM 0 HB3 LYS A 23 34.909 -26.602 -3.189 1.00 0.00 H new ATOM 0 HG2 LYS A 23 34.721 -23.666 -2.490 1.00 0.00 H new ATOM 0 HG3 LYS A 23 35.551 -24.788 -1.430 1.00 0.00 H new ATOM 0 HD2 LYS A 23 36.325 -25.130 -4.249 1.00 0.00 H new ATOM 0 HD3 LYS A 23 36.641 -23.509 -3.662 1.00 0.00 H new ATOM 0 HE2 LYS A 23 38.589 -24.953 -3.274 1.00 0.00 H new ATOM 0 HE3 LYS A 23 37.913 -24.418 -1.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 38.480 -26.811 -1.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 36.849 -26.524 -1.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 37.282 -27.043 -3.001 1.00 0.00 H new ATOM 328 N MET A 24 31.795 -26.380 -5.560 1.00 0.00 N ATOM 329 CA MET A 24 31.090 -27.488 -6.196 1.00 0.00 C ATOM 330 C MET A 24 30.857 -27.206 -7.676 1.00 0.00 C ATOM 331 O MET A 24 29.877 -27.671 -8.258 1.00 0.00 O ATOM 332 CB MET A 24 29.754 -27.740 -5.495 1.00 0.00 C ATOM 333 CG MET A 24 29.900 -28.198 -4.053 1.00 0.00 C ATOM 334 SD MET A 24 29.802 -29.990 -3.881 1.00 0.00 S ATOM 335 CE MET A 24 31.461 -30.368 -3.321 1.00 0.00 C ATOM 0 H MET A 24 31.482 -25.455 -5.855 1.00 0.00 H new ATOM 0 HA MET A 24 31.711 -28.379 -6.108 1.00 0.00 H new ATOM 0 HB2 MET A 24 29.163 -26.825 -5.519 1.00 0.00 H new ATOM 0 HB3 MET A 24 29.197 -28.494 -6.052 1.00 0.00 H new ATOM 0 HG2 MET A 24 30.856 -27.851 -3.660 1.00 0.00 H new ATOM 0 HG3 MET A 24 29.120 -27.736 -3.448 1.00 0.00 H new ATOM 0 HE1 MET A 24 31.803 -31.290 -3.792 1.00 0.00 H new ATOM 0 HE2 MET A 24 32.131 -29.552 -3.592 1.00 0.00 H new ATOM 0 HE3 MET A 24 31.460 -30.492 -2.238 1.00 0.00 H new ATOM 345 N GLN A 25 31.762 -26.441 -8.278 1.00 0.00 N ATOM 346 CA GLN A 25 31.652 -26.096 -9.691 1.00 0.00 C ATOM 347 C GLN A 25 31.791 -27.337 -10.566 1.00 0.00 C ATOM 348 O GLN A 25 31.229 -27.403 -11.659 1.00 0.00 O ATOM 349 CB GLN A 25 32.718 -25.067 -10.071 1.00 0.00 C ATOM 350 CG GLN A 25 34.136 -25.515 -9.755 1.00 0.00 C ATOM 351 CD GLN A 25 34.872 -24.536 -8.862 1.00 0.00 C ATOM 352 OE1 GLN A 25 35.215 -24.854 -7.723 1.00 0.00 O ATOM 353 NE2 GLN A 25 35.120 -23.336 -9.376 1.00 0.00 N ATOM 0 H GLN A 25 32.579 -26.049 -7.810 1.00 0.00 H new ATOM 0 HA GLN A 25 30.665 -25.664 -9.858 1.00 0.00 H new ATOM 0 HB2 GLN A 25 32.642 -24.854 -11.137 1.00 0.00 H new ATOM 0 HB3 GLN A 25 32.515 -24.134 -9.545 1.00 0.00 H new ATOM 0 HG2 GLN A 25 34.105 -26.491 -9.270 1.00 0.00 H new ATOM 0 HG3 GLN A 25 34.690 -25.639 -10.686 1.00 0.00 H new ATOM 0 HE21 GLN A 25 34.818 -23.115 -10.325 1.00 0.00 H new ATOM 0 HE22 GLN A 25 35.613 -22.636 -8.822 1.00 0.00 H new ATOM 362 N GLN A 26 32.544 -28.318 -10.078 1.00 0.00 N ATOM 363 CA GLN A 26 32.758 -29.556 -10.818 1.00 0.00 C ATOM 364 C GLN A 26 31.431 -30.244 -11.122 1.00 0.00 C ATOM 365 O GLN A 26 31.318 -30.998 -12.089 1.00 0.00 O ATOM 366 CB GLN A 26 33.664 -30.499 -10.024 1.00 0.00 C ATOM 367 CG GLN A 26 33.019 -31.044 -8.761 1.00 0.00 C ATOM 368 CD GLN A 26 33.965 -31.047 -7.577 1.00 0.00 C ATOM 369 OE1 GLN A 26 34.600 -30.037 -7.272 1.00 0.00 O ATOM 370 NE2 GLN A 26 34.064 -32.186 -6.901 1.00 0.00 N ATOM 0 H GLN A 26 33.016 -28.279 -9.174 1.00 0.00 H new ATOM 0 HA GLN A 26 33.242 -29.307 -11.762 1.00 0.00 H new ATOM 0 HB2 GLN A 26 33.954 -31.333 -10.663 1.00 0.00 H new ATOM 0 HB3 GLN A 26 34.578 -29.970 -9.756 1.00 0.00 H new ATOM 0 HG2 GLN A 26 32.141 -30.445 -8.518 1.00 0.00 H new ATOM 0 HG3 GLN A 26 32.670 -32.060 -8.945 1.00 0.00 H new ATOM 0 HE21 GLN A 26 33.519 -32.999 -7.189 1.00 0.00 H new ATOM 0 HE22 GLN A 26 34.685 -32.248 -6.094 1.00 0.00 H new ATOM 379 N TYR A 27 30.429 -29.981 -10.290 1.00 0.00 N ATOM 380 CA TYR A 27 29.111 -30.577 -10.468 1.00 0.00 C ATOM 381 C TYR A 27 28.290 -29.791 -11.486 1.00 0.00 C ATOM 382 O TYR A 27 27.266 -30.266 -11.977 1.00 0.00 O ATOM 383 CB TYR A 27 28.369 -30.634 -9.132 1.00 0.00 C ATOM 384 CG TYR A 27 28.776 -31.802 -8.262 1.00 0.00 C ATOM 385 CD1 TYR A 27 28.802 -33.095 -8.769 1.00 0.00 C ATOM 386 CD2 TYR A 27 29.134 -31.612 -6.933 1.00 0.00 C ATOM 387 CE1 TYR A 27 29.173 -34.165 -7.978 1.00 0.00 C ATOM 388 CE2 TYR A 27 29.508 -32.676 -6.135 1.00 0.00 C ATOM 389 CZ TYR A 27 29.525 -33.950 -6.662 1.00 0.00 C ATOM 390 OH TYR A 27 29.896 -35.013 -5.870 1.00 0.00 O ATOM 0 H TYR A 27 30.505 -29.359 -9.485 1.00 0.00 H new ATOM 0 HA TYR A 27 29.247 -31.591 -10.844 1.00 0.00 H new ATOM 0 HB2 TYR A 27 28.547 -29.707 -8.587 1.00 0.00 H new ATOM 0 HB3 TYR A 27 27.297 -30.690 -9.323 1.00 0.00 H new ATOM 0 HD1 TYR A 27 28.527 -33.267 -9.799 1.00 0.00 H new ATOM 0 HD2 TYR A 27 29.120 -30.616 -6.517 1.00 0.00 H new ATOM 0 HE1 TYR A 27 29.187 -35.164 -8.388 1.00 0.00 H new ATOM 0 HE2 TYR A 27 29.785 -32.511 -5.104 1.00 0.00 H new ATOM 0 HH TYR A 27 30.114 -34.690 -4.971 1.00 0.00 H new ATOM 400 N THR A 28 28.748 -28.583 -11.799 1.00 0.00 N ATOM 401 CA THR A 28 28.058 -27.728 -12.757 1.00 0.00 C ATOM 402 C THR A 28 27.784 -28.472 -14.059 1.00 0.00 C ATOM 403 O THR A 28 26.699 -28.363 -14.630 1.00 0.00 O ATOM 404 CB THR A 28 28.874 -26.459 -13.066 1.00 0.00 C ATOM 405 OG1 THR A 28 29.123 -25.730 -11.859 1.00 0.00 O ATOM 406 CG2 THR A 28 28.137 -25.570 -14.058 1.00 0.00 C ATOM 0 H THR A 28 29.594 -28.174 -11.403 1.00 0.00 H new ATOM 0 HA THR A 28 27.111 -27.440 -12.300 1.00 0.00 H new ATOM 0 HB THR A 28 29.823 -26.763 -13.509 1.00 0.00 H new ATOM 0 HG1 THR A 28 29.644 -24.926 -12.064 1.00 0.00 H new ATOM 0 HG21 THR A 28 28.732 -24.680 -14.261 1.00 0.00 H new ATOM 0 HG22 THR A 28 27.975 -26.118 -14.986 1.00 0.00 H new ATOM 0 HG23 THR A 28 27.175 -25.275 -13.638 1.00 0.00 H new ATOM 414 N GLU A 29 28.774 -29.229 -14.523 1.00 0.00 N ATOM 415 CA GLU A 29 28.638 -29.990 -15.759 1.00 0.00 C ATOM 416 C GLU A 29 27.448 -30.943 -15.683 1.00 0.00 C ATOM 417 O GLU A 29 26.818 -31.250 -16.695 1.00 0.00 O ATOM 418 CB GLU A 29 29.918 -30.778 -16.042 1.00 0.00 C ATOM 419 CG GLU A 29 31.161 -29.909 -16.128 1.00 0.00 C ATOM 420 CD GLU A 29 32.347 -30.513 -15.400 1.00 0.00 C ATOM 421 OE1 GLU A 29 32.976 -31.438 -15.954 1.00 0.00 O ATOM 422 OE2 GLU A 29 32.645 -30.060 -14.275 1.00 0.00 O ATOM 0 H GLU A 29 29.678 -29.331 -14.062 1.00 0.00 H new ATOM 0 HA GLU A 29 28.466 -29.285 -16.572 1.00 0.00 H new ATOM 0 HB2 GLU A 29 30.058 -31.521 -15.257 1.00 0.00 H new ATOM 0 HB3 GLU A 29 29.800 -31.322 -16.979 1.00 0.00 H new ATOM 0 HG2 GLU A 29 31.422 -29.757 -17.175 1.00 0.00 H new ATOM 0 HG3 GLU A 29 30.943 -28.927 -15.708 1.00 0.00 H new ATOM 429 N HIS A 30 27.146 -31.407 -14.474 1.00 0.00 N ATOM 430 CA HIS A 30 26.032 -32.325 -14.264 1.00 0.00 C ATOM 431 C HIS A 30 24.710 -31.566 -14.183 1.00 0.00 C ATOM 432 O HIS A 30 23.709 -31.977 -14.771 1.00 0.00 O ATOM 433 CB HIS A 30 26.246 -33.137 -12.987 1.00 0.00 C ATOM 434 CG HIS A 30 27.345 -34.148 -13.097 1.00 0.00 C ATOM 435 ND1 HIS A 30 28.613 -33.836 -13.540 1.00 0.00 N ATOM 436 CD2 HIS A 30 27.361 -35.473 -12.818 1.00 0.00 C ATOM 437 CE1 HIS A 30 29.361 -34.925 -13.530 1.00 0.00 C ATOM 438 NE2 HIS A 30 28.625 -35.932 -13.095 1.00 0.00 N ATOM 0 H HIS A 30 27.657 -31.162 -13.626 1.00 0.00 H new ATOM 0 HA HIS A 30 25.989 -33.005 -15.115 1.00 0.00 H new ATOM 0 HB2 HIS A 30 26.471 -32.456 -12.167 1.00 0.00 H new ATOM 0 HB3 HIS A 30 25.318 -33.648 -12.731 1.00 0.00 H new ATOM 0 HD2 HIS A 30 26.534 -36.059 -12.447 1.00 0.00 H new ATOM 0 HE1 HIS A 30 30.398 -34.982 -13.827 1.00 0.00 H new ATOM 0 HE2 HIS A 30 28.944 -36.894 -12.983 1.00 0.00 H new ATOM 446 N PHE A 31 24.715 -30.457 -13.452 1.00 0.00 N ATOM 447 CA PHE A 31 23.517 -29.641 -13.292 1.00 0.00 C ATOM 448 C PHE A 31 22.906 -29.300 -14.648 1.00 0.00 C ATOM 449 O PHE A 31 21.694 -29.392 -14.836 1.00 0.00 O ATOM 450 CB PHE A 31 23.846 -28.356 -12.531 1.00 0.00 C ATOM 451 CG PHE A 31 23.696 -28.485 -11.042 1.00 0.00 C ATOM 452 CD1 PHE A 31 24.763 -28.896 -10.258 1.00 0.00 C ATOM 453 CD2 PHE A 31 22.489 -28.197 -10.426 1.00 0.00 C ATOM 454 CE1 PHE A 31 24.628 -29.016 -8.888 1.00 0.00 C ATOM 455 CE2 PHE A 31 22.349 -28.315 -9.056 1.00 0.00 C ATOM 456 CZ PHE A 31 23.419 -28.726 -8.286 1.00 0.00 C ATOM 0 H PHE A 31 25.535 -30.102 -12.961 1.00 0.00 H new ATOM 0 HA PHE A 31 22.790 -30.217 -12.720 1.00 0.00 H new ATOM 0 HB2 PHE A 31 24.869 -28.059 -12.761 1.00 0.00 H new ATOM 0 HB3 PHE A 31 23.195 -27.557 -12.886 1.00 0.00 H new ATOM 0 HD1 PHE A 31 25.710 -29.125 -10.723 1.00 0.00 H new ATOM 0 HD2 PHE A 31 21.648 -27.877 -11.023 1.00 0.00 H new ATOM 0 HE1 PHE A 31 25.467 -29.336 -8.288 1.00 0.00 H new ATOM 0 HE2 PHE A 31 21.403 -28.086 -8.588 1.00 0.00 H new ATOM 0 HZ PHE A 31 23.311 -28.821 -7.216 1.00 0.00 H new ATOM 466 N MET A 32 23.757 -28.905 -15.591 1.00 0.00 N ATOM 467 CA MET A 32 23.302 -28.551 -16.930 1.00 0.00 C ATOM 468 C MET A 32 22.608 -29.733 -17.599 1.00 0.00 C ATOM 469 O MET A 32 21.474 -29.618 -18.063 1.00 0.00 O ATOM 470 CB MET A 32 24.481 -28.085 -17.786 1.00 0.00 C ATOM 471 CG MET A 32 25.303 -26.982 -17.139 1.00 0.00 C ATOM 472 SD MET A 32 25.549 -25.568 -18.231 1.00 0.00 S ATOM 473 CE MET A 32 25.555 -24.224 -17.047 1.00 0.00 C ATOM 0 H MET A 32 24.764 -28.822 -15.452 1.00 0.00 H new ATOM 0 HA MET A 32 22.584 -27.736 -16.839 1.00 0.00 H new ATOM 0 HB2 MET A 32 25.129 -28.937 -17.992 1.00 0.00 H new ATOM 0 HB3 MET A 32 24.105 -27.731 -18.746 1.00 0.00 H new ATOM 0 HG2 MET A 32 24.805 -26.650 -16.228 1.00 0.00 H new ATOM 0 HG3 MET A 32 26.273 -27.382 -16.845 1.00 0.00 H new ATOM 0 HE1 MET A 32 24.640 -23.641 -17.154 1.00 0.00 H new ATOM 0 HE2 MET A 32 25.611 -24.629 -16.037 1.00 0.00 H new ATOM 0 HE3 MET A 32 26.417 -23.583 -17.229 1.00 0.00 H new ATOM 483 N ALA A 33 23.298 -30.869 -17.646 1.00 0.00 N ATOM 484 CA ALA A 33 22.747 -32.072 -18.257 1.00 0.00 C ATOM 485 C ALA A 33 21.391 -32.424 -17.653 1.00 0.00 C ATOM 486 O ALA A 33 20.506 -32.929 -18.343 1.00 0.00 O ATOM 487 CB ALA A 33 23.715 -33.235 -18.099 1.00 0.00 C ATOM 0 H ALA A 33 24.239 -30.981 -17.268 1.00 0.00 H new ATOM 0 HA ALA A 33 22.602 -31.876 -19.319 1.00 0.00 H new ATOM 0 HB1 ALA A 33 23.291 -34.127 -18.560 1.00 0.00 H new ATOM 0 HB2 ALA A 33 24.660 -32.990 -18.584 1.00 0.00 H new ATOM 0 HB3 ALA A 33 23.889 -33.422 -17.039 1.00 0.00 H new ATOM 493 N ALA A 34 21.237 -32.153 -16.361 1.00 0.00 N ATOM 494 CA ALA A 34 19.989 -32.440 -15.665 1.00 0.00 C ATOM 495 C ALA A 34 18.908 -31.429 -16.036 1.00 0.00 C ATOM 496 O ALA A 34 17.716 -31.719 -15.947 1.00 0.00 O ATOM 497 CB ALA A 34 20.213 -32.447 -14.160 1.00 0.00 C ATOM 0 H ALA A 34 21.960 -31.735 -15.776 1.00 0.00 H new ATOM 0 HA ALA A 34 19.648 -33.428 -15.975 1.00 0.00 H new ATOM 0 HB1 ALA A 34 19.272 -32.663 -13.653 1.00 0.00 H new ATOM 0 HB2 ALA A 34 20.946 -33.212 -13.905 1.00 0.00 H new ATOM 0 HB3 ALA A 34 20.581 -31.471 -13.842 1.00 0.00 H new ATOM 503 N GLY A 35 19.334 -30.240 -16.451 1.00 0.00 N ATOM 504 CA GLY A 35 18.390 -29.204 -16.828 1.00 0.00 C ATOM 505 C GLY A 35 18.400 -28.033 -15.866 1.00 0.00 C ATOM 506 O GLY A 35 17.354 -27.454 -15.571 1.00 0.00 O ATOM 0 H GLY A 35 20.316 -29.976 -16.533 1.00 0.00 H new ATOM 0 HA2 GLY A 35 18.627 -28.848 -17.831 1.00 0.00 H new ATOM 0 HA3 GLY A 35 17.387 -29.628 -16.869 1.00 0.00 H new ATOM 510 N TYR A 36 19.583 -27.684 -15.373 1.00 0.00 N ATOM 511 CA TYR A 36 19.724 -26.576 -14.435 1.00 0.00 C ATOM 512 C TYR A 36 20.793 -25.595 -14.907 1.00 0.00 C ATOM 513 O TYR A 36 21.685 -25.217 -14.147 1.00 0.00 O ATOM 514 CB TYR A 36 20.077 -27.102 -13.043 1.00 0.00 C ATOM 515 CG TYR A 36 19.145 -28.185 -12.550 1.00 0.00 C ATOM 516 CD1 TYR A 36 17.767 -28.055 -12.680 1.00 0.00 C ATOM 517 CD2 TYR A 36 19.640 -29.338 -11.953 1.00 0.00 C ATOM 518 CE1 TYR A 36 16.911 -29.042 -12.231 1.00 0.00 C ATOM 519 CE2 TYR A 36 18.792 -30.330 -11.502 1.00 0.00 C ATOM 520 CZ TYR A 36 17.428 -30.178 -11.643 1.00 0.00 C ATOM 521 OH TYR A 36 16.579 -31.163 -11.193 1.00 0.00 O ATOM 0 H TYR A 36 20.458 -28.152 -15.607 1.00 0.00 H new ATOM 0 HA TYR A 36 18.771 -26.050 -14.387 1.00 0.00 H new ATOM 0 HB2 TYR A 36 21.095 -27.490 -13.058 1.00 0.00 H new ATOM 0 HB3 TYR A 36 20.062 -26.272 -12.336 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.359 -27.167 -13.140 1.00 0.00 H new ATOM 0 HD2 TYR A 36 20.707 -29.460 -11.840 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.843 -28.925 -12.340 1.00 0.00 H new ATOM 0 HE2 TYR A 36 19.194 -31.220 -11.041 1.00 0.00 H new ATOM 0 HH TYR A 36 16.059 -30.825 -10.435 1.00 0.00 H new ATOM 531 N THR A 37 20.695 -25.185 -16.168 1.00 0.00 N ATOM 532 CA THR A 37 21.652 -24.248 -16.743 1.00 0.00 C ATOM 533 C THR A 37 21.403 -22.830 -16.241 1.00 0.00 C ATOM 534 O THR A 37 22.312 -22.001 -16.220 1.00 0.00 O ATOM 535 CB THR A 37 21.588 -24.255 -18.282 1.00 0.00 C ATOM 536 OG1 THR A 37 20.344 -23.701 -18.723 1.00 0.00 O ATOM 537 CG2 THR A 37 21.741 -25.668 -18.824 1.00 0.00 C ATOM 0 H THR A 37 19.963 -25.487 -16.810 1.00 0.00 H new ATOM 0 HA THR A 37 22.643 -24.573 -16.426 1.00 0.00 H new ATOM 0 HB THR A 37 22.410 -23.647 -18.660 1.00 0.00 H new ATOM 0 HG1 THR A 37 20.312 -23.707 -19.702 1.00 0.00 H new ATOM 0 HG21 THR A 37 21.693 -25.647 -19.913 1.00 0.00 H new ATOM 0 HG22 THR A 37 22.702 -26.076 -18.511 1.00 0.00 H new ATOM 0 HG23 THR A 37 20.938 -26.295 -18.437 1.00 0.00 H new ATOM 545 N ALA A 38 20.166 -22.559 -15.838 1.00 0.00 N ATOM 546 CA ALA A 38 19.799 -21.241 -15.334 1.00 0.00 C ATOM 547 C ALA A 38 19.315 -21.322 -13.890 1.00 0.00 C ATOM 548 O ALA A 38 18.629 -22.270 -13.508 1.00 0.00 O ATOM 549 CB ALA A 38 18.729 -20.617 -16.218 1.00 0.00 C ATOM 0 H ALA A 38 19.401 -23.234 -15.851 1.00 0.00 H new ATOM 0 HA ALA A 38 20.687 -20.609 -15.357 1.00 0.00 H new ATOM 0 HB1 ALA A 38 18.465 -19.633 -15.830 1.00 0.00 H new ATOM 0 HB2 ALA A 38 19.110 -20.516 -17.234 1.00 0.00 H new ATOM 0 HB3 ALA A 38 17.845 -21.254 -16.224 1.00 0.00 H new ATOM 555 N ILE A 39 19.676 -20.321 -13.094 1.00 0.00 N ATOM 556 CA ILE A 39 19.277 -20.279 -11.692 1.00 0.00 C ATOM 557 C ILE A 39 17.761 -20.365 -11.549 1.00 0.00 C ATOM 558 O ILE A 39 17.250 -20.800 -10.518 1.00 0.00 O ATOM 559 CB ILE A 39 19.774 -18.995 -11.004 1.00 0.00 C ATOM 560 CG1 ILE A 39 21.295 -18.877 -11.132 1.00 0.00 C ATOM 561 CG2 ILE A 39 19.358 -18.983 -9.540 1.00 0.00 C ATOM 562 CD1 ILE A 39 22.044 -20.041 -10.522 1.00 0.00 C ATOM 0 H ILE A 39 20.244 -19.529 -13.395 1.00 0.00 H new ATOM 0 HA ILE A 39 19.735 -21.142 -11.208 1.00 0.00 H new ATOM 0 HB ILE A 39 19.319 -18.137 -11.498 1.00 0.00 H new ATOM 0 HG12 ILE A 39 21.558 -18.799 -12.187 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.621 -17.954 -10.653 1.00 0.00 H new ATOM 0 HG21 ILE A 39 19.717 -18.069 -9.067 1.00 0.00 H new ATOM 0 HG22 ILE A 39 18.271 -19.025 -9.470 1.00 0.00 H new ATOM 0 HG23 ILE A 39 19.788 -19.847 -9.033 1.00 0.00 H new ATOM 0 HD11 ILE A 39 23.116 -19.891 -10.649 1.00 0.00 H new ATOM 0 HD12 ILE A 39 21.810 -20.107 -9.459 1.00 0.00 H new ATOM 0 HD13 ILE A 39 21.746 -20.965 -11.017 1.00 0.00 H new ATOM 574 N GLU A 40 17.049 -19.949 -12.592 1.00 0.00 N ATOM 575 CA GLU A 40 15.591 -19.980 -12.582 1.00 0.00 C ATOM 576 C GLU A 40 15.079 -21.402 -12.376 1.00 0.00 C ATOM 577 O GLU A 40 14.012 -21.613 -11.800 1.00 0.00 O ATOM 578 CB GLU A 40 15.038 -19.411 -13.890 1.00 0.00 C ATOM 579 CG GLU A 40 15.681 -18.097 -14.302 1.00 0.00 C ATOM 580 CD GLU A 40 14.770 -17.248 -15.167 1.00 0.00 C ATOM 581 OE1 GLU A 40 14.557 -17.615 -16.342 1.00 0.00 O ATOM 582 OE2 GLU A 40 14.270 -16.217 -14.671 1.00 0.00 O ATOM 0 H GLU A 40 17.458 -19.587 -13.454 1.00 0.00 H new ATOM 0 HA GLU A 40 15.245 -19.364 -11.752 1.00 0.00 H new ATOM 0 HB2 GLU A 40 15.184 -20.142 -14.685 1.00 0.00 H new ATOM 0 HB3 GLU A 40 13.963 -19.263 -13.786 1.00 0.00 H new ATOM 0 HG2 GLU A 40 15.955 -17.535 -13.409 1.00 0.00 H new ATOM 0 HG3 GLU A 40 16.603 -18.303 -14.845 1.00 0.00 H new ATOM 589 N LYS A 41 15.847 -22.376 -12.853 1.00 0.00 N ATOM 590 CA LYS A 41 15.474 -23.780 -12.722 1.00 0.00 C ATOM 591 C LYS A 41 16.157 -24.414 -11.515 1.00 0.00 C ATOM 592 O LYS A 41 15.591 -25.288 -10.857 1.00 0.00 O ATOM 593 CB LYS A 41 15.844 -24.548 -13.993 1.00 0.00 C ATOM 594 CG LYS A 41 15.216 -23.977 -15.253 1.00 0.00 C ATOM 595 CD LYS A 41 16.272 -23.560 -16.262 1.00 0.00 C ATOM 596 CE LYS A 41 15.769 -22.444 -17.166 1.00 0.00 C ATOM 597 NZ LYS A 41 14.652 -22.898 -18.040 1.00 0.00 N ATOM 0 H LYS A 41 16.732 -22.219 -13.334 1.00 0.00 H new ATOM 0 HA LYS A 41 14.395 -23.831 -12.575 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.928 -24.548 -14.105 1.00 0.00 H new ATOM 0 HB3 LYS A 41 15.535 -25.588 -13.882 1.00 0.00 H new ATOM 0 HG2 LYS A 41 14.557 -24.720 -15.701 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.598 -23.117 -14.995 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.168 -23.229 -15.737 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.558 -24.420 -16.868 1.00 0.00 H new ATOM 0 HE2 LYS A 41 15.434 -21.605 -16.555 1.00 0.00 H new ATOM 0 HE3 LYS A 41 16.589 -22.080 -17.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.349 -22.114 -18.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.973 -23.693 -18.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 13.852 -23.205 -17.450 1.00 0.00 H new ATOM 611 N VAL A 42 17.375 -23.968 -11.227 1.00 0.00 N ATOM 612 CA VAL A 42 18.134 -24.491 -10.098 1.00 0.00 C ATOM 613 C VAL A 42 17.354 -24.342 -8.796 1.00 0.00 C ATOM 614 O VAL A 42 17.575 -25.085 -7.839 1.00 0.00 O ATOM 615 CB VAL A 42 19.491 -23.776 -9.954 1.00 0.00 C ATOM 616 CG1 VAL A 42 20.253 -24.312 -8.751 1.00 0.00 C ATOM 617 CG2 VAL A 42 20.311 -23.931 -11.226 1.00 0.00 C ATOM 0 H VAL A 42 17.858 -23.245 -11.761 1.00 0.00 H new ATOM 0 HA VAL A 42 18.308 -25.549 -10.296 1.00 0.00 H new ATOM 0 HB VAL A 42 19.307 -22.714 -9.793 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.209 -23.795 -8.666 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.668 -24.145 -7.846 1.00 0.00 H new ATOM 0 HG13 VAL A 42 20.429 -25.380 -8.878 1.00 0.00 H new ATOM 0 HG21 VAL A 42 21.267 -23.420 -11.107 1.00 0.00 H new ATOM 0 HG22 VAL A 42 20.487 -24.989 -11.419 1.00 0.00 H new ATOM 0 HG23 VAL A 42 19.768 -23.495 -12.064 1.00 0.00 H new ATOM 627 N VAL A 43 16.440 -23.378 -8.767 1.00 0.00 N ATOM 628 CA VAL A 43 15.625 -23.133 -7.583 1.00 0.00 C ATOM 629 C VAL A 43 14.413 -24.058 -7.549 1.00 0.00 C ATOM 630 O VAL A 43 13.868 -24.343 -6.483 1.00 0.00 O ATOM 631 CB VAL A 43 15.143 -21.671 -7.527 1.00 0.00 C ATOM 632 CG1 VAL A 43 16.328 -20.718 -7.531 1.00 0.00 C ATOM 633 CG2 VAL A 43 14.205 -21.374 -8.687 1.00 0.00 C ATOM 0 H VAL A 43 16.245 -22.754 -9.550 1.00 0.00 H new ATOM 0 HA VAL A 43 16.256 -23.334 -6.717 1.00 0.00 H new ATOM 0 HB VAL A 43 14.592 -21.524 -6.598 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.968 -19.690 -7.491 1.00 0.00 H new ATOM 0 HG12 VAL A 43 16.957 -20.916 -6.663 1.00 0.00 H new ATOM 0 HG13 VAL A 43 16.909 -20.864 -8.442 1.00 0.00 H new ATOM 0 HG21 VAL A 43 13.874 -20.337 -8.631 1.00 0.00 H new ATOM 0 HG22 VAL A 43 14.728 -21.538 -9.629 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.339 -22.034 -8.633 1.00 0.00 H new ATOM 643 N GLN A 44 13.997 -24.523 -8.723 1.00 0.00 N ATOM 644 CA GLN A 44 12.849 -25.416 -8.826 1.00 0.00 C ATOM 645 C GLN A 44 13.205 -26.818 -8.343 1.00 0.00 C ATOM 646 O GLN A 44 12.397 -27.486 -7.697 1.00 0.00 O ATOM 647 CB GLN A 44 12.349 -25.472 -10.271 1.00 0.00 C ATOM 648 CG GLN A 44 11.848 -24.136 -10.794 1.00 0.00 C ATOM 649 CD GLN A 44 10.581 -24.269 -11.616 1.00 0.00 C ATOM 650 OE1 GLN A 44 9.621 -24.916 -11.197 1.00 0.00 O ATOM 651 NE2 GLN A 44 10.572 -23.656 -12.794 1.00 0.00 N ATOM 0 H GLN A 44 14.437 -24.296 -9.615 1.00 0.00 H new ATOM 0 HA GLN A 44 12.056 -25.024 -8.189 1.00 0.00 H new ATOM 0 HB2 GLN A 44 13.157 -25.824 -10.913 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.545 -26.204 -10.340 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.663 -23.467 -9.953 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.625 -23.674 -11.403 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.390 -23.130 -13.102 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.747 -23.711 -13.391 1.00 0.00 H new ATOM 660 N MET A 45 14.417 -27.258 -8.662 1.00 0.00 N ATOM 661 CA MET A 45 14.880 -28.582 -8.259 1.00 0.00 C ATOM 662 C MET A 45 14.754 -28.766 -6.750 1.00 0.00 C ATOM 663 O MET A 45 14.864 -27.807 -5.985 1.00 0.00 O ATOM 664 CB MET A 45 16.333 -28.791 -8.691 1.00 0.00 C ATOM 665 CG MET A 45 17.329 -27.973 -7.886 1.00 0.00 C ATOM 666 SD MET A 45 18.515 -29.001 -6.997 1.00 0.00 S ATOM 667 CE MET A 45 19.371 -29.785 -8.361 1.00 0.00 C ATOM 0 H MET A 45 15.097 -26.718 -9.198 1.00 0.00 H new ATOM 0 HA MET A 45 14.252 -29.325 -8.751 1.00 0.00 H new ATOM 0 HB2 MET A 45 16.583 -29.848 -8.597 1.00 0.00 H new ATOM 0 HB3 MET A 45 16.431 -28.533 -9.745 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.866 -27.301 -8.555 1.00 0.00 H new ATOM 0 HG3 MET A 45 16.789 -27.349 -7.174 1.00 0.00 H new ATOM 0 HE1 MET A 45 20.311 -30.207 -8.006 1.00 0.00 H new ATOM 0 HE2 MET A 45 18.749 -30.580 -8.772 1.00 0.00 H new ATOM 0 HE3 MET A 45 19.574 -29.046 -9.136 1.00 0.00 H new ATOM 677 N THR A 46 14.521 -30.004 -6.327 1.00 0.00 N ATOM 678 CA THR A 46 14.378 -30.314 -4.910 1.00 0.00 C ATOM 679 C THR A 46 15.621 -31.013 -4.372 1.00 0.00 C ATOM 680 O THR A 46 16.514 -31.384 -5.132 1.00 0.00 O ATOM 681 CB THR A 46 13.148 -31.205 -4.651 1.00 0.00 C ATOM 682 OG1 THR A 46 12.934 -31.345 -3.242 1.00 0.00 O ATOM 683 CG2 THR A 46 13.332 -32.577 -5.280 1.00 0.00 C ATOM 0 H THR A 46 14.427 -30.809 -6.946 1.00 0.00 H new ATOM 0 HA THR A 46 14.245 -29.365 -4.391 1.00 0.00 H new ATOM 0 HB THR A 46 12.279 -30.729 -5.105 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.150 -31.911 -3.085 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.451 -33.188 -5.084 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.466 -32.469 -6.356 1.00 0.00 H new ATOM 0 HG23 THR A 46 14.211 -33.059 -4.851 1.00 0.00 H new ATOM 691 N ASN A 47 15.671 -31.192 -3.056 1.00 0.00 N ATOM 692 CA ASN A 47 16.805 -31.848 -2.416 1.00 0.00 C ATOM 693 C ASN A 47 17.101 -33.190 -3.077 1.00 0.00 C ATOM 694 O ASN A 47 18.251 -33.627 -3.132 1.00 0.00 O ATOM 695 CB ASN A 47 16.529 -32.051 -0.925 1.00 0.00 C ATOM 696 CG ASN A 47 15.942 -30.815 -0.272 1.00 0.00 C ATOM 697 OD1 ASN A 47 14.775 -30.483 -0.483 1.00 0.00 O ATOM 698 ND2 ASN A 47 16.750 -30.127 0.526 1.00 0.00 N ATOM 0 H ASN A 47 14.939 -30.892 -2.412 1.00 0.00 H new ATOM 0 HA ASN A 47 17.678 -31.205 -2.533 1.00 0.00 H new ATOM 0 HB2 ASN A 47 15.842 -32.888 -0.796 1.00 0.00 H new ATOM 0 HB3 ASN A 47 17.457 -32.320 -0.420 1.00 0.00 H new ATOM 0 HD21 ASN A 47 16.411 -29.286 0.993 1.00 0.00 H new ATOM 0 HD22 ASN A 47 17.710 -30.439 0.672 1.00 0.00 H new ATOM 705 N ASP A 48 16.056 -33.839 -3.579 1.00 0.00 N ATOM 706 CA ASP A 48 16.203 -35.132 -4.239 1.00 0.00 C ATOM 707 C ASP A 48 16.970 -34.988 -5.550 1.00 0.00 C ATOM 708 O ASP A 48 17.814 -35.821 -5.881 1.00 0.00 O ATOM 709 CB ASP A 48 14.831 -35.753 -4.501 1.00 0.00 C ATOM 710 CG ASP A 48 13.857 -35.506 -3.366 1.00 0.00 C ATOM 711 OD1 ASP A 48 14.290 -35.535 -2.196 1.00 0.00 O ATOM 712 OD2 ASP A 48 12.660 -35.285 -3.649 1.00 0.00 O ATOM 0 H ASP A 48 15.098 -33.491 -3.542 1.00 0.00 H new ATOM 0 HA ASP A 48 16.769 -35.788 -3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 48 14.420 -35.343 -5.424 1.00 0.00 H new ATOM 0 HB3 ASP A 48 14.944 -36.827 -4.652 1.00 0.00 H new ATOM 717 N ASP A 49 16.670 -33.928 -6.292 1.00 0.00 N ATOM 718 CA ASP A 49 17.330 -33.676 -7.567 1.00 0.00 C ATOM 719 C ASP A 49 18.840 -33.561 -7.383 1.00 0.00 C ATOM 720 O ASP A 49 19.614 -33.925 -8.269 1.00 0.00 O ATOM 721 CB ASP A 49 16.783 -32.398 -8.205 1.00 0.00 C ATOM 722 CG ASP A 49 15.313 -32.511 -8.557 1.00 0.00 C ATOM 723 OD1 ASP A 49 14.698 -33.541 -8.211 1.00 0.00 O ATOM 724 OD2 ASP A 49 14.777 -31.569 -9.178 1.00 0.00 O ATOM 0 H ASP A 49 15.974 -33.229 -6.032 1.00 0.00 H new ATOM 0 HA ASP A 49 17.125 -34.519 -8.227 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.926 -31.563 -7.519 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.353 -32.172 -9.106 1.00 0.00 H new ATOM 729 N VAL A 50 19.254 -33.050 -6.228 1.00 0.00 N ATOM 730 CA VAL A 50 20.671 -32.887 -5.927 1.00 0.00 C ATOM 731 C VAL A 50 21.377 -34.236 -5.855 1.00 0.00 C ATOM 732 O VAL A 50 22.594 -34.322 -6.017 1.00 0.00 O ATOM 733 CB VAL A 50 20.880 -32.138 -4.597 1.00 0.00 C ATOM 734 CG1 VAL A 50 22.363 -32.009 -4.285 1.00 0.00 C ATOM 735 CG2 VAL A 50 20.216 -30.771 -4.646 1.00 0.00 C ATOM 0 H VAL A 50 18.627 -32.742 -5.485 1.00 0.00 H new ATOM 0 HA VAL A 50 21.101 -32.299 -6.738 1.00 0.00 H new ATOM 0 HB VAL A 50 20.414 -32.714 -3.798 1.00 0.00 H new ATOM 0 HG11 VAL A 50 22.492 -31.477 -3.342 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.806 -33.002 -4.205 1.00 0.00 H new ATOM 0 HG13 VAL A 50 22.856 -31.455 -5.084 1.00 0.00 H new ATOM 0 HG21 VAL A 50 20.374 -30.256 -3.698 1.00 0.00 H new ATOM 0 HG22 VAL A 50 20.651 -30.184 -5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 50 19.147 -30.892 -4.820 1.00 0.00 H new ATOM 745 N LYS A 51 20.604 -35.289 -5.611 1.00 0.00 N ATOM 746 CA LYS A 51 21.154 -36.637 -5.519 1.00 0.00 C ATOM 747 C LYS A 51 21.114 -37.334 -6.875 1.00 0.00 C ATOM 748 O LYS A 51 21.849 -38.293 -7.112 1.00 0.00 O ATOM 749 CB LYS A 51 20.375 -37.457 -4.488 1.00 0.00 C ATOM 750 CG LYS A 51 20.253 -36.776 -3.136 1.00 0.00 C ATOM 751 CD LYS A 51 19.568 -37.675 -2.119 1.00 0.00 C ATOM 752 CE LYS A 51 20.381 -38.932 -1.850 1.00 0.00 C ATOM 753 NZ LYS A 51 20.714 -39.078 -0.406 1.00 0.00 N ATOM 0 H LYS A 51 19.595 -35.235 -5.473 1.00 0.00 H new ATOM 0 HA LYS A 51 22.194 -36.559 -5.202 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.376 -37.658 -4.876 1.00 0.00 H new ATOM 0 HB3 LYS A 51 20.866 -38.421 -4.357 1.00 0.00 H new ATOM 0 HG2 LYS A 51 21.244 -36.504 -2.774 1.00 0.00 H new ATOM 0 HG3 LYS A 51 19.688 -35.850 -3.243 1.00 0.00 H new ATOM 0 HD2 LYS A 51 19.423 -37.128 -1.187 1.00 0.00 H new ATOM 0 HD3 LYS A 51 18.579 -37.951 -2.484 1.00 0.00 H new ATOM 0 HE2 LYS A 51 19.821 -39.805 -2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 51 21.301 -38.901 -2.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 21.311 -39.919 -0.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 21.226 -38.233 -0.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 19.837 -39.184 0.143 1.00 0.00 H new ATOM 767 N ARG A 52 20.252 -36.847 -7.761 1.00 0.00 N ATOM 768 CA ARG A 52 20.117 -37.424 -9.093 1.00 0.00 C ATOM 769 C ARG A 52 21.135 -36.817 -10.054 1.00 0.00 C ATOM 770 O ARG A 52 21.662 -37.504 -10.929 1.00 0.00 O ATOM 771 CB ARG A 52 18.700 -37.202 -9.627 1.00 0.00 C ATOM 772 CG ARG A 52 18.468 -37.803 -11.003 1.00 0.00 C ATOM 773 CD ARG A 52 16.989 -38.042 -11.264 1.00 0.00 C ATOM 774 NE ARG A 52 16.771 -39.038 -12.309 1.00 0.00 N ATOM 775 CZ ARG A 52 15.632 -39.162 -12.981 1.00 0.00 C ATOM 776 NH1 ARG A 52 14.613 -38.355 -12.719 1.00 0.00 N ATOM 777 NH2 ARG A 52 15.510 -40.094 -13.918 1.00 0.00 N ATOM 0 H ARG A 52 19.636 -36.054 -7.581 1.00 0.00 H new ATOM 0 HA ARG A 52 20.306 -38.495 -9.019 1.00 0.00 H new ATOM 0 HB2 ARG A 52 17.985 -37.633 -8.926 1.00 0.00 H new ATOM 0 HB3 ARG A 52 18.500 -36.131 -9.669 1.00 0.00 H new ATOM 0 HG2 ARG A 52 18.870 -37.136 -11.765 1.00 0.00 H new ATOM 0 HG3 ARG A 52 19.010 -38.745 -11.086 1.00 0.00 H new ATOM 0 HD2 ARG A 52 16.507 -38.371 -10.343 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.516 -37.104 -11.553 1.00 0.00 H new ATOM 0 HE ARG A 52 17.536 -39.674 -12.536 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.703 -37.637 -12.000 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.739 -38.452 -13.236 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.292 -40.716 -14.123 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.635 -40.188 -14.433 1.00 0.00 H new ATOM 791 N ILE A 53 21.405 -35.527 -9.885 1.00 0.00 N ATOM 792 CA ILE A 53 22.360 -34.829 -10.736 1.00 0.00 C ATOM 793 C ILE A 53 23.689 -35.573 -10.796 1.00 0.00 C ATOM 794 O ILE A 53 24.386 -35.540 -11.810 1.00 0.00 O ATOM 795 CB ILE A 53 22.610 -33.392 -10.241 1.00 0.00 C ATOM 796 CG1 ILE A 53 22.922 -33.392 -8.743 1.00 0.00 C ATOM 797 CG2 ILE A 53 21.404 -32.513 -10.536 1.00 0.00 C ATOM 798 CD1 ILE A 53 23.392 -32.052 -8.224 1.00 0.00 C ATOM 0 H ILE A 53 20.976 -34.944 -9.166 1.00 0.00 H new ATOM 0 HA ILE A 53 21.923 -34.790 -11.734 1.00 0.00 H new ATOM 0 HB ILE A 53 23.471 -32.985 -10.772 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.029 -33.692 -8.194 1.00 0.00 H new ATOM 0 HG13 ILE A 53 23.688 -34.140 -8.540 1.00 0.00 H new ATOM 0 HG21 ILE A 53 21.596 -31.501 -10.180 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.223 -32.492 -11.611 1.00 0.00 H new ATOM 0 HG23 ILE A 53 20.527 -32.916 -10.029 1.00 0.00 H new ATOM 0 HD11 ILE A 53 23.594 -32.126 -7.156 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.303 -31.759 -8.746 1.00 0.00 H new ATOM 0 HD13 ILE A 53 22.618 -31.304 -8.395 1.00 0.00 H new ATOM 810 N GLY A 54 24.035 -36.245 -9.703 1.00 0.00 N ATOM 811 CA GLY A 54 25.280 -36.990 -9.652 1.00 0.00 C ATOM 812 C GLY A 54 25.852 -37.068 -8.251 1.00 0.00 C ATOM 813 O GLY A 54 26.463 -38.069 -7.877 1.00 0.00 O ATOM 0 H GLY A 54 23.475 -36.287 -8.851 1.00 0.00 H new ATOM 0 HA2 GLY A 54 25.112 -37.999 -10.029 1.00 0.00 H new ATOM 0 HA3 GLY A 54 26.008 -36.520 -10.313 1.00 0.00 H new ATOM 817 N VAL A 55 25.657 -36.007 -7.474 1.00 0.00 N ATOM 818 CA VAL A 55 26.159 -35.959 -6.106 1.00 0.00 C ATOM 819 C VAL A 55 25.592 -37.102 -5.272 1.00 0.00 C ATOM 820 O VAL A 55 24.377 -37.226 -5.115 1.00 0.00 O ATOM 821 CB VAL A 55 25.811 -34.621 -5.427 1.00 0.00 C ATOM 822 CG1 VAL A 55 26.511 -34.507 -4.081 1.00 0.00 C ATOM 823 CG2 VAL A 55 26.181 -33.454 -6.330 1.00 0.00 C ATOM 0 H VAL A 55 25.155 -35.169 -7.769 1.00 0.00 H new ATOM 0 HA VAL A 55 27.243 -36.058 -6.163 1.00 0.00 H new ATOM 0 HB VAL A 55 24.735 -34.590 -5.254 1.00 0.00 H new ATOM 0 HG11 VAL A 55 26.253 -33.555 -3.616 1.00 0.00 H new ATOM 0 HG12 VAL A 55 26.192 -35.325 -3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 55 27.590 -34.559 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 55 25.928 -32.516 -5.835 1.00 0.00 H new ATOM 0 HG22 VAL A 55 27.251 -33.479 -6.536 1.00 0.00 H new ATOM 0 HG23 VAL A 55 25.629 -33.530 -7.267 1.00 0.00 H new ATOM 833 N ARG A 56 26.479 -37.935 -4.738 1.00 0.00 N ATOM 834 CA ARG A 56 26.066 -39.069 -3.920 1.00 0.00 C ATOM 835 C ARG A 56 26.624 -38.950 -2.504 1.00 0.00 C ATOM 836 O ARG A 56 26.196 -39.662 -1.595 1.00 0.00 O ATOM 837 CB ARG A 56 26.534 -40.380 -4.555 1.00 0.00 C ATOM 838 CG ARG A 56 27.988 -40.359 -4.996 1.00 0.00 C ATOM 839 CD ARG A 56 28.113 -40.461 -6.508 1.00 0.00 C ATOM 840 NE ARG A 56 29.292 -39.760 -7.008 1.00 0.00 N ATOM 841 CZ ARG A 56 29.525 -39.541 -8.298 1.00 0.00 C ATOM 842 NH1 ARG A 56 28.663 -39.965 -9.212 1.00 0.00 N ATOM 843 NH2 ARG A 56 30.621 -38.895 -8.675 1.00 0.00 N ATOM 0 H ARG A 56 27.488 -37.846 -4.857 1.00 0.00 H new ATOM 0 HA ARG A 56 24.977 -39.068 -3.865 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.392 -41.191 -3.841 1.00 0.00 H new ATOM 0 HB3 ARG A 56 25.905 -40.601 -5.417 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.460 -39.439 -4.652 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.523 -41.186 -4.529 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.165 -41.511 -6.797 1.00 0.00 H new ATOM 0 HD3 ARG A 56 27.220 -40.046 -6.974 1.00 0.00 H new ATOM 0 HE ARG A 56 29.974 -39.420 -6.330 1.00 0.00 H new ATOM 0 HH11 ARG A 56 27.819 -40.461 -8.926 1.00 0.00 H new ATOM 0 HH12 ARG A 56 28.844 -39.796 -10.201 1.00 0.00 H new ATOM 0 HH21 ARG A 56 31.286 -38.566 -7.975 1.00 0.00 H new ATOM 0 HH22 ARG A 56 30.799 -38.727 -9.665 1.00 0.00 H new ATOM 857 N LEU A 57 27.582 -38.047 -2.326 1.00 0.00 N ATOM 858 CA LEU A 57 28.199 -37.834 -1.021 1.00 0.00 C ATOM 859 C LEU A 57 27.285 -37.020 -0.112 1.00 0.00 C ATOM 860 O LEU A 57 26.429 -36.261 -0.570 1.00 0.00 O ATOM 861 CB LEU A 57 29.544 -37.122 -1.182 1.00 0.00 C ATOM 862 CG LEU A 57 30.680 -37.958 -1.773 1.00 0.00 C ATOM 863 CD1 LEU A 57 31.958 -37.138 -1.855 1.00 0.00 C ATOM 864 CD2 LEU A 57 30.903 -39.215 -0.945 1.00 0.00 C ATOM 0 H LEU A 57 27.948 -37.451 -3.068 1.00 0.00 H new ATOM 0 HA LEU A 57 28.363 -38.808 -0.560 1.00 0.00 H new ATOM 0 HB2 LEU A 57 29.396 -36.247 -1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 57 29.859 -36.758 -0.204 1.00 0.00 H new ATOM 0 HG LEU A 57 30.399 -38.257 -2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 57 32.756 -37.749 -2.278 1.00 0.00 H new ATOM 0 HD12 LEU A 57 31.792 -36.268 -2.490 1.00 0.00 H new ATOM 0 HD13 LEU A 57 32.244 -36.809 -0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 57 31.715 -39.798 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 57 31.163 -38.937 0.076 1.00 0.00 H new ATOM 0 HD23 LEU A 57 29.991 -39.812 -0.937 1.00 0.00 H new ATOM 876 N PRO A 58 27.469 -37.176 1.207 1.00 0.00 N ATOM 877 CA PRO A 58 26.672 -36.462 2.208 1.00 0.00 C ATOM 878 C PRO A 58 26.986 -34.970 2.242 1.00 0.00 C ATOM 879 O PRO A 58 26.084 -34.135 2.218 1.00 0.00 O ATOM 880 CB PRO A 58 27.081 -37.124 3.526 1.00 0.00 C ATOM 881 CG PRO A 58 28.446 -37.663 3.272 1.00 0.00 C ATOM 882 CD PRO A 58 28.471 -38.063 1.823 1.00 0.00 C ATOM 0 HA PRO A 58 25.604 -36.523 1.998 1.00 0.00 H new ATOM 0 HB2 PRO A 58 27.085 -36.405 4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 58 26.387 -37.918 3.802 1.00 0.00 H new ATOM 0 HG2 PRO A 58 29.207 -36.912 3.483 1.00 0.00 H new ATOM 0 HG3 PRO A 58 28.654 -38.517 3.916 1.00 0.00 H new ATOM 0 HD2 PRO A 58 29.458 -37.920 1.384 1.00 0.00 H new ATOM 0 HD3 PRO A 58 28.213 -39.114 1.692 1.00 0.00 H new ATOM 890 N GLY A 59 28.274 -34.642 2.299 1.00 0.00 N ATOM 891 CA GLY A 59 28.684 -33.250 2.335 1.00 0.00 C ATOM 892 C GLY A 59 28.351 -32.515 1.052 1.00 0.00 C ATOM 893 O GLY A 59 27.702 -31.468 1.079 1.00 0.00 O ATOM 0 H GLY A 59 29.040 -35.315 2.321 1.00 0.00 H new ATOM 0 HA2 GLY A 59 28.196 -32.752 3.173 1.00 0.00 H new ATOM 0 HA3 GLY A 59 29.758 -33.195 2.513 1.00 0.00 H new ATOM 897 N HIS A 60 28.799 -33.060 -0.074 1.00 0.00 N ATOM 898 CA HIS A 60 28.546 -32.448 -1.374 1.00 0.00 C ATOM 899 C HIS A 60 27.059 -32.156 -1.556 1.00 0.00 C ATOM 900 O HIS A 60 26.684 -31.214 -2.254 1.00 0.00 O ATOM 901 CB HIS A 60 29.040 -33.360 -2.496 1.00 0.00 C ATOM 902 CG HIS A 60 30.529 -33.519 -2.527 1.00 0.00 C ATOM 903 ND1 HIS A 60 31.214 -33.980 -3.632 1.00 0.00 N ATOM 904 CD2 HIS A 60 31.465 -33.274 -1.581 1.00 0.00 C ATOM 905 CE1 HIS A 60 32.507 -34.013 -3.363 1.00 0.00 C ATOM 906 NE2 HIS A 60 32.686 -33.589 -2.125 1.00 0.00 N ATOM 0 H HIS A 60 29.339 -33.924 -0.113 1.00 0.00 H new ATOM 0 HA HIS A 60 29.092 -31.505 -1.417 1.00 0.00 H new ATOM 0 HB2 HIS A 60 28.580 -34.342 -2.384 1.00 0.00 H new ATOM 0 HB3 HIS A 60 28.706 -32.959 -3.453 1.00 0.00 H new ATOM 0 HD2 HIS A 60 31.285 -32.900 -0.584 1.00 0.00 H new ATOM 0 HE1 HIS A 60 33.285 -34.332 -4.040 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.585 -33.509 -1.650 1.00 0.00 H new ATOM 914 N GLN A 61 26.219 -32.970 -0.925 1.00 0.00 N ATOM 915 CA GLN A 61 24.774 -32.799 -1.020 1.00 0.00 C ATOM 916 C GLN A 61 24.317 -31.579 -0.228 1.00 0.00 C ATOM 917 O GLN A 61 23.740 -30.644 -0.785 1.00 0.00 O ATOM 918 CB GLN A 61 24.057 -34.050 -0.511 1.00 0.00 C ATOM 919 CG GLN A 61 23.829 -35.101 -1.586 1.00 0.00 C ATOM 920 CD GLN A 61 23.057 -36.301 -1.074 1.00 0.00 C ATOM 921 OE1 GLN A 61 22.254 -36.189 -0.148 1.00 0.00 O ATOM 922 NE2 GLN A 61 23.298 -37.460 -1.676 1.00 0.00 N ATOM 0 H GLN A 61 26.514 -33.754 -0.343 1.00 0.00 H new ATOM 0 HA GLN A 61 24.520 -32.644 -2.069 1.00 0.00 H new ATOM 0 HB2 GLN A 61 24.641 -34.490 0.297 1.00 0.00 H new ATOM 0 HB3 GLN A 61 23.095 -33.760 -0.088 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.286 -34.652 -2.418 1.00 0.00 H new ATOM 0 HG3 GLN A 61 24.792 -35.432 -1.975 1.00 0.00 H new ATOM 0 HE21 GLN A 61 23.972 -37.507 -2.440 1.00 0.00 H new ATOM 0 HE22 GLN A 61 22.809 -38.303 -1.374 1.00 0.00 H new ATOM 931 N LYS A 62 24.578 -31.593 1.075 1.00 0.00 N ATOM 932 CA LYS A 62 24.195 -30.488 1.945 1.00 0.00 C ATOM 933 C LYS A 62 24.817 -29.179 1.468 1.00 0.00 C ATOM 934 O LYS A 62 24.186 -28.124 1.526 1.00 0.00 O ATOM 935 CB LYS A 62 24.623 -30.773 3.386 1.00 0.00 C ATOM 936 CG LYS A 62 23.506 -31.325 4.255 1.00 0.00 C ATOM 937 CD LYS A 62 23.762 -31.057 5.728 1.00 0.00 C ATOM 938 CE LYS A 62 22.690 -30.158 6.326 1.00 0.00 C ATOM 939 NZ LYS A 62 23.269 -29.142 7.248 1.00 0.00 N ATOM 0 H LYS A 62 25.054 -32.359 1.552 1.00 0.00 H new ATOM 0 HA LYS A 62 23.110 -30.389 1.908 1.00 0.00 H new ATOM 0 HB2 LYS A 62 25.450 -31.484 3.377 1.00 0.00 H new ATOM 0 HB3 LYS A 62 24.999 -29.853 3.833 1.00 0.00 H new ATOM 0 HG2 LYS A 62 22.558 -30.874 3.961 1.00 0.00 H new ATOM 0 HG3 LYS A 62 23.412 -32.398 4.090 1.00 0.00 H new ATOM 0 HD2 LYS A 62 23.791 -32.002 6.271 1.00 0.00 H new ATOM 0 HD3 LYS A 62 24.739 -30.590 5.849 1.00 0.00 H new ATOM 0 HE2 LYS A 62 22.149 -29.655 5.524 1.00 0.00 H new ATOM 0 HE3 LYS A 62 21.965 -30.767 6.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 22.507 -28.549 7.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 23.763 -29.622 8.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 23.942 -28.544 6.727 1.00 0.00 H new ATOM 953 N ARG A 63 26.057 -29.256 0.996 1.00 0.00 N ATOM 954 CA ARG A 63 26.764 -28.078 0.509 1.00 0.00 C ATOM 955 C ARG A 63 25.943 -27.352 -0.553 1.00 0.00 C ATOM 956 O ARG A 63 25.934 -26.122 -0.611 1.00 0.00 O ATOM 957 CB ARG A 63 28.125 -28.474 -0.065 1.00 0.00 C ATOM 958 CG ARG A 63 29.045 -27.292 -0.325 1.00 0.00 C ATOM 959 CD ARG A 63 30.447 -27.551 0.203 1.00 0.00 C ATOM 960 NE ARG A 63 31.099 -26.322 0.650 1.00 0.00 N ATOM 961 CZ ARG A 63 32.358 -26.270 1.071 1.00 0.00 C ATOM 962 NH1 ARG A 63 33.096 -27.370 1.102 1.00 0.00 N ATOM 963 NH2 ARG A 63 32.880 -25.114 1.461 1.00 0.00 N ATOM 0 H ARG A 63 26.593 -30.122 0.941 1.00 0.00 H new ATOM 0 HA ARG A 63 26.916 -27.403 1.351 1.00 0.00 H new ATOM 0 HB2 ARG A 63 28.615 -29.160 0.626 1.00 0.00 H new ATOM 0 HB3 ARG A 63 27.972 -29.016 -0.998 1.00 0.00 H new ATOM 0 HG2 ARG A 63 29.089 -27.093 -1.396 1.00 0.00 H new ATOM 0 HG3 ARG A 63 28.636 -26.400 0.149 1.00 0.00 H new ATOM 0 HD2 ARG A 63 30.398 -28.257 1.032 1.00 0.00 H new ATOM 0 HD3 ARG A 63 31.048 -28.017 -0.578 1.00 0.00 H new ATOM 0 HE ARG A 63 30.558 -25.457 0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 63 32.698 -28.260 0.802 1.00 0.00 H new ATOM 0 HH12 ARG A 63 34.062 -27.327 1.426 1.00 0.00 H new ATOM 0 HH21 ARG A 63 32.315 -24.265 1.438 1.00 0.00 H new ATOM 0 HH22 ARG A 63 33.847 -25.074 1.784 1.00 0.00 H new ATOM 977 N ILE A 64 25.257 -28.122 -1.391 1.00 0.00 N ATOM 978 CA ILE A 64 24.434 -27.552 -2.450 1.00 0.00 C ATOM 979 C ILE A 64 23.028 -27.243 -1.948 1.00 0.00 C ATOM 980 O ILE A 64 22.495 -26.159 -2.189 1.00 0.00 O ATOM 981 CB ILE A 64 24.337 -28.500 -3.660 1.00 0.00 C ATOM 982 CG1 ILE A 64 25.732 -28.804 -4.210 1.00 0.00 C ATOM 983 CG2 ILE A 64 23.456 -27.892 -4.741 1.00 0.00 C ATOM 984 CD1 ILE A 64 25.723 -29.745 -5.395 1.00 0.00 C ATOM 0 H ILE A 64 25.255 -29.141 -1.357 1.00 0.00 H new ATOM 0 HA ILE A 64 24.918 -26.626 -2.761 1.00 0.00 H new ATOM 0 HB ILE A 64 23.883 -29.436 -3.334 1.00 0.00 H new ATOM 0 HG12 ILE A 64 26.210 -27.869 -4.502 1.00 0.00 H new ATOM 0 HG13 ILE A 64 26.340 -29.238 -3.416 1.00 0.00 H new ATOM 0 HG21 ILE A 64 23.398 -28.574 -5.589 1.00 0.00 H new ATOM 0 HG22 ILE A 64 22.456 -27.722 -4.342 1.00 0.00 H new ATOM 0 HG23 ILE A 64 23.882 -26.943 -5.067 1.00 0.00 H new ATOM 0 HD11 ILE A 64 26.745 -29.915 -5.732 1.00 0.00 H new ATOM 0 HD12 ILE A 64 25.274 -30.694 -5.102 1.00 0.00 H new ATOM 0 HD13 ILE A 64 25.143 -29.304 -6.205 1.00 0.00 H new ATOM 996 N ALA A 65 22.432 -28.201 -1.246 1.00 0.00 N ATOM 997 CA ALA A 65 21.089 -28.030 -0.705 1.00 0.00 C ATOM 998 C ALA A 65 20.994 -26.763 0.138 1.00 0.00 C ATOM 999 O ALA A 65 20.034 -26.000 0.025 1.00 0.00 O ATOM 1000 CB ALA A 65 20.693 -29.246 0.120 1.00 0.00 C ATOM 0 H ALA A 65 22.858 -29.104 -1.038 1.00 0.00 H new ATOM 0 HA ALA A 65 20.397 -27.931 -1.542 1.00 0.00 H new ATOM 0 HB1 ALA A 65 19.688 -29.104 0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 65 20.712 -30.135 -0.510 1.00 0.00 H new ATOM 0 HB3 ALA A 65 21.395 -29.371 0.944 1.00 0.00 H new ATOM 1006 N TYR A 66 21.995 -26.544 0.984 1.00 0.00 N ATOM 1007 CA TYR A 66 22.023 -25.371 1.849 1.00 0.00 C ATOM 1008 C TYR A 66 22.136 -24.091 1.027 1.00 0.00 C ATOM 1009 O TYR A 66 21.621 -23.043 1.415 1.00 0.00 O ATOM 1010 CB TYR A 66 23.191 -25.463 2.832 1.00 0.00 C ATOM 1011 CG TYR A 66 23.036 -24.570 4.042 1.00 0.00 C ATOM 1012 CD1 TYR A 66 21.847 -24.541 4.761 1.00 0.00 C ATOM 1013 CD2 TYR A 66 24.079 -23.757 4.468 1.00 0.00 C ATOM 1014 CE1 TYR A 66 21.701 -23.725 5.866 1.00 0.00 C ATOM 1015 CE2 TYR A 66 23.942 -22.939 5.573 1.00 0.00 C ATOM 1016 CZ TYR A 66 22.751 -22.927 6.269 1.00 0.00 C ATOM 1017 OH TYR A 66 22.610 -22.115 7.370 1.00 0.00 O ATOM 0 H TYR A 66 22.798 -27.164 1.089 1.00 0.00 H new ATOM 0 HA TYR A 66 21.088 -25.342 2.408 1.00 0.00 H new ATOM 0 HB2 TYR A 66 23.295 -26.496 3.164 1.00 0.00 H new ATOM 0 HB3 TYR A 66 24.113 -25.201 2.313 1.00 0.00 H new ATOM 0 HD1 TYR A 66 21.023 -25.167 4.451 1.00 0.00 H new ATOM 0 HD2 TYR A 66 25.013 -23.765 3.926 1.00 0.00 H new ATOM 0 HE1 TYR A 66 20.769 -23.712 6.412 1.00 0.00 H new ATOM 0 HE2 TYR A 66 24.763 -22.313 5.890 1.00 0.00 H new ATOM 0 HH TYR A 66 23.442 -21.619 7.520 1.00 0.00 H new ATOM 1027 N SER A 67 22.814 -24.185 -0.113 1.00 0.00 N ATOM 1028 CA SER A 67 22.999 -23.035 -0.990 1.00 0.00 C ATOM 1029 C SER A 67 21.716 -22.725 -1.757 1.00 0.00 C ATOM 1030 O SER A 67 21.477 -21.584 -2.154 1.00 0.00 O ATOM 1031 CB SER A 67 24.143 -23.294 -1.971 1.00 0.00 C ATOM 1032 OG SER A 67 25.040 -22.197 -2.009 1.00 0.00 O ATOM 0 H SER A 67 23.244 -25.046 -0.451 1.00 0.00 H new ATOM 0 HA SER A 67 23.249 -22.173 -0.371 1.00 0.00 H new ATOM 0 HB2 SER A 67 24.680 -24.197 -1.679 1.00 0.00 H new ATOM 0 HB3 SER A 67 23.739 -23.472 -2.967 1.00 0.00 H new ATOM 0 HG SER A 67 25.039 -21.805 -2.907 1.00 0.00 H new ATOM 1038 N LEU A 68 20.895 -23.749 -1.961 1.00 0.00 N ATOM 1039 CA LEU A 68 19.636 -23.588 -2.681 1.00 0.00 C ATOM 1040 C LEU A 68 18.676 -22.693 -1.904 1.00 0.00 C ATOM 1041 O LEU A 68 17.939 -21.899 -2.490 1.00 0.00 O ATOM 1042 CB LEU A 68 18.991 -24.952 -2.931 1.00 0.00 C ATOM 1043 CG LEU A 68 19.538 -25.745 -4.118 1.00 0.00 C ATOM 1044 CD1 LEU A 68 18.877 -27.113 -4.196 1.00 0.00 C ATOM 1045 CD2 LEU A 68 19.329 -24.976 -5.415 1.00 0.00 C ATOM 0 H LEU A 68 21.078 -24.699 -1.638 1.00 0.00 H new ATOM 0 HA LEU A 68 19.851 -23.114 -3.639 1.00 0.00 H new ATOM 0 HB2 LEU A 68 19.107 -25.557 -2.031 1.00 0.00 H new ATOM 0 HB3 LEU A 68 17.921 -24.804 -3.080 1.00 0.00 H new ATOM 0 HG LEU A 68 20.609 -25.889 -3.972 1.00 0.00 H new ATOM 0 HD11 LEU A 68 19.279 -27.663 -5.047 1.00 0.00 H new ATOM 0 HD12 LEU A 68 19.077 -27.667 -3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 68 17.801 -26.991 -4.318 1.00 0.00 H new ATOM 0 HD21 LEU A 68 19.724 -25.555 -6.249 1.00 0.00 H new ATOM 0 HD22 LEU A 68 18.264 -24.801 -5.567 1.00 0.00 H new ATOM 0 HD23 LEU A 68 19.849 -24.020 -5.359 1.00 0.00 H new ATOM 1057 N LEU A 69 18.691 -22.826 -0.582 1.00 0.00 N ATOM 1058 CA LEU A 69 17.822 -22.027 0.277 1.00 0.00 C ATOM 1059 C LEU A 69 17.960 -20.542 -0.041 1.00 0.00 C ATOM 1060 O LEU A 69 16.965 -19.827 -0.160 1.00 0.00 O ATOM 1061 CB LEU A 69 18.156 -22.279 1.748 1.00 0.00 C ATOM 1062 CG LEU A 69 18.285 -23.745 2.166 1.00 0.00 C ATOM 1063 CD1 LEU A 69 18.500 -23.855 3.667 1.00 0.00 C ATOM 1064 CD2 LEU A 69 17.052 -24.530 1.742 1.00 0.00 C ATOM 0 H LEU A 69 19.294 -23.479 -0.082 1.00 0.00 H new ATOM 0 HA LEU A 69 16.791 -22.326 0.089 1.00 0.00 H new ATOM 0 HB2 LEU A 69 19.093 -21.772 1.979 1.00 0.00 H new ATOM 0 HB3 LEU A 69 17.383 -21.814 2.360 1.00 0.00 H new ATOM 0 HG LEU A 69 19.153 -24.172 1.664 1.00 0.00 H new ATOM 0 HD11 LEU A 69 18.589 -24.905 3.946 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.413 -23.327 3.943 1.00 0.00 H new ATOM 0 HD13 LEU A 69 17.652 -23.412 4.189 1.00 0.00 H new ATOM 0 HD21 LEU A 69 17.161 -25.571 2.047 1.00 0.00 H new ATOM 0 HD22 LEU A 69 16.168 -24.103 2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 69 16.943 -24.479 0.659 1.00 0.00 H new ATOM 1076 N GLY A 70 19.200 -20.083 -0.178 1.00 0.00 N ATOM 1077 CA GLY A 70 19.445 -18.686 -0.483 1.00 0.00 C ATOM 1078 C GLY A 70 18.893 -18.281 -1.835 1.00 0.00 C ATOM 1079 O GLY A 70 18.469 -17.141 -2.025 1.00 0.00 O ATOM 0 H GLY A 70 20.040 -20.654 -0.083 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.994 -18.064 0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 70 20.518 -18.495 -0.460 1.00 0.00 H new ATOM 1083 N LEU A 71 18.898 -19.217 -2.778 1.00 0.00 N ATOM 1084 CA LEU A 71 18.395 -18.952 -4.122 1.00 0.00 C ATOM 1085 C LEU A 71 16.891 -18.699 -4.100 1.00 0.00 C ATOM 1086 O LEU A 71 16.422 -17.645 -4.530 1.00 0.00 O ATOM 1087 CB LEU A 71 18.712 -20.128 -5.047 1.00 0.00 C ATOM 1088 CG LEU A 71 20.192 -20.486 -5.195 1.00 0.00 C ATOM 1089 CD1 LEU A 71 20.360 -21.698 -6.098 1.00 0.00 C ATOM 1090 CD2 LEU A 71 20.975 -19.300 -5.740 1.00 0.00 C ATOM 0 H LEU A 71 19.245 -20.166 -2.637 1.00 0.00 H new ATOM 0 HA LEU A 71 18.890 -18.057 -4.499 1.00 0.00 H new ATOM 0 HB2 LEU A 71 18.181 -21.006 -4.680 1.00 0.00 H new ATOM 0 HB3 LEU A 71 18.312 -19.904 -6.036 1.00 0.00 H new ATOM 0 HG LEU A 71 20.587 -20.735 -4.210 1.00 0.00 H new ATOM 0 HD11 LEU A 71 21.419 -21.938 -6.192 1.00 0.00 H new ATOM 0 HD12 LEU A 71 19.832 -22.549 -5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 71 19.950 -21.477 -7.083 1.00 0.00 H new ATOM 0 HD21 LEU A 71 22.026 -19.572 -5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 71 20.579 -19.020 -6.716 1.00 0.00 H new ATOM 0 HD23 LEU A 71 20.882 -18.457 -5.056 1.00 0.00 H new ATOM 1102 N LYS A 72 16.140 -19.671 -3.593 1.00 0.00 N ATOM 1103 CA LYS A 72 14.689 -19.553 -3.511 1.00 0.00 C ATOM 1104 C LYS A 72 14.288 -18.337 -2.682 1.00 0.00 C ATOM 1105 O LYS A 72 13.210 -17.774 -2.870 1.00 0.00 O ATOM 1106 CB LYS A 72 14.088 -20.821 -2.901 1.00 0.00 C ATOM 1107 CG LYS A 72 14.496 -22.095 -3.620 1.00 0.00 C ATOM 1108 CD LYS A 72 14.281 -23.321 -2.749 1.00 0.00 C ATOM 1109 CE LYS A 72 15.364 -24.364 -2.976 1.00 0.00 C ATOM 1110 NZ LYS A 72 14.837 -25.567 -3.678 1.00 0.00 N ATOM 0 H LYS A 72 16.512 -20.550 -3.233 1.00 0.00 H new ATOM 0 HA LYS A 72 14.302 -19.425 -4.522 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.391 -20.890 -1.856 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.001 -20.740 -2.913 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.919 -22.195 -4.539 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.546 -22.031 -3.907 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.273 -23.026 -1.700 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.305 -23.756 -2.965 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.172 -23.927 -3.562 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.790 -24.660 -2.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.602 -26.261 -3.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.071 -25.990 -3.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 14.469 -25.291 -4.611 1.00 0.00 H new ATOM 1124 N ASP A 73 15.163 -17.937 -1.766 1.00 0.00 N ATOM 1125 CA ASP A 73 14.901 -16.787 -0.909 1.00 0.00 C ATOM 1126 C ASP A 73 15.186 -15.483 -1.648 1.00 0.00 C ATOM 1127 O ASP A 73 14.385 -14.549 -1.609 1.00 0.00 O ATOM 1128 CB ASP A 73 15.751 -16.864 0.360 1.00 0.00 C ATOM 1129 CG ASP A 73 15.113 -16.141 1.530 1.00 0.00 C ATOM 1130 OD1 ASP A 73 14.347 -15.184 1.289 1.00 0.00 O ATOM 1131 OD2 ASP A 73 15.378 -16.532 2.685 1.00 0.00 O ATOM 0 H ASP A 73 16.060 -18.392 -1.598 1.00 0.00 H new ATOM 0 HA ASP A 73 13.847 -16.805 -0.632 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.909 -17.909 0.625 1.00 0.00 H new ATOM 0 HB3 ASP A 73 16.733 -16.434 0.163 1.00 0.00 H new ATOM 1136 N GLN A 74 16.331 -15.427 -2.320 1.00 0.00 N ATOM 1137 CA GLN A 74 16.722 -14.237 -3.066 1.00 0.00 C ATOM 1138 C GLN A 74 15.668 -13.878 -4.108 1.00 0.00 C ATOM 1139 O GLN A 74 15.182 -12.748 -4.150 1.00 0.00 O ATOM 1140 CB GLN A 74 18.075 -14.457 -3.745 1.00 0.00 C ATOM 1141 CG GLN A 74 19.253 -14.410 -2.786 1.00 0.00 C ATOM 1142 CD GLN A 74 19.854 -13.023 -2.668 1.00 0.00 C ATOM 1143 OE1 GLN A 74 19.177 -12.019 -2.890 1.00 0.00 O ATOM 1144 NE2 GLN A 74 21.133 -12.960 -2.316 1.00 0.00 N ATOM 0 H GLN A 74 17.004 -16.192 -2.363 1.00 0.00 H new ATOM 0 HA GLN A 74 16.808 -13.409 -2.363 1.00 0.00 H new ATOM 0 HB2 GLN A 74 18.066 -15.423 -4.249 1.00 0.00 H new ATOM 0 HB3 GLN A 74 18.213 -13.698 -4.515 1.00 0.00 H new ATOM 0 HG2 GLN A 74 18.929 -14.746 -1.801 1.00 0.00 H new ATOM 0 HG3 GLN A 74 20.020 -15.107 -3.124 1.00 0.00 H new ATOM 0 HE21 GLN A 74 21.657 -13.818 -2.141 1.00 0.00 H new ATOM 0 HE22 GLN A 74 21.592 -12.054 -2.220 1.00 0.00 H new ATOM 1153 N VAL A 75 15.320 -14.847 -4.949 1.00 0.00 N ATOM 1154 CA VAL A 75 14.323 -14.633 -5.991 1.00 0.00 C ATOM 1155 C VAL A 75 13.026 -14.084 -5.407 1.00 0.00 C ATOM 1156 O VAL A 75 12.310 -13.329 -6.062 1.00 0.00 O ATOM 1157 CB VAL A 75 14.019 -15.937 -6.753 1.00 0.00 C ATOM 1158 CG1 VAL A 75 13.470 -16.993 -5.806 1.00 0.00 C ATOM 1159 CG2 VAL A 75 13.047 -15.673 -7.893 1.00 0.00 C ATOM 0 H VAL A 75 15.714 -15.788 -4.929 1.00 0.00 H new ATOM 0 HA VAL A 75 14.742 -13.904 -6.685 1.00 0.00 H new ATOM 0 HB VAL A 75 14.949 -16.314 -7.179 1.00 0.00 H new ATOM 0 HG11 VAL A 75 13.261 -17.907 -6.362 1.00 0.00 H new ATOM 0 HG12 VAL A 75 14.205 -17.201 -5.028 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.550 -16.629 -5.348 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.843 -16.605 -8.421 1.00 0.00 H new ATOM 0 HG22 VAL A 75 12.116 -15.272 -7.492 1.00 0.00 H new ATOM 0 HG23 VAL A 75 13.484 -14.953 -8.584 1.00 0.00 H new ATOM 1169 N ASN A 76 12.731 -14.470 -4.170 1.00 0.00 N ATOM 1170 CA ASN A 76 11.519 -14.017 -3.496 1.00 0.00 C ATOM 1171 C ASN A 76 11.811 -12.816 -2.602 1.00 0.00 C ATOM 1172 O ASN A 76 11.728 -12.904 -1.377 1.00 0.00 O ATOM 1173 CB ASN A 76 10.918 -15.152 -2.665 1.00 0.00 C ATOM 1174 CG ASN A 76 9.940 -15.995 -3.459 1.00 0.00 C ATOM 1175 OD1 ASN A 76 9.128 -15.471 -4.222 1.00 0.00 O ATOM 1176 ND2 ASN A 76 10.013 -17.309 -3.283 1.00 0.00 N ATOM 0 H ASN A 76 13.314 -15.095 -3.614 1.00 0.00 H new ATOM 0 HA ASN A 76 10.801 -13.714 -4.258 1.00 0.00 H new ATOM 0 HB2 ASN A 76 11.720 -15.788 -2.290 1.00 0.00 H new ATOM 0 HB3 ASN A 76 10.410 -14.733 -1.796 1.00 0.00 H new ATOM 0 HD21 ASN A 76 9.380 -17.927 -3.791 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.702 -17.700 -2.640 1.00 0.00 H new ATOM 1183 N THR A 77 12.154 -11.691 -3.224 1.00 0.00 N ATOM 1184 CA THR A 77 12.458 -10.472 -2.485 1.00 0.00 C ATOM 1185 C THR A 77 12.143 -9.233 -3.316 1.00 0.00 C ATOM 1186 O THR A 77 13.020 -8.678 -3.977 1.00 0.00 O ATOM 1187 CB THR A 77 13.938 -10.428 -2.060 1.00 0.00 C ATOM 1188 OG1 THR A 77 14.364 -11.728 -1.635 1.00 0.00 O ATOM 1189 CG2 THR A 77 14.148 -9.427 -0.933 1.00 0.00 C ATOM 0 H THR A 77 12.228 -11.600 -4.237 1.00 0.00 H new ATOM 0 HA THR A 77 11.831 -10.478 -1.593 1.00 0.00 H new ATOM 0 HB THR A 77 14.531 -10.114 -2.919 1.00 0.00 H new ATOM 0 HG1 THR A 77 14.688 -12.235 -2.408 1.00 0.00 H new ATOM 0 HG21 THR A 77 15.200 -9.413 -0.650 1.00 0.00 H new ATOM 0 HG22 THR A 77 13.850 -8.434 -1.268 1.00 0.00 H new ATOM 0 HG23 THR A 77 13.544 -9.716 -0.073 1.00 0.00 H new ATOM 1197 N VAL A 78 10.886 -8.804 -3.276 1.00 0.00 N ATOM 1198 CA VAL A 78 10.455 -7.629 -4.024 1.00 0.00 C ATOM 1199 C VAL A 78 11.002 -6.350 -3.400 1.00 0.00 C ATOM 1200 O VAL A 78 11.379 -5.415 -4.105 1.00 0.00 O ATOM 1201 CB VAL A 78 8.919 -7.538 -4.092 1.00 0.00 C ATOM 1202 CG1 VAL A 78 8.491 -6.378 -4.978 1.00 0.00 C ATOM 1203 CG2 VAL A 78 8.330 -8.848 -4.593 1.00 0.00 C ATOM 0 H VAL A 78 10.148 -9.253 -2.733 1.00 0.00 H new ATOM 0 HA VAL A 78 10.850 -7.735 -5.035 1.00 0.00 H new ATOM 0 HB VAL A 78 8.538 -7.355 -3.087 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.403 -6.330 -5.014 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.882 -5.446 -4.571 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.881 -6.526 -5.985 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.244 -8.766 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 78 8.716 -9.063 -5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 78 8.607 -9.655 -3.914 1.00 0.00 H new ATOM 1213 N GLY A 79 11.042 -6.316 -2.071 1.00 0.00 N ATOM 1214 CA GLY A 79 11.545 -5.147 -1.374 1.00 0.00 C ATOM 1215 C GLY A 79 10.623 -4.696 -0.258 1.00 0.00 C ATOM 1216 O GLY A 79 10.527 -5.352 0.780 1.00 0.00 O ATOM 0 H GLY A 79 10.735 -7.077 -1.465 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.529 -5.370 -0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.675 -4.332 -2.086 1.00 0.00 H new ATOM 1220 N ILE A 80 9.944 -3.574 -0.471 1.00 0.00 N ATOM 1221 CA ILE A 80 9.026 -3.037 0.525 1.00 0.00 C ATOM 1222 C ILE A 80 7.612 -3.569 0.313 1.00 0.00 C ATOM 1223 O ILE A 80 7.213 -3.917 -0.798 1.00 0.00 O ATOM 1224 CB ILE A 80 8.993 -1.497 0.488 1.00 0.00 C ATOM 1225 CG1 ILE A 80 8.659 -1.006 -0.922 1.00 0.00 C ATOM 1226 CG2 ILE A 80 10.326 -0.928 0.952 1.00 0.00 C ATOM 1227 CD1 ILE A 80 7.740 0.195 -0.941 1.00 0.00 C ATOM 0 H ILE A 80 10.012 -3.019 -1.324 1.00 0.00 H new ATOM 0 HA ILE A 80 9.392 -3.362 1.499 1.00 0.00 H new ATOM 0 HB ILE A 80 8.215 -1.148 1.167 1.00 0.00 H new ATOM 0 HG12 ILE A 80 9.585 -0.753 -1.439 1.00 0.00 H new ATOM 0 HG13 ILE A 80 8.194 -1.818 -1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 80 10.288 0.161 0.920 1.00 0.00 H new ATOM 0 HG22 ILE A 80 10.526 -1.255 1.973 1.00 0.00 H new ATOM 0 HG23 ILE A 80 11.121 -1.282 0.296 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.546 0.488 -1.973 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.799 -0.059 -0.453 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.212 1.022 -0.411 1.00 0.00 H new ATOM 1239 N PRO A 81 6.835 -3.632 1.404 1.00 0.00 N ATOM 1240 CA PRO A 81 5.452 -4.119 1.364 1.00 0.00 C ATOM 1241 C PRO A 81 4.520 -3.156 0.636 1.00 0.00 C ATOM 1242 O PRO A 81 4.570 -1.945 0.854 1.00 0.00 O ATOM 1243 CB PRO A 81 5.068 -4.219 2.842 1.00 0.00 C ATOM 1244 CG PRO A 81 5.953 -3.238 3.531 1.00 0.00 C ATOM 1245 CD PRO A 81 7.245 -3.234 2.761 1.00 0.00 C ATOM 0 HA PRO A 81 5.367 -5.061 0.823 1.00 0.00 H new ATOM 0 HB2 PRO A 81 4.016 -3.978 2.995 1.00 0.00 H new ATOM 0 HB3 PRO A 81 5.223 -5.228 3.224 1.00 0.00 H new ATOM 0 HG2 PRO A 81 5.502 -2.246 3.542 1.00 0.00 H new ATOM 0 HG3 PRO A 81 6.119 -3.524 4.570 1.00 0.00 H new ATOM 0 HD2 PRO A 81 7.713 -2.250 2.767 1.00 0.00 H new ATOM 0 HD3 PRO A 81 7.967 -3.933 3.184 1.00 0.00 H new ATOM 1253 N ILE A 82 3.672 -3.702 -0.229 1.00 0.00 N ATOM 1254 CA ILE A 82 2.728 -2.891 -0.988 1.00 0.00 C ATOM 1255 C ILE A 82 1.542 -2.475 -0.123 1.00 0.00 C ATOM 1256 O ILE A 82 0.920 -1.440 -0.362 1.00 0.00 O ATOM 1257 CB ILE A 82 2.207 -3.643 -2.226 1.00 0.00 C ATOM 1258 CG1 ILE A 82 1.460 -4.910 -1.803 1.00 0.00 C ATOM 1259 CG2 ILE A 82 3.358 -3.988 -3.159 1.00 0.00 C ATOM 1260 CD1 ILE A 82 -0.042 -4.803 -1.950 1.00 0.00 C ATOM 0 H ILE A 82 3.619 -4.702 -0.422 1.00 0.00 H new ATOM 0 HA ILE A 82 3.267 -2.002 -1.314 1.00 0.00 H new ATOM 0 HB ILE A 82 1.512 -2.995 -2.761 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.817 -5.749 -2.401 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.700 -5.134 -0.764 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.974 -4.519 -4.030 1.00 0.00 H new ATOM 0 HG22 ILE A 82 3.852 -3.072 -3.482 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.074 -4.621 -2.635 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.506 -5.737 -1.632 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.411 -3.985 -1.331 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.293 -4.610 -2.993 1.00 0.00 H new ATOM 1272 N SER A 83 1.236 -3.288 0.882 1.00 0.00 N ATOM 1273 CA SER A 83 0.123 -3.006 1.782 1.00 0.00 C ATOM 1274 C SER A 83 0.248 -1.607 2.379 1.00 0.00 C ATOM 1275 O SER A 83 1.341 -1.166 2.731 1.00 0.00 O ATOM 1276 CB SER A 83 0.068 -4.047 2.901 1.00 0.00 C ATOM 1277 OG SER A 83 -1.227 -4.614 3.007 1.00 0.00 O ATOM 0 H SER A 83 1.743 -4.147 1.094 1.00 0.00 H new ATOM 0 HA SER A 83 -0.800 -3.055 1.205 1.00 0.00 H new ATOM 0 HB2 SER A 83 0.798 -4.833 2.707 1.00 0.00 H new ATOM 0 HB3 SER A 83 0.344 -3.583 3.848 1.00 0.00 H new ATOM 0 HG SER A 83 -1.236 -5.278 3.728 1.00 0.00 H new ATOM 1283 N GLY A 84 -0.881 -0.915 2.489 1.00 0.00 N ATOM 1284 CA GLY A 84 -0.878 0.427 3.043 1.00 0.00 C ATOM 1285 C GLY A 84 -2.145 1.192 2.717 1.00 0.00 C ATOM 1286 O GLY A 84 -2.996 1.421 3.576 1.00 0.00 O ATOM 0 H GLY A 84 -1.798 -1.259 2.205 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.760 0.370 4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -0.018 0.974 2.657 1.00 0.00 H new ATOM 1290 N PRO A 85 -2.282 1.603 1.447 1.00 0.00 N ATOM 1291 CA PRO A 85 -3.451 2.355 0.981 1.00 0.00 C ATOM 1292 C PRO A 85 -4.713 1.500 0.943 1.00 0.00 C ATOM 1293 O PRO A 85 -4.663 0.292 1.175 1.00 0.00 O ATOM 1294 CB PRO A 85 -3.054 2.785 -0.434 1.00 0.00 C ATOM 1295 CG PRO A 85 -2.053 1.773 -0.871 1.00 0.00 C ATOM 1296 CD PRO A 85 -1.307 1.365 0.370 1.00 0.00 C ATOM 0 HA PRO A 85 -3.691 3.187 1.643 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -3.917 2.801 -1.100 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -2.630 3.789 -0.438 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -2.542 0.915 -1.332 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -1.374 2.191 -1.614 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -1.000 0.320 0.329 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -0.403 1.957 0.508 1.00 0.00 H new ATOM 1304 N SER A 86 -5.843 2.135 0.650 1.00 0.00 N ATOM 1305 CA SER A 86 -7.120 1.432 0.585 1.00 0.00 C ATOM 1306 C SER A 86 -7.809 1.679 -0.753 1.00 0.00 C ATOM 1307 O SER A 86 -7.817 2.800 -1.262 1.00 0.00 O ATOM 1308 CB SER A 86 -8.030 1.879 1.731 1.00 0.00 C ATOM 1309 OG SER A 86 -9.242 1.145 1.734 1.00 0.00 O ATOM 0 H SER A 86 -5.901 3.134 0.454 1.00 0.00 H new ATOM 0 HA SER A 86 -6.924 0.364 0.681 1.00 0.00 H new ATOM 0 HB2 SER A 86 -7.516 1.743 2.682 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.246 2.943 1.635 1.00 0.00 H new ATOM 0 HG SER A 86 -9.806 1.448 2.476 1.00 0.00 H new ATOM 1315 N SER A 87 -8.386 0.624 -1.318 1.00 0.00 N ATOM 1316 CA SER A 87 -9.075 0.724 -2.599 1.00 0.00 C ATOM 1317 C SER A 87 -10.504 0.201 -2.490 1.00 0.00 C ATOM 1318 O SER A 87 -10.864 -0.457 -1.514 1.00 0.00 O ATOM 1319 CB SER A 87 -8.315 -0.057 -3.673 1.00 0.00 C ATOM 1320 OG SER A 87 -7.241 0.707 -4.195 1.00 0.00 O ATOM 0 H SER A 87 -8.390 -0.310 -0.909 1.00 0.00 H new ATOM 0 HA SER A 87 -9.112 1.776 -2.882 1.00 0.00 H new ATOM 0 HB2 SER A 87 -7.933 -0.986 -3.250 1.00 0.00 H new ATOM 0 HB3 SER A 87 -8.996 -0.331 -4.479 1.00 0.00 H new ATOM 0 HG SER A 87 -6.770 0.185 -4.878 1.00 0.00 H new ATOM 1326 N GLY A 88 -11.316 0.499 -3.500 1.00 0.00 N ATOM 1327 CA GLY A 88 -12.696 0.052 -3.499 1.00 0.00 C ATOM 1328 C GLY A 88 -13.653 1.123 -3.983 1.00 0.00 C ATOM 1329 O GLY A 88 -13.298 1.947 -4.826 1.00 0.00 O ATOM 0 H GLY A 88 -11.042 1.042 -4.319 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.790 -0.829 -4.134 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.976 -0.252 -2.490 1.00 0.00 H new TER 1333 GLY A 88