USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1041 hydrogens (8 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B1139 PTR HN2 : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD NoAdj-H: B1139 PTR H : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD Set 1.1: A 103 ASN : amide:sc= -0.214 K(o=-3,f=-5.9!) USER MOD Set 1.2: A 113 HIS : no HD1:sc= -2.77 K(o=-3,f=-5.9) USER MOD Set 2.1: A 68 TYR OH : rot 179:sc= 1.27 USER MOD Set 2.2: A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.3: A 88 THR OG1 : rot 63:sc= 1.03 USER MOD Set 3.1: A 29 SER OG : rot -107:sc= 0.56 USER MOD Set 3.2: A 67 HIS : no HD1:sc= -1.6 K(o=-1,f=-5.8!) USER MOD Set 4.1: A 2 SER OG : rot 180:sc= 0.615 USER MOD Set 4.2: A 5 SER OG : rot -144:sc= 0.691 USER MOD Single : A 1 GLY N :NH3+ -137:sc= 0.0271 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 HIS : no HD1:sc= 0.0459 K(o=0.046,f=-1.2) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.913 X(o=-0.91,f=-0.59) USER MOD Single : A 21 HIS : no HD1:sc= -0.228 X(o=-0.23,f=-0.075) USER MOD Single : A 25 SER OG : rot 70:sc= 2.03 USER MOD Single : A 30 GLN : amide:sc= 0.224 X(o=0.22,f=-0.067) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 36 GLN : amide:sc= 0.795 K(o=0.8,f=-1.4!) USER MOD Single : A 48 SER OG : rot 90:sc= 0.276 USER MOD Single : A 49 GLN : amide:sc= -0.457 X(o=-0.46,f=-0.44) USER MOD Single : A 51 ASN : amide:sc= 0.601 K(o=0.6,f=0) USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 58 SER OG : rot -50:sc= 1.18 USER MOD Single : A 60 CYS SG : rot 102:sc= -0.0767 USER MOD Single : A 61 HIS : no HD1:sc= -2.39! C(o=-2.4!,f=-5!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0.252 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0.0436 K(o=0.044,f=-4!) USER MOD Single : A 100 HIS : no HE2:sc= 0.943 K(o=0.94,f=-2.8!) USER MOD Single : A 101 GLN : amide:sc= -0.891 K(o=-0.89,f=-5!) USER MOD Single : A 109 CYS SG : rot -130:sc= 0 USER MOD Single : A 114 CYS SG : rot 180:sc= -0.319 USER MOD Single : A 115 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 119:sc= 1.1 USER MOD Single : B1136 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B1141 ASN : amide:sc= 0.272 K(o=0.27,f=-5.7!) USER MOD Single : B1142 GLN : amide:sc= -0.0814 X(o=-0.081,f=-0.066) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.554 24.201 -5.454 1.00 0.00 N ATOM 2 CA GLY A 1 27.877 23.549 -5.608 1.00 0.00 C ATOM 3 C GLY A 1 28.072 22.407 -4.619 1.00 0.00 C ATOM 4 O GLY A 1 27.109 21.783 -4.178 1.00 0.00 O ATOM 0 H1 GLY A 1 26.143 24.378 -6.393 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.922 23.579 -4.911 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.668 25.104 -4.950 1.00 0.00 H new ATOM 0 HA2 GLY A 1 27.977 23.169 -6.625 1.00 0.00 H new ATOM 0 HA3 GLY A 1 28.664 24.289 -5.466 1.00 0.00 H new ATOM 10 N SER A 2 29.322 22.103 -4.262 1.00 0.00 N ATOM 11 CA SER A 2 29.672 21.059 -3.279 1.00 0.00 C ATOM 12 C SER A 2 29.337 21.479 -1.832 1.00 0.00 C ATOM 13 O SER A 2 29.441 22.670 -1.513 1.00 0.00 O ATOM 14 CB SER A 2 31.158 20.697 -3.414 1.00 0.00 C ATOM 15 OG SER A 2 31.417 20.220 -4.728 1.00 0.00 O ATOM 0 H SER A 2 30.136 22.579 -4.650 1.00 0.00 H new ATOM 0 HA SER A 2 29.065 20.180 -3.496 1.00 0.00 H new ATOM 0 HB2 SER A 2 31.776 21.571 -3.205 1.00 0.00 H new ATOM 0 HB3 SER A 2 31.425 19.936 -2.681 1.00 0.00 H new ATOM 0 HG SER A 2 32.366 19.991 -4.812 1.00 0.00 H new ATOM 21 N PRO A 3 28.944 20.543 -0.938 1.00 0.00 N ATOM 22 CA PRO A 3 28.875 19.085 -1.134 1.00 0.00 C ATOM 23 C PRO A 3 27.589 18.580 -1.820 1.00 0.00 C ATOM 24 O PRO A 3 27.541 17.427 -2.256 1.00 0.00 O ATOM 25 CB PRO A 3 29.021 18.510 0.277 1.00 0.00 C ATOM 26 CG PRO A 3 28.310 19.546 1.145 1.00 0.00 C ATOM 27 CD PRO A 3 28.689 20.860 0.465 1.00 0.00 C ATOM 0 HA PRO A 3 29.655 18.761 -1.823 1.00 0.00 H new ATOM 0 HB2 PRO A 3 28.559 17.527 0.362 1.00 0.00 H new ATOM 0 HB3 PRO A 3 30.067 18.396 0.560 1.00 0.00 H new ATOM 0 HG2 PRO A 3 27.231 19.392 1.159 1.00 0.00 H new ATOM 0 HG3 PRO A 3 28.650 19.511 2.180 1.00 0.00 H new ATOM 0 HD2 PRO A 3 27.885 21.591 0.558 1.00 0.00 H new ATOM 0 HD3 PRO A 3 29.572 21.297 0.931 1.00 0.00 H new ATOM 35 N ALA A 4 26.571 19.435 -1.991 1.00 0.00 N ATOM 36 CA ALA A 4 25.278 19.083 -2.603 1.00 0.00 C ATOM 37 C ALA A 4 25.385 18.560 -4.056 1.00 0.00 C ATOM 38 O ALA A 4 24.454 17.928 -4.564 1.00 0.00 O ATOM 39 CB ALA A 4 24.353 20.302 -2.501 1.00 0.00 C ATOM 0 H ALA A 4 26.623 20.412 -1.702 1.00 0.00 H new ATOM 0 HA ALA A 4 24.862 18.241 -2.050 1.00 0.00 H new ATOM 0 HB1 ALA A 4 23.388 20.065 -2.948 1.00 0.00 H new ATOM 0 HB2 ALA A 4 24.212 20.565 -1.453 1.00 0.00 H new ATOM 0 HB3 ALA A 4 24.801 21.144 -3.029 1.00 0.00 H new ATOM 45 N SER A 5 26.528 18.787 -4.713 1.00 0.00 N ATOM 46 CA SER A 5 26.885 18.279 -6.046 1.00 0.00 C ATOM 47 C SER A 5 26.955 16.740 -6.107 1.00 0.00 C ATOM 48 O SER A 5 26.798 16.167 -7.190 1.00 0.00 O ATOM 49 CB SER A 5 28.251 18.859 -6.446 1.00 0.00 C ATOM 50 OG SER A 5 29.230 18.499 -5.479 1.00 0.00 O ATOM 0 H SER A 5 27.269 19.360 -4.309 1.00 0.00 H new ATOM 0 HA SER A 5 26.100 18.592 -6.735 1.00 0.00 H new ATOM 0 HB2 SER A 5 28.542 18.485 -7.428 1.00 0.00 H new ATOM 0 HB3 SER A 5 28.186 19.944 -6.525 1.00 0.00 H new ATOM 0 HG SER A 5 29.868 19.235 -5.370 1.00 0.00 H new ATOM 56 N GLY A 6 27.161 16.067 -4.965 1.00 0.00 N ATOM 57 CA GLY A 6 27.147 14.600 -4.853 1.00 0.00 C ATOM 58 C GLY A 6 27.966 13.984 -3.709 1.00 0.00 C ATOM 59 O GLY A 6 28.026 12.756 -3.613 1.00 0.00 O ATOM 0 H GLY A 6 27.345 16.535 -4.078 1.00 0.00 H new ATOM 0 HA2 GLY A 6 26.112 14.278 -4.741 1.00 0.00 H new ATOM 0 HA3 GLY A 6 27.510 14.184 -5.793 1.00 0.00 H new ATOM 63 N THR A 7 28.601 14.789 -2.845 1.00 0.00 N ATOM 64 CA THR A 7 29.506 14.325 -1.767 1.00 0.00 C ATOM 65 C THR A 7 28.939 14.477 -0.346 1.00 0.00 C ATOM 66 O THR A 7 29.618 14.123 0.624 1.00 0.00 O ATOM 67 CB THR A 7 30.895 14.983 -1.881 1.00 0.00 C ATOM 68 OG1 THR A 7 30.795 16.388 -1.821 1.00 0.00 O ATOM 69 CG2 THR A 7 31.593 14.631 -3.196 1.00 0.00 C ATOM 0 H THR A 7 28.502 15.804 -2.871 1.00 0.00 H new ATOM 0 HA THR A 7 29.606 13.251 -1.924 1.00 0.00 H new ATOM 0 HB THR A 7 31.477 14.600 -1.043 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.689 16.783 -1.894 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.568 15.117 -3.232 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.723 13.551 -3.261 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.986 14.974 -4.034 1.00 0.00 H new ATOM 77 N SER A 8 27.697 14.957 -0.194 1.00 0.00 N ATOM 78 CA SER A 8 26.996 15.052 1.101 1.00 0.00 C ATOM 79 C SER A 8 26.851 13.690 1.805 1.00 0.00 C ATOM 80 O SER A 8 26.690 12.649 1.156 1.00 0.00 O ATOM 81 CB SER A 8 25.602 15.667 0.929 1.00 0.00 C ATOM 82 OG SER A 8 25.690 16.996 0.445 1.00 0.00 O ATOM 0 H SER A 8 27.139 15.296 -0.978 1.00 0.00 H new ATOM 0 HA SER A 8 27.616 15.695 1.726 1.00 0.00 H new ATOM 0 HB2 SER A 8 25.016 15.062 0.237 1.00 0.00 H new ATOM 0 HB3 SER A 8 25.076 15.658 1.884 1.00 0.00 H new ATOM 0 HG SER A 8 24.789 17.367 0.342 1.00 0.00 H new ATOM 88 N LEU A 9 26.875 13.701 3.142 1.00 0.00 N ATOM 89 CA LEU A 9 26.773 12.500 3.981 1.00 0.00 C ATOM 90 C LEU A 9 25.338 11.933 4.011 1.00 0.00 C ATOM 91 O LEU A 9 24.356 12.661 3.834 1.00 0.00 O ATOM 92 CB LEU A 9 27.283 12.801 5.411 1.00 0.00 C ATOM 93 CG LEU A 9 28.806 12.944 5.625 1.00 0.00 C ATOM 94 CD1 LEU A 9 29.575 11.688 5.209 1.00 0.00 C ATOM 95 CD2 LEU A 9 29.429 14.149 4.917 1.00 0.00 C ATOM 0 H LEU A 9 26.968 14.561 3.683 1.00 0.00 H new ATOM 0 HA LEU A 9 27.406 11.731 3.538 1.00 0.00 H new ATOM 0 HB2 LEU A 9 26.811 13.725 5.746 1.00 0.00 H new ATOM 0 HB3 LEU A 9 26.927 12.006 6.066 1.00 0.00 H new ATOM 0 HG LEU A 9 28.900 13.099 6.700 1.00 0.00 H new ATOM 0 HD11 LEU A 9 30.641 11.841 5.379 1.00 0.00 H new ATOM 0 HD12 LEU A 9 29.231 10.839 5.799 1.00 0.00 H new ATOM 0 HD13 LEU A 9 29.402 11.489 4.151 1.00 0.00 H new ATOM 0 HD21 LEU A 9 30.500 14.176 5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.264 14.065 3.843 1.00 0.00 H new ATOM 0 HD23 LEU A 9 28.968 15.066 5.285 1.00 0.00 H new ATOM 107 N SER A 10 25.223 10.624 4.256 1.00 0.00 N ATOM 108 CA SER A 10 23.948 9.886 4.294 1.00 0.00 C ATOM 109 C SER A 10 23.058 10.267 5.491 1.00 0.00 C ATOM 110 O SER A 10 23.550 10.644 6.560 1.00 0.00 O ATOM 111 CB SER A 10 24.208 8.372 4.317 1.00 0.00 C ATOM 112 OG SER A 10 24.986 7.979 3.196 1.00 0.00 O ATOM 0 H SER A 10 26.032 10.030 4.438 1.00 0.00 H new ATOM 0 HA SER A 10 23.409 10.166 3.389 1.00 0.00 H new ATOM 0 HB2 SER A 10 24.725 8.101 5.238 1.00 0.00 H new ATOM 0 HB3 SER A 10 23.259 7.835 4.314 1.00 0.00 H new ATOM 0 HG SER A 10 25.142 7.012 3.229 1.00 0.00 H new ATOM 118 N ALA A 11 21.739 10.121 5.321 1.00 0.00 N ATOM 119 CA ALA A 11 20.714 10.357 6.347 1.00 0.00 C ATOM 120 C ALA A 11 19.568 9.322 6.263 1.00 0.00 C ATOM 121 O ALA A 11 19.374 8.674 5.229 1.00 0.00 O ATOM 122 CB ALA A 11 20.194 11.793 6.192 1.00 0.00 C ATOM 0 H ALA A 11 21.340 9.824 4.431 1.00 0.00 H new ATOM 0 HA ALA A 11 21.157 10.235 7.336 1.00 0.00 H new ATOM 0 HB1 ALA A 11 19.431 11.987 6.946 1.00 0.00 H new ATOM 0 HB2 ALA A 11 21.018 12.494 6.321 1.00 0.00 H new ATOM 0 HB3 ALA A 11 19.763 11.919 5.199 1.00 0.00 H new ATOM 128 N ALA A 12 18.799 9.172 7.347 1.00 0.00 N ATOM 129 CA ALA A 12 17.683 8.225 7.430 1.00 0.00 C ATOM 130 C ALA A 12 16.473 8.639 6.564 1.00 0.00 C ATOM 131 O ALA A 12 16.173 9.827 6.408 1.00 0.00 O ATOM 132 CB ALA A 12 17.291 8.048 8.903 1.00 0.00 C ATOM 0 H ALA A 12 18.936 9.712 8.202 1.00 0.00 H new ATOM 0 HA ALA A 12 18.015 7.271 7.021 1.00 0.00 H new ATOM 0 HB1 ALA A 12 16.461 7.345 8.977 1.00 0.00 H new ATOM 0 HB2 ALA A 12 18.143 7.663 9.463 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.990 9.010 9.317 1.00 0.00 H new ATOM 138 N ILE A 13 15.752 7.643 6.032 1.00 0.00 N ATOM 139 CA ILE A 13 14.534 7.832 5.217 1.00 0.00 C ATOM 140 C ILE A 13 13.288 8.160 6.068 1.00 0.00 C ATOM 141 O ILE A 13 12.333 8.768 5.579 1.00 0.00 O ATOM 142 CB ILE A 13 14.332 6.588 4.310 1.00 0.00 C ATOM 143 CG1 ILE A 13 13.199 6.727 3.268 1.00 0.00 C ATOM 144 CG2 ILE A 13 14.092 5.305 5.130 1.00 0.00 C ATOM 145 CD1 ILE A 13 13.385 7.895 2.290 1.00 0.00 C ATOM 0 H ILE A 13 16.000 6.661 6.156 1.00 0.00 H new ATOM 0 HA ILE A 13 14.672 8.708 4.583 1.00 0.00 H new ATOM 0 HB ILE A 13 15.272 6.515 3.763 1.00 0.00 H new ATOM 0 HG12 ILE A 13 13.127 5.800 2.700 1.00 0.00 H new ATOM 0 HG13 ILE A 13 12.252 6.854 3.792 1.00 0.00 H new ATOM 0 HG21 ILE A 13 13.956 4.461 4.454 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.951 5.119 5.774 1.00 0.00 H new ATOM 0 HG23 ILE A 13 13.199 5.427 5.743 1.00 0.00 H new ATOM 0 HD11 ILE A 13 12.548 7.922 1.593 1.00 0.00 H new ATOM 0 HD12 ILE A 13 13.425 8.832 2.846 1.00 0.00 H new ATOM 0 HD13 ILE A 13 14.314 7.761 1.736 1.00 0.00 H new ATOM 157 N HIS A 14 13.310 7.788 7.352 1.00 0.00 N ATOM 158 CA HIS A 14 12.212 7.892 8.322 1.00 0.00 C ATOM 159 C HIS A 14 12.601 8.682 9.586 1.00 0.00 C ATOM 160 O HIS A 14 13.787 8.815 9.911 1.00 0.00 O ATOM 161 CB HIS A 14 11.771 6.464 8.696 1.00 0.00 C ATOM 162 CG HIS A 14 12.843 5.648 9.391 1.00 0.00 C ATOM 163 ND1 HIS A 14 14.077 5.279 8.841 1.00 0.00 N ATOM 164 CD2 HIS A 14 12.777 5.177 10.670 1.00 0.00 C ATOM 165 CE1 HIS A 14 14.723 4.601 9.804 1.00 0.00 C ATOM 166 NE2 HIS A 14 13.964 4.521 10.911 1.00 0.00 N ATOM 0 H HIS A 14 14.147 7.381 7.769 1.00 0.00 H new ATOM 0 HA HIS A 14 11.395 8.447 7.861 1.00 0.00 H new ATOM 0 HB2 HIS A 14 10.897 6.523 9.344 1.00 0.00 H new ATOM 0 HB3 HIS A 14 11.462 5.942 7.791 1.00 0.00 H new ATOM 0 HD2 HIS A 14 11.954 5.296 11.359 1.00 0.00 H new ATOM 0 HE1 HIS A 14 15.712 4.180 9.703 1.00 0.00 H new ATOM 0 HE2 HIS A 14 14.223 4.054 11.780 1.00 0.00 H new ATOM 174 N ARG A 15 11.590 9.175 10.323 1.00 0.00 N ATOM 175 CA ARG A 15 11.761 9.870 11.626 1.00 0.00 C ATOM 176 C ARG A 15 10.849 9.428 12.772 1.00 0.00 C ATOM 177 O ARG A 15 10.909 9.935 13.893 1.00 0.00 O ATOM 178 CB ARG A 15 11.704 11.394 11.401 1.00 0.00 C ATOM 179 CG ARG A 15 10.321 11.849 10.889 1.00 0.00 C ATOM 180 CD ARG A 15 10.223 13.374 10.745 1.00 0.00 C ATOM 181 NE ARG A 15 10.243 14.061 12.055 1.00 0.00 N ATOM 182 CZ ARG A 15 10.232 15.369 12.256 1.00 0.00 C ATOM 183 NH1 ARG A 15 10.201 16.221 11.270 1.00 0.00 N ATOM 184 NH2 ARG A 15 10.251 15.850 13.467 1.00 0.00 N ATOM 0 H ARG A 15 10.615 9.105 10.032 1.00 0.00 H new ATOM 0 HA ARG A 15 12.744 9.565 11.985 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.932 11.908 12.335 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.471 11.684 10.682 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.122 11.382 9.924 1.00 0.00 H new ATOM 0 HG3 ARG A 15 9.550 11.501 11.576 1.00 0.00 H new ATOM 0 HD2 ARG A 15 11.052 13.734 10.135 1.00 0.00 H new ATOM 0 HD3 ARG A 15 9.304 13.629 10.217 1.00 0.00 H new ATOM 0 HE ARG A 15 10.268 13.468 12.885 1.00 0.00 H new ATOM 0 HH11 ARG A 15 10.184 15.886 10.307 1.00 0.00 H new ATOM 0 HH12 ARG A 15 10.193 17.223 11.462 1.00 0.00 H new ATOM 0 HH21 ARG A 15 10.275 15.217 14.267 1.00 0.00 H new ATOM 0 HH22 ARG A 15 10.242 16.859 13.615 1.00 0.00 H new ATOM 198 N THR A 16 9.992 8.488 12.432 1.00 0.00 N ATOM 199 CA THR A 16 8.995 7.792 13.268 1.00 0.00 C ATOM 200 C THR A 16 8.890 6.314 12.860 1.00 0.00 C ATOM 201 O THR A 16 9.521 5.880 11.896 1.00 0.00 O ATOM 202 CB THR A 16 7.613 8.479 13.183 1.00 0.00 C ATOM 203 OG1 THR A 16 7.207 8.591 11.840 1.00 0.00 O ATOM 204 CG2 THR A 16 7.590 9.879 13.793 1.00 0.00 C ATOM 0 H THR A 16 9.961 8.148 11.471 1.00 0.00 H new ATOM 0 HA THR A 16 9.330 7.845 14.304 1.00 0.00 H new ATOM 0 HB THR A 16 6.936 7.846 13.756 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.330 9.026 11.799 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.589 10.301 13.698 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.861 9.821 14.847 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.303 10.516 13.270 1.00 0.00 H new ATOM 212 N GLN A 17 8.047 5.539 13.547 1.00 0.00 N ATOM 213 CA GLN A 17 7.736 4.133 13.228 1.00 0.00 C ATOM 214 C GLN A 17 6.758 3.948 12.037 1.00 0.00 C ATOM 215 O GLN A 17 6.226 2.853 11.841 1.00 0.00 O ATOM 216 CB GLN A 17 7.242 3.431 14.514 1.00 0.00 C ATOM 217 CG GLN A 17 5.757 3.635 14.895 1.00 0.00 C ATOM 218 CD GLN A 17 5.262 5.077 14.818 1.00 0.00 C ATOM 219 OE1 GLN A 17 4.517 5.468 13.930 1.00 0.00 O ATOM 220 NE2 GLN A 17 5.681 5.939 15.720 1.00 0.00 N ATOM 0 H GLN A 17 7.544 5.878 14.367 1.00 0.00 H new ATOM 0 HA GLN A 17 8.654 3.661 12.879 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.421 2.361 14.407 1.00 0.00 H new ATOM 0 HB3 GLN A 17 7.856 3.775 15.346 1.00 0.00 H new ATOM 0 HG2 GLN A 17 5.142 3.020 14.238 1.00 0.00 H new ATOM 0 HG3 GLN A 17 5.605 3.268 15.910 1.00 0.00 H new ATOM 0 HE21 GLN A 17 6.303 5.632 16.468 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.384 6.914 15.671 1.00 0.00 H new ATOM 229 N LEU A 18 6.506 5.009 11.255 1.00 0.00 N ATOM 230 CA LEU A 18 5.517 5.049 10.167 1.00 0.00 C ATOM 231 C LEU A 18 5.614 3.932 9.103 1.00 0.00 C ATOM 232 O LEU A 18 6.697 3.455 8.759 1.00 0.00 O ATOM 233 CB LEU A 18 5.511 6.457 9.543 1.00 0.00 C ATOM 234 CG LEU A 18 6.587 6.754 8.472 1.00 0.00 C ATOM 235 CD1 LEU A 18 6.442 8.198 7.995 1.00 0.00 C ATOM 236 CD2 LEU A 18 8.035 6.590 8.934 1.00 0.00 C ATOM 0 H LEU A 18 7.002 5.893 11.367 1.00 0.00 H new ATOM 0 HA LEU A 18 4.555 4.833 10.632 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.532 6.625 9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.623 7.185 10.347 1.00 0.00 H new ATOM 0 HG LEU A 18 6.408 6.015 7.691 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.199 8.410 7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.451 8.341 7.565 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.572 8.875 8.839 1.00 0.00 H new ATOM 0 HD21 LEU A 18 8.709 6.822 8.109 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.231 7.269 9.764 1.00 0.00 H new ATOM 0 HD23 LEU A 18 8.199 5.563 9.259 1.00 0.00 H new ATOM 248 N TRP A 19 4.459 3.575 8.527 1.00 0.00 N ATOM 249 CA TRP A 19 4.293 2.506 7.523 1.00 0.00 C ATOM 250 C TRP A 19 4.210 3.023 6.070 1.00 0.00 C ATOM 251 O TRP A 19 3.614 2.379 5.201 1.00 0.00 O ATOM 252 CB TRP A 19 3.123 1.594 7.937 1.00 0.00 C ATOM 253 CG TRP A 19 3.452 0.630 9.035 1.00 0.00 C ATOM 254 CD1 TRP A 19 3.989 -0.596 8.844 1.00 0.00 C ATOM 255 CD2 TRP A 19 3.295 0.772 10.484 1.00 0.00 C ATOM 256 NE1 TRP A 19 4.175 -1.224 10.056 1.00 0.00 N ATOM 257 CE2 TRP A 19 3.770 -0.427 11.106 1.00 0.00 C ATOM 258 CE3 TRP A 19 2.796 1.782 11.337 1.00 0.00 C ATOM 259 CZ2 TRP A 19 3.755 -0.609 12.497 1.00 0.00 C ATOM 260 CZ3 TRP A 19 2.779 1.609 12.736 1.00 0.00 C ATOM 261 CH2 TRP A 19 3.258 0.420 13.316 1.00 0.00 C ATOM 0 H TRP A 19 3.579 4.038 8.753 1.00 0.00 H new ATOM 0 HA TRP A 19 5.200 1.902 7.512 1.00 0.00 H new ATOM 0 HB2 TRP A 19 2.287 2.217 8.255 1.00 0.00 H new ATOM 0 HB3 TRP A 19 2.789 1.033 7.064 1.00 0.00 H new ATOM 0 HD1 TRP A 19 4.236 -1.021 7.882 1.00 0.00 H new ATOM 0 HE1 TRP A 19 4.564 -2.161 10.163 1.00 0.00 H new ATOM 0 HE3 TRP A 19 2.422 2.701 10.910 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 4.120 -1.527 12.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 2.395 2.396 13.368 1.00 0.00 H new ATOM 0 HH2 TRP A 19 3.244 0.298 14.389 1.00 0.00 H new ATOM 272 N PHE A 20 4.807 4.186 5.797 1.00 0.00 N ATOM 273 CA PHE A 20 4.913 4.758 4.452 1.00 0.00 C ATOM 274 C PHE A 20 6.310 5.345 4.174 1.00 0.00 C ATOM 275 O PHE A 20 6.845 6.155 4.932 1.00 0.00 O ATOM 276 CB PHE A 20 3.754 5.730 4.164 1.00 0.00 C ATOM 277 CG PHE A 20 3.511 6.856 5.153 1.00 0.00 C ATOM 278 CD1 PHE A 20 2.772 6.616 6.329 1.00 0.00 C ATOM 279 CD2 PHE A 20 3.936 8.166 4.857 1.00 0.00 C ATOM 280 CE1 PHE A 20 2.463 7.674 7.203 1.00 0.00 C ATOM 281 CE2 PHE A 20 3.618 9.226 5.725 1.00 0.00 C ATOM 282 CZ PHE A 20 2.879 8.982 6.895 1.00 0.00 C ATOM 0 H PHE A 20 5.238 4.767 6.517 1.00 0.00 H new ATOM 0 HA PHE A 20 4.806 3.946 3.733 1.00 0.00 H new ATOM 0 HB2 PHE A 20 3.927 6.176 3.185 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.837 5.145 4.091 1.00 0.00 H new ATOM 0 HD1 PHE A 20 2.441 5.614 6.560 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.508 8.357 3.961 1.00 0.00 H new ATOM 0 HE1 PHE A 20 1.907 7.482 8.109 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.942 10.229 5.492 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.631 9.798 7.557 1.00 0.00 H new ATOM 292 N HIS A 21 6.877 4.913 3.042 1.00 0.00 N ATOM 293 CA HIS A 21 8.234 5.183 2.536 1.00 0.00 C ATOM 294 C HIS A 21 8.113 5.398 1.027 1.00 0.00 C ATOM 295 O HIS A 21 7.399 4.613 0.409 1.00 0.00 O ATOM 296 CB HIS A 21 9.091 3.934 2.831 1.00 0.00 C ATOM 297 CG HIS A 21 9.323 3.688 4.303 1.00 0.00 C ATOM 298 ND1 HIS A 21 8.453 3.010 5.165 1.00 0.00 N ATOM 299 CD2 HIS A 21 10.401 4.128 5.014 1.00 0.00 C ATOM 300 CE1 HIS A 21 9.013 3.097 6.383 1.00 0.00 C ATOM 301 NE2 HIS A 21 10.192 3.738 6.320 1.00 0.00 N ATOM 0 H HIS A 21 6.357 4.315 2.400 1.00 0.00 H new ATOM 0 HA HIS A 21 8.691 6.057 3.000 1.00 0.00 H new ATOM 0 HB2 HIS A 21 8.604 3.060 2.398 1.00 0.00 H new ATOM 0 HB3 HIS A 21 10.055 4.040 2.334 1.00 0.00 H new ATOM 0 HD2 HIS A 21 11.250 4.674 4.630 1.00 0.00 H new ATOM 0 HE1 HIS A 21 8.575 2.705 7.289 1.00 0.00 H new ATOM 0 HE2 HIS A 21 10.823 3.907 7.103 1.00 0.00 H new ATOM 309 N GLY A 22 8.778 6.359 0.369 1.00 0.00 N ATOM 310 CA GLY A 22 8.523 6.589 -1.047 1.00 0.00 C ATOM 311 C GLY A 22 9.771 6.779 -1.874 1.00 0.00 C ATOM 312 O GLY A 22 9.841 7.693 -2.678 1.00 0.00 O ATOM 0 H GLY A 22 9.478 6.972 0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 22 7.961 5.745 -1.446 1.00 0.00 H new ATOM 0 HA3 GLY A 22 7.892 7.471 -1.153 1.00 0.00 H new ATOM 316 N ARG A 23 10.755 5.905 -1.672 1.00 0.00 N ATOM 317 CA ARG A 23 11.995 5.838 -2.465 1.00 0.00 C ATOM 318 C ARG A 23 12.455 4.373 -2.548 1.00 0.00 C ATOM 319 O ARG A 23 13.588 4.003 -2.263 1.00 0.00 O ATOM 320 CB ARG A 23 12.998 6.886 -1.907 1.00 0.00 C ATOM 321 CG ARG A 23 14.479 6.853 -2.341 1.00 0.00 C ATOM 322 CD ARG A 23 14.744 6.763 -3.855 1.00 0.00 C ATOM 323 NE ARG A 23 15.741 5.711 -4.155 1.00 0.00 N ATOM 324 CZ ARG A 23 15.522 4.561 -4.770 1.00 0.00 C ATOM 325 NH1 ARG A 23 14.446 4.324 -5.458 1.00 0.00 N ATOM 326 NH2 ARG A 23 16.386 3.594 -4.714 1.00 0.00 N ATOM 0 H ARG A 23 10.717 5.202 -0.934 1.00 0.00 H new ATOM 0 HA ARG A 23 11.868 6.126 -3.508 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.609 7.872 -2.161 1.00 0.00 H new ATOM 0 HB3 ARG A 23 12.978 6.805 -0.820 1.00 0.00 H new ATOM 0 HG2 ARG A 23 14.967 7.751 -1.961 1.00 0.00 H new ATOM 0 HG3 ARG A 23 14.958 6.001 -1.859 1.00 0.00 H new ATOM 0 HD2 ARG A 23 13.813 6.547 -4.379 1.00 0.00 H new ATOM 0 HD3 ARG A 23 15.102 7.724 -4.223 1.00 0.00 H new ATOM 0 HE ARG A 23 16.699 5.892 -3.855 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.726 5.041 -5.541 1.00 0.00 H new ATOM 0 HH12 ARG A 23 14.322 3.421 -5.915 1.00 0.00 H new ATOM 0 HH21 ARG A 23 17.252 3.714 -4.189 1.00 0.00 H new ATOM 0 HH22 ARG A 23 16.199 2.714 -5.195 1.00 0.00 H new ATOM 340 N ILE A 24 11.481 3.526 -2.890 1.00 0.00 N ATOM 341 CA ILE A 24 11.610 2.067 -2.972 1.00 0.00 C ATOM 342 C ILE A 24 10.624 1.559 -4.035 1.00 0.00 C ATOM 343 O ILE A 24 9.600 0.958 -3.723 1.00 0.00 O ATOM 344 CB ILE A 24 11.457 1.483 -1.538 1.00 0.00 C ATOM 345 CG1 ILE A 24 11.894 0.005 -1.483 1.00 0.00 C ATOM 346 CG2 ILE A 24 10.057 1.658 -0.912 1.00 0.00 C ATOM 347 CD1 ILE A 24 13.414 -0.189 -1.542 1.00 0.00 C ATOM 0 H ILE A 24 10.543 3.850 -3.127 1.00 0.00 H new ATOM 0 HA ILE A 24 12.589 1.726 -3.310 1.00 0.00 H new ATOM 0 HB ILE A 24 12.128 2.083 -0.924 1.00 0.00 H new ATOM 0 HG12 ILE A 24 11.514 -0.443 -0.565 1.00 0.00 H new ATOM 0 HG13 ILE A 24 11.435 -0.532 -2.313 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.047 1.220 0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 24 9.819 2.719 -0.845 1.00 0.00 H new ATOM 0 HG23 ILE A 24 9.315 1.158 -1.535 1.00 0.00 H new ATOM 0 HD11 ILE A 24 13.647 -1.253 -1.499 1.00 0.00 H new ATOM 0 HD12 ILE A 24 13.798 0.229 -2.472 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.879 0.319 -0.697 1.00 0.00 H new ATOM 359 N SER A 25 10.894 1.884 -5.303 1.00 0.00 N ATOM 360 CA SER A 25 10.026 1.609 -6.469 1.00 0.00 C ATOM 361 C SER A 25 9.566 0.154 -6.549 1.00 0.00 C ATOM 362 O SER A 25 10.206 -0.730 -5.989 1.00 0.00 O ATOM 363 CB SER A 25 10.718 2.055 -7.763 1.00 0.00 C ATOM 364 OG SER A 25 9.783 2.173 -8.826 1.00 0.00 O ATOM 0 H SER A 25 11.755 2.365 -5.563 1.00 0.00 H new ATOM 0 HA SER A 25 9.117 2.196 -6.336 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.214 3.012 -7.603 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.491 1.336 -8.032 1.00 0.00 H new ATOM 0 HG SER A 25 9.200 2.944 -8.665 1.00 0.00 H new ATOM 370 N ARG A 26 8.456 -0.118 -7.239 1.00 0.00 N ATOM 371 CA ARG A 26 7.796 -1.435 -7.333 1.00 0.00 C ATOM 372 C ARG A 26 8.720 -2.637 -7.583 1.00 0.00 C ATOM 373 O ARG A 26 8.522 -3.697 -6.997 1.00 0.00 O ATOM 374 CB ARG A 26 6.656 -1.356 -8.383 1.00 0.00 C ATOM 375 CG ARG A 26 7.024 -1.145 -9.861 1.00 0.00 C ATOM 376 CD ARG A 26 7.779 0.150 -10.175 1.00 0.00 C ATOM 377 NE ARG A 26 7.864 0.369 -11.621 1.00 0.00 N ATOM 378 CZ ARG A 26 8.716 1.131 -12.271 1.00 0.00 C ATOM 379 NH1 ARG A 26 9.546 1.948 -11.683 1.00 0.00 N ATOM 380 NH2 ARG A 26 8.722 1.059 -13.566 1.00 0.00 N ATOM 0 H ARG A 26 7.967 0.600 -7.773 1.00 0.00 H new ATOM 0 HA ARG A 26 7.394 -1.641 -6.341 1.00 0.00 H new ATOM 0 HB2 ARG A 26 6.080 -2.279 -8.315 1.00 0.00 H new ATOM 0 HB3 ARG A 26 5.992 -0.543 -8.089 1.00 0.00 H new ATOM 0 HG2 ARG A 26 7.632 -1.988 -10.190 1.00 0.00 H new ATOM 0 HG3 ARG A 26 6.108 -1.163 -10.451 1.00 0.00 H new ATOM 0 HD2 ARG A 26 7.273 0.993 -9.705 1.00 0.00 H new ATOM 0 HD3 ARG A 26 8.782 0.103 -9.751 1.00 0.00 H new ATOM 0 HE ARG A 26 7.181 -0.129 -12.192 1.00 0.00 H new ATOM 0 HH11 ARG A 26 9.556 2.020 -10.666 1.00 0.00 H new ATOM 0 HH12 ARG A 26 10.185 2.515 -12.241 1.00 0.00 H new ATOM 0 HH21 ARG A 26 8.080 0.427 -14.045 1.00 0.00 H new ATOM 0 HH22 ARG A 26 9.368 1.634 -14.106 1.00 0.00 H new ATOM 394 N GLU A 27 9.759 -2.459 -8.399 1.00 0.00 N ATOM 395 CA GLU A 27 10.772 -3.488 -8.694 1.00 0.00 C ATOM 396 C GLU A 27 11.814 -3.680 -7.569 1.00 0.00 C ATOM 397 O GLU A 27 12.394 -4.756 -7.433 1.00 0.00 O ATOM 398 CB GLU A 27 11.440 -3.180 -10.045 1.00 0.00 C ATOM 399 CG GLU A 27 12.264 -1.884 -10.072 1.00 0.00 C ATOM 400 CD GLU A 27 12.869 -1.644 -11.469 1.00 0.00 C ATOM 401 OE1 GLU A 27 13.766 -2.418 -11.887 1.00 0.00 O ATOM 402 OE2 GLU A 27 12.462 -0.677 -12.158 1.00 0.00 O ATOM 0 H GLU A 27 9.929 -1.579 -8.886 1.00 0.00 H new ATOM 0 HA GLU A 27 10.252 -4.444 -8.756 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.090 -4.013 -10.312 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.668 -3.120 -10.812 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.631 -1.041 -9.796 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.061 -1.940 -9.331 1.00 0.00 H new ATOM 409 N GLU A 28 12.047 -2.646 -6.756 1.00 0.00 N ATOM 410 CA GLU A 28 12.912 -2.657 -5.567 1.00 0.00 C ATOM 411 C GLU A 28 12.188 -3.243 -4.344 1.00 0.00 C ATOM 412 O GLU A 28 12.702 -4.134 -3.671 1.00 0.00 O ATOM 413 CB GLU A 28 13.416 -1.235 -5.257 1.00 0.00 C ATOM 414 CG GLU A 28 14.098 -0.539 -6.442 1.00 0.00 C ATOM 415 CD GLU A 28 14.520 0.889 -6.062 1.00 0.00 C ATOM 416 OE1 GLU A 28 13.647 1.787 -6.007 1.00 0.00 O ATOM 417 OE2 GLU A 28 15.723 1.143 -5.817 1.00 0.00 O ATOM 0 H GLU A 28 11.619 -1.734 -6.914 1.00 0.00 H new ATOM 0 HA GLU A 28 13.766 -3.298 -5.787 1.00 0.00 H new ATOM 0 HB2 GLU A 28 12.574 -0.626 -4.928 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.118 -1.284 -4.425 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.972 -1.111 -6.753 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.418 -0.508 -7.293 1.00 0.00 H new ATOM 424 N SER A 29 10.963 -2.774 -4.069 1.00 0.00 N ATOM 425 CA SER A 29 10.171 -3.174 -2.891 1.00 0.00 C ATOM 426 C SER A 29 9.703 -4.626 -2.955 1.00 0.00 C ATOM 427 O SER A 29 9.601 -5.265 -1.911 1.00 0.00 O ATOM 428 CB SER A 29 9.012 -2.201 -2.641 1.00 0.00 C ATOM 429 OG SER A 29 8.436 -1.743 -3.846 1.00 0.00 O ATOM 0 H SER A 29 10.486 -2.097 -4.664 1.00 0.00 H new ATOM 0 HA SER A 29 10.838 -3.116 -2.031 1.00 0.00 H new ATOM 0 HB2 SER A 29 8.249 -2.694 -2.039 1.00 0.00 H new ATOM 0 HB3 SER A 29 9.372 -1.349 -2.065 1.00 0.00 H new ATOM 0 HG SER A 29 8.694 -0.810 -3.998 1.00 0.00 H new ATOM 435 N GLN A 30 9.530 -5.216 -4.145 1.00 0.00 N ATOM 436 CA GLN A 30 9.193 -6.647 -4.253 1.00 0.00 C ATOM 437 C GLN A 30 10.301 -7.583 -3.726 1.00 0.00 C ATOM 438 O GLN A 30 10.007 -8.717 -3.353 1.00 0.00 O ATOM 439 CB GLN A 30 8.699 -7.017 -5.663 1.00 0.00 C ATOM 440 CG GLN A 30 9.675 -6.731 -6.812 1.00 0.00 C ATOM 441 CD GLN A 30 9.062 -6.962 -8.201 1.00 0.00 C ATOM 442 OE1 GLN A 30 9.688 -7.528 -9.085 1.00 0.00 O ATOM 443 NE2 GLN A 30 7.852 -6.511 -8.473 1.00 0.00 N ATOM 0 H GLN A 30 9.616 -4.733 -5.039 1.00 0.00 H new ATOM 0 HA GLN A 30 8.352 -6.813 -3.579 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.456 -8.080 -5.675 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.773 -6.476 -5.856 1.00 0.00 H new ATOM 0 HG2 GLN A 30 10.017 -5.699 -6.741 1.00 0.00 H new ATOM 0 HG3 GLN A 30 10.554 -7.366 -6.700 1.00 0.00 H new ATOM 0 HE21 GLN A 30 7.311 -6.035 -7.751 1.00 0.00 H new ATOM 0 HE22 GLN A 30 7.458 -6.638 -9.405 1.00 0.00 H new ATOM 452 N ARG A 31 11.553 -7.108 -3.604 1.00 0.00 N ATOM 453 CA ARG A 31 12.660 -7.877 -2.997 1.00 0.00 C ATOM 454 C ARG A 31 12.577 -7.879 -1.460 1.00 0.00 C ATOM 455 O ARG A 31 12.994 -8.852 -0.836 1.00 0.00 O ATOM 456 CB ARG A 31 13.998 -7.317 -3.523 1.00 0.00 C ATOM 457 CG ARG A 31 15.278 -8.057 -3.089 1.00 0.00 C ATOM 458 CD ARG A 31 15.360 -9.528 -3.528 1.00 0.00 C ATOM 459 NE ARG A 31 14.604 -10.424 -2.630 1.00 0.00 N ATOM 460 CZ ARG A 31 14.393 -11.718 -2.792 1.00 0.00 C ATOM 461 NH1 ARG A 31 14.865 -12.373 -3.814 1.00 0.00 N ATOM 462 NH2 ARG A 31 13.692 -12.381 -1.916 1.00 0.00 N ATOM 0 H ARG A 31 11.829 -6.179 -3.923 1.00 0.00 H new ATOM 0 HA ARG A 31 12.584 -8.924 -3.290 1.00 0.00 H new ATOM 0 HB2 ARG A 31 13.960 -7.313 -4.612 1.00 0.00 H new ATOM 0 HB3 ARG A 31 14.081 -6.278 -3.203 1.00 0.00 H new ATOM 0 HG2 ARG A 31 16.141 -7.525 -3.491 1.00 0.00 H new ATOM 0 HG3 ARG A 31 15.354 -8.013 -2.003 1.00 0.00 H new ATOM 0 HD2 ARG A 31 14.974 -9.624 -4.543 1.00 0.00 H new ATOM 0 HD3 ARG A 31 16.404 -9.840 -3.554 1.00 0.00 H new ATOM 0 HE ARG A 31 14.202 -9.998 -1.795 1.00 0.00 H new ATOM 0 HH11 ARG A 31 15.417 -11.887 -4.521 1.00 0.00 H new ATOM 0 HH12 ARG A 31 14.683 -13.372 -3.908 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.305 -11.901 -1.103 1.00 0.00 H new ATOM 0 HH22 ARG A 31 13.530 -13.380 -2.043 1.00 0.00 H new ATOM 476 N LEU A 32 12.011 -6.823 -0.862 1.00 0.00 N ATOM 477 CA LEU A 32 11.852 -6.657 0.594 1.00 0.00 C ATOM 478 C LEU A 32 10.523 -7.247 1.099 1.00 0.00 C ATOM 479 O LEU A 32 10.514 -8.024 2.054 1.00 0.00 O ATOM 480 CB LEU A 32 11.963 -5.160 0.969 1.00 0.00 C ATOM 481 CG LEU A 32 13.389 -4.579 1.044 1.00 0.00 C ATOM 482 CD1 LEU A 32 14.104 -4.516 -0.307 1.00 0.00 C ATOM 483 CD2 LEU A 32 13.311 -3.153 1.596 1.00 0.00 C ATOM 0 H LEU A 32 11.639 -6.035 -1.392 1.00 0.00 H new ATOM 0 HA LEU A 32 12.654 -7.210 1.083 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.396 -4.582 0.240 1.00 0.00 H new ATOM 0 HB3 LEU A 32 11.482 -5.013 1.936 1.00 0.00 H new ATOM 0 HG LEU A 32 13.961 -5.249 1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.101 -4.096 -0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.186 -5.520 -0.722 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.535 -3.886 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.314 -2.730 1.654 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.697 -2.541 0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.867 -3.172 2.591 1.00 0.00 H new ATOM 495 N ILE A 33 9.399 -6.924 0.444 1.00 0.00 N ATOM 496 CA ILE A 33 8.049 -7.393 0.835 1.00 0.00 C ATOM 497 C ILE A 33 7.787 -8.841 0.338 1.00 0.00 C ATOM 498 O ILE A 33 6.860 -9.518 0.787 1.00 0.00 O ATOM 499 CB ILE A 33 6.968 -6.342 0.439 1.00 0.00 C ATOM 500 CG1 ILE A 33 7.054 -5.003 1.226 1.00 0.00 C ATOM 501 CG2 ILE A 33 5.542 -6.861 0.713 1.00 0.00 C ATOM 502 CD1 ILE A 33 8.301 -4.129 1.034 1.00 0.00 C ATOM 0 H ILE A 33 9.394 -6.324 -0.381 1.00 0.00 H new ATOM 0 HA ILE A 33 7.986 -7.469 1.921 1.00 0.00 H new ATOM 0 HB ILE A 33 7.167 -6.173 -0.619 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.183 -4.404 0.960 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.970 -5.235 2.288 1.00 0.00 H new ATOM 0 HG21 ILE A 33 4.816 -6.101 0.424 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.367 -7.768 0.134 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.433 -7.082 1.775 1.00 0.00 H new ATOM 0 HD11 ILE A 33 8.214 -3.232 1.647 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.187 -4.689 1.333 1.00 0.00 H new ATOM 0 HD13 ILE A 33 8.388 -3.845 -0.015 1.00 0.00 H new ATOM 514 N GLY A 34 8.673 -9.390 -0.507 1.00 0.00 N ATOM 515 CA GLY A 34 8.521 -10.719 -1.122 1.00 0.00 C ATOM 516 C GLY A 34 9.269 -11.848 -0.414 1.00 0.00 C ATOM 517 O GLY A 34 9.185 -13.000 -0.839 1.00 0.00 O ATOM 0 H GLY A 34 9.531 -8.915 -0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.461 -10.969 -1.153 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.866 -10.666 -2.155 1.00 0.00 H new ATOM 521 N GLN A 35 9.982 -11.538 0.678 1.00 0.00 N ATOM 522 CA GLN A 35 10.642 -12.544 1.523 1.00 0.00 C ATOM 523 C GLN A 35 9.614 -13.177 2.496 1.00 0.00 C ATOM 524 O GLN A 35 9.875 -14.212 3.110 1.00 0.00 O ATOM 525 CB GLN A 35 11.835 -11.867 2.227 1.00 0.00 C ATOM 526 CG GLN A 35 12.744 -12.852 2.982 1.00 0.00 C ATOM 527 CD GLN A 35 14.006 -12.209 3.565 1.00 0.00 C ATOM 528 OE1 GLN A 35 14.249 -11.010 3.489 1.00 0.00 O ATOM 529 NE2 GLN A 35 14.871 -12.989 4.182 1.00 0.00 N ATOM 0 H GLN A 35 10.118 -10.580 1.001 1.00 0.00 H new ATOM 0 HA GLN A 35 11.034 -13.372 0.933 1.00 0.00 H new ATOM 0 HB2 GLN A 35 12.429 -11.333 1.485 1.00 0.00 H new ATOM 0 HB3 GLN A 35 11.458 -11.123 2.929 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.175 -13.310 3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 35 13.036 -13.654 2.304 1.00 0.00 H new ATOM 0 HE21 GLN A 35 14.691 -13.990 4.258 1.00 0.00 H new ATOM 0 HE22 GLN A 35 15.720 -12.591 4.583 1.00 0.00 H new ATOM 538 N GLN A 36 8.431 -12.557 2.620 1.00 0.00 N ATOM 539 CA GLN A 36 7.302 -13.007 3.426 1.00 0.00 C ATOM 540 C GLN A 36 6.432 -14.046 2.680 1.00 0.00 C ATOM 541 O GLN A 36 6.390 -14.067 1.448 1.00 0.00 O ATOM 542 CB GLN A 36 6.464 -11.805 3.907 1.00 0.00 C ATOM 543 CG GLN A 36 7.181 -10.866 4.897 1.00 0.00 C ATOM 544 CD GLN A 36 7.829 -9.658 4.223 1.00 0.00 C ATOM 545 OE1 GLN A 36 7.227 -8.610 4.047 1.00 0.00 O ATOM 546 NE2 GLN A 36 9.081 -9.757 3.832 1.00 0.00 N ATOM 0 H GLN A 36 8.233 -11.683 2.133 1.00 0.00 H new ATOM 0 HA GLN A 36 7.705 -13.512 4.304 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.156 -11.225 3.037 1.00 0.00 H new ATOM 0 HB3 GLN A 36 5.555 -12.180 4.378 1.00 0.00 H new ATOM 0 HG2 GLN A 36 6.464 -10.517 5.640 1.00 0.00 H new ATOM 0 HG3 GLN A 36 7.946 -11.429 5.432 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.592 -10.628 3.974 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.540 -8.963 3.386 1.00 0.00 H new ATOM 555 N GLY A 37 5.720 -14.895 3.435 1.00 0.00 N ATOM 556 CA GLY A 37 4.852 -15.968 2.906 1.00 0.00 C ATOM 557 C GLY A 37 3.529 -16.158 3.666 1.00 0.00 C ATOM 558 O GLY A 37 3.011 -17.276 3.724 1.00 0.00 O ATOM 0 H GLY A 37 5.729 -14.858 4.454 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.627 -15.753 1.861 1.00 0.00 H new ATOM 0 HA3 GLY A 37 5.405 -16.907 2.926 1.00 0.00 H new ATOM 562 N LEU A 38 3.025 -15.101 4.314 1.00 0.00 N ATOM 563 CA LEU A 38 1.785 -15.106 5.111 1.00 0.00 C ATOM 564 C LEU A 38 0.528 -14.960 4.211 1.00 0.00 C ATOM 565 O LEU A 38 0.602 -15.126 2.990 1.00 0.00 O ATOM 566 CB LEU A 38 1.898 -13.986 6.177 1.00 0.00 C ATOM 567 CG LEU A 38 2.867 -14.183 7.364 1.00 0.00 C ATOM 568 CD1 LEU A 38 2.568 -15.460 8.152 1.00 0.00 C ATOM 569 CD2 LEU A 38 4.348 -14.182 6.984 1.00 0.00 C ATOM 0 H LEU A 38 3.481 -14.188 4.300 1.00 0.00 H new ATOM 0 HA LEU A 38 1.663 -16.064 5.617 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.188 -13.069 5.663 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.902 -13.820 6.588 1.00 0.00 H new ATOM 0 HG LEU A 38 2.686 -13.307 7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.276 -15.553 8.976 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.554 -15.414 8.549 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.661 -16.324 7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.953 -14.326 7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 38 4.543 -14.991 6.280 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.604 -13.229 6.522 1.00 0.00 H new ATOM 581 N VAL A 39 -0.643 -14.681 4.812 1.00 0.00 N ATOM 582 CA VAL A 39 -1.896 -14.383 4.085 1.00 0.00 C ATOM 583 C VAL A 39 -1.678 -13.251 3.092 1.00 0.00 C ATOM 584 O VAL A 39 -0.847 -12.371 3.321 1.00 0.00 O ATOM 585 CB VAL A 39 -3.086 -14.078 5.020 1.00 0.00 C ATOM 586 CG1 VAL A 39 -3.478 -15.322 5.823 1.00 0.00 C ATOM 587 CG2 VAL A 39 -2.847 -12.913 5.990 1.00 0.00 C ATOM 0 H VAL A 39 -0.750 -14.655 5.826 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.165 -15.289 3.541 1.00 0.00 H new ATOM 0 HB VAL A 39 -3.895 -13.776 4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.318 -15.084 6.475 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.764 -16.121 5.139 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.631 -15.647 6.427 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.732 -12.767 6.609 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.992 -13.140 6.627 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.646 -12.003 5.424 1.00 0.00 H new ATOM 597 N ASP A 40 -2.466 -13.251 2.009 1.00 0.00 N ATOM 598 CA ASP A 40 -2.344 -12.319 0.887 1.00 0.00 C ATOM 599 C ASP A 40 -2.280 -10.827 1.246 1.00 0.00 C ATOM 600 O ASP A 40 -1.845 -9.975 0.469 1.00 0.00 O ATOM 601 CB ASP A 40 -3.557 -12.471 -0.025 1.00 0.00 C ATOM 602 CG ASP A 40 -3.661 -13.851 -0.667 1.00 0.00 C ATOM 603 OD1 ASP A 40 -4.142 -14.792 0.009 1.00 0.00 O ATOM 604 OD2 ASP A 40 -3.275 -13.952 -1.850 1.00 0.00 O ATOM 0 H ASP A 40 -3.227 -13.920 1.888 1.00 0.00 H new ATOM 0 HA ASP A 40 -1.392 -12.586 0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -4.462 -12.277 0.551 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -3.510 -11.716 -0.809 1.00 0.00 H new ATOM 609 N GLY A 41 -2.727 -10.547 2.460 1.00 0.00 N ATOM 610 CA GLY A 41 -2.905 -9.224 3.036 1.00 0.00 C ATOM 611 C GLY A 41 -1.780 -8.715 3.939 1.00 0.00 C ATOM 612 O GLY A 41 -2.038 -7.843 4.759 1.00 0.00 O ATOM 0 H GLY A 41 -2.992 -11.286 3.111 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.037 -8.512 2.221 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.831 -9.224 3.612 1.00 0.00 H new ATOM 616 N LEU A 42 -0.526 -9.137 3.756 1.00 0.00 N ATOM 617 CA LEU A 42 0.606 -8.587 4.524 1.00 0.00 C ATOM 618 C LEU A 42 1.225 -7.486 3.657 1.00 0.00 C ATOM 619 O LEU A 42 2.280 -7.624 3.044 1.00 0.00 O ATOM 620 CB LEU A 42 1.601 -9.687 4.966 1.00 0.00 C ATOM 621 CG LEU A 42 1.394 -10.254 6.381 1.00 0.00 C ATOM 622 CD1 LEU A 42 1.637 -9.222 7.480 1.00 0.00 C ATOM 623 CD2 LEU A 42 0.009 -10.869 6.564 1.00 0.00 C ATOM 0 H LEU A 42 -0.264 -9.858 3.084 1.00 0.00 H new ATOM 0 HA LEU A 42 0.277 -8.156 5.469 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.542 -10.510 4.254 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.611 -9.282 4.902 1.00 0.00 H new ATOM 0 HG LEU A 42 2.144 -11.038 6.479 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.475 -9.683 8.454 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.662 -8.858 7.417 1.00 0.00 H new ATOM 0 HD13 LEU A 42 0.947 -8.387 7.354 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.087 -11.255 7.579 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.753 -10.108 6.392 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.124 -11.684 5.852 1.00 0.00 H new ATOM 635 N PHE A 43 0.498 -6.367 3.608 1.00 0.00 N ATOM 636 CA PHE A 43 0.803 -5.232 2.745 1.00 0.00 C ATOM 637 C PHE A 43 1.537 -4.039 3.405 1.00 0.00 C ATOM 638 O PHE A 43 1.642 -3.958 4.632 1.00 0.00 O ATOM 639 CB PHE A 43 -0.505 -4.892 2.006 1.00 0.00 C ATOM 640 CG PHE A 43 -1.631 -4.146 2.724 1.00 0.00 C ATOM 641 CD1 PHE A 43 -1.592 -3.800 4.094 1.00 0.00 C ATOM 642 CD2 PHE A 43 -2.772 -3.792 1.978 1.00 0.00 C ATOM 643 CE1 PHE A 43 -2.648 -3.081 4.684 1.00 0.00 C ATOM 644 CE2 PHE A 43 -3.826 -3.071 2.565 1.00 0.00 C ATOM 645 CZ PHE A 43 -3.763 -2.709 3.917 1.00 0.00 C ATOM 0 H PHE A 43 -0.335 -6.226 4.180 1.00 0.00 H new ATOM 0 HA PHE A 43 1.577 -5.514 2.032 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -0.236 -4.302 1.130 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -0.922 -5.831 1.642 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -0.743 -4.091 4.694 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.838 -4.079 0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -2.600 -2.815 5.730 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.686 -2.795 1.973 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.568 -2.147 4.367 1.00 0.00 H new ATOM 655 N LEU A 44 2.080 -3.130 2.589 1.00 0.00 N ATOM 656 CA LEU A 44 2.732 -1.866 3.009 1.00 0.00 C ATOM 657 C LEU A 44 2.389 -0.710 2.046 1.00 0.00 C ATOM 658 O LEU A 44 2.336 -0.940 0.838 1.00 0.00 O ATOM 659 CB LEU A 44 4.261 -2.098 3.103 1.00 0.00 C ATOM 660 CG LEU A 44 5.112 -0.914 3.613 1.00 0.00 C ATOM 661 CD1 LEU A 44 4.893 -0.672 5.106 1.00 0.00 C ATOM 662 CD2 LEU A 44 6.594 -1.207 3.400 1.00 0.00 C ATOM 0 H LEU A 44 2.082 -3.251 1.576 1.00 0.00 H new ATOM 0 HA LEU A 44 2.356 -1.573 3.989 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.436 -2.951 3.759 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.624 -2.377 2.114 1.00 0.00 H new ATOM 0 HG LEU A 44 4.806 -0.030 3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.507 0.168 5.432 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.842 -0.446 5.288 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.174 -1.565 5.664 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.187 -0.367 3.762 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.869 -2.108 3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.787 -1.355 2.337 1.00 0.00 H new ATOM 674 N VAL A 45 2.245 0.534 2.521 1.00 0.00 N ATOM 675 CA VAL A 45 1.866 1.697 1.677 1.00 0.00 C ATOM 676 C VAL A 45 3.115 2.498 1.277 1.00 0.00 C ATOM 677 O VAL A 45 3.346 3.627 1.724 1.00 0.00 O ATOM 678 CB VAL A 45 0.788 2.598 2.328 1.00 0.00 C ATOM 679 CG1 VAL A 45 0.145 3.538 1.290 1.00 0.00 C ATOM 680 CG2 VAL A 45 -0.364 1.800 2.946 1.00 0.00 C ATOM 0 H VAL A 45 2.386 0.773 3.503 1.00 0.00 H new ATOM 0 HA VAL A 45 1.405 1.299 0.773 1.00 0.00 H new ATOM 0 HB VAL A 45 1.319 3.151 3.103 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.608 4.158 1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.913 4.176 0.852 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.325 2.946 0.505 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.087 2.487 3.386 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.851 1.206 2.173 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.026 1.138 3.720 1.00 0.00 H new ATOM 690 N ARG A 46 3.961 1.888 0.439 1.00 0.00 N ATOM 691 CA ARG A 46 5.200 2.503 -0.077 1.00 0.00 C ATOM 692 C ARG A 46 5.009 3.042 -1.462 1.00 0.00 C ATOM 693 O ARG A 46 4.081 2.673 -2.150 1.00 0.00 O ATOM 694 CB ARG A 46 6.413 1.547 0.043 1.00 0.00 C ATOM 695 CG ARG A 46 6.331 0.136 -0.597 1.00 0.00 C ATOM 696 CD ARG A 46 5.956 -0.023 -2.088 1.00 0.00 C ATOM 697 NE ARG A 46 6.716 0.862 -2.995 1.00 0.00 N ATOM 698 CZ ARG A 46 6.619 1.032 -4.292 1.00 0.00 C ATOM 699 NH1 ARG A 46 6.003 0.271 -5.123 1.00 0.00 N ATOM 700 NH2 ARG A 46 7.184 2.057 -4.822 1.00 0.00 N ATOM 0 H ARG A 46 3.807 0.941 0.093 1.00 0.00 H new ATOM 0 HA ARG A 46 5.433 3.360 0.555 1.00 0.00 H new ATOM 0 HB2 ARG A 46 7.275 2.054 -0.391 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.622 1.414 1.104 1.00 0.00 H new ATOM 0 HG2 ARG A 46 7.302 -0.339 -0.456 1.00 0.00 H new ATOM 0 HG3 ARG A 46 5.607 -0.439 -0.019 1.00 0.00 H new ATOM 0 HD2 ARG A 46 6.120 -1.059 -2.385 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.891 0.178 -2.208 1.00 0.00 H new ATOM 0 HE ARG A 46 7.430 1.431 -2.540 1.00 0.00 H new ATOM 0 HH11 ARG A 46 5.523 -0.565 -4.790 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.993 0.503 -6.116 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.695 2.718 -4.236 1.00 0.00 H new ATOM 0 HH22 ARG A 46 7.122 2.210 -5.829 1.00 0.00 H new ATOM 714 N GLU A 47 5.859 3.974 -1.851 1.00 0.00 N ATOM 715 CA GLU A 47 5.797 4.601 -3.156 1.00 0.00 C ATOM 716 C GLU A 47 7.210 4.821 -3.675 1.00 0.00 C ATOM 717 O GLU A 47 8.157 4.158 -3.239 1.00 0.00 O ATOM 718 CB GLU A 47 4.850 5.838 -3.114 1.00 0.00 C ATOM 719 CG GLU A 47 4.765 6.638 -1.792 1.00 0.00 C ATOM 720 CD GLU A 47 3.868 5.977 -0.739 1.00 0.00 C ATOM 721 OE1 GLU A 47 2.742 5.545 -0.946 1.00 0.00 O ATOM 722 OE2 GLU A 47 4.424 5.823 0.481 1.00 0.00 O ATOM 0 H GLU A 47 6.618 4.319 -1.264 1.00 0.00 H new ATOM 0 HA GLU A 47 5.333 3.957 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.161 6.525 -3.901 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.845 5.499 -3.365 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.768 6.756 -1.382 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.387 7.638 -2.004 1.00 0.00 H new ATOM 730 N SER A 48 7.364 5.709 -4.629 1.00 0.00 N ATOM 731 CA SER A 48 8.638 6.106 -5.165 1.00 0.00 C ATOM 732 C SER A 48 8.643 7.603 -5.414 1.00 0.00 C ATOM 733 O SER A 48 7.608 8.241 -5.622 1.00 0.00 O ATOM 734 CB SER A 48 8.905 5.356 -6.460 1.00 0.00 C ATOM 735 OG SER A 48 10.252 5.566 -6.825 1.00 0.00 O ATOM 0 H SER A 48 6.577 6.189 -5.066 1.00 0.00 H new ATOM 0 HA SER A 48 9.424 5.865 -4.450 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.709 4.292 -6.330 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.239 5.709 -7.247 1.00 0.00 H new ATOM 0 HG SER A 48 10.812 4.869 -6.424 1.00 0.00 H new ATOM 741 N GLN A 49 9.859 8.120 -5.468 1.00 0.00 N ATOM 742 CA GLN A 49 10.159 9.496 -5.813 1.00 0.00 C ATOM 743 C GLN A 49 10.540 9.532 -7.327 1.00 0.00 C ATOM 744 O GLN A 49 10.925 10.573 -7.859 1.00 0.00 O ATOM 745 CB GLN A 49 11.130 10.037 -4.731 1.00 0.00 C ATOM 746 CG GLN A 49 12.565 9.482 -4.758 1.00 0.00 C ATOM 747 CD GLN A 49 13.407 9.960 -5.941 1.00 0.00 C ATOM 748 OE1 GLN A 49 13.831 11.106 -6.017 1.00 0.00 O ATOM 749 NE2 GLN A 49 13.695 9.101 -6.899 1.00 0.00 N ATOM 0 H GLN A 49 10.694 7.571 -5.265 1.00 0.00 H new ATOM 0 HA GLN A 49 9.337 10.211 -5.771 1.00 0.00 H new ATOM 0 HB2 GLN A 49 11.181 11.121 -4.830 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.701 9.826 -3.751 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.068 9.764 -3.833 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.520 8.393 -4.777 1.00 0.00 H new ATOM 0 HE21 GLN A 49 13.347 8.143 -6.847 1.00 0.00 H new ATOM 0 HE22 GLN A 49 14.265 9.394 -7.692 1.00 0.00 H new ATOM 758 N ARG A 50 10.346 8.379 -8.022 1.00 0.00 N ATOM 759 CA ARG A 50 10.497 8.128 -9.470 1.00 0.00 C ATOM 760 C ARG A 50 9.128 8.185 -10.171 1.00 0.00 C ATOM 761 O ARG A 50 8.947 9.142 -10.922 1.00 0.00 O ATOM 762 CB ARG A 50 11.271 6.820 -9.734 1.00 0.00 C ATOM 763 CG ARG A 50 11.624 6.573 -11.213 1.00 0.00 C ATOM 764 CD ARG A 50 12.570 7.630 -11.800 1.00 0.00 C ATOM 765 NE ARG A 50 12.969 7.287 -13.179 1.00 0.00 N ATOM 766 CZ ARG A 50 13.785 7.974 -13.960 1.00 0.00 C ATOM 767 NH1 ARG A 50 14.350 9.082 -13.568 1.00 0.00 N ATOM 768 NH2 ARG A 50 14.056 7.554 -15.164 1.00 0.00 N ATOM 0 H ARG A 50 10.055 7.531 -7.535 1.00 0.00 H new ATOM 0 HA ARG A 50 11.103 8.921 -9.907 1.00 0.00 H new ATOM 0 HB2 ARG A 50 12.192 6.834 -9.151 1.00 0.00 H new ATOM 0 HB3 ARG A 50 10.677 5.982 -9.371 1.00 0.00 H new ATOM 0 HG2 ARG A 50 12.085 5.590 -11.309 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.705 6.553 -11.799 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.080 8.604 -11.793 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.458 7.715 -11.173 1.00 0.00 H new ATOM 0 HE ARG A 50 12.574 6.431 -13.570 1.00 0.00 H new ATOM 0 HH11 ARG A 50 14.167 9.444 -12.632 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.975 9.586 -14.197 1.00 0.00 H new ATOM 0 HH21 ARG A 50 13.638 6.690 -15.509 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.686 8.089 -15.761 1.00 0.00 H new ATOM 782 N ASN A 51 8.161 7.256 -9.969 1.00 0.00 N ATOM 783 CA ASN A 51 6.832 7.447 -10.570 1.00 0.00 C ATOM 784 C ASN A 51 6.192 8.748 -10.007 1.00 0.00 C ATOM 785 O ASN A 51 6.018 8.853 -8.789 1.00 0.00 O ATOM 786 CB ASN A 51 5.954 6.204 -10.375 1.00 0.00 C ATOM 787 CG ASN A 51 6.360 5.177 -11.413 1.00 0.00 C ATOM 788 OD1 ASN A 51 5.861 5.152 -12.532 1.00 0.00 O ATOM 789 ND2 ASN A 51 7.390 4.422 -11.132 1.00 0.00 N ATOM 0 H ASN A 51 8.273 6.405 -9.418 1.00 0.00 H new ATOM 0 HA ASN A 51 6.928 7.571 -11.649 1.00 0.00 H new ATOM 0 HB2 ASN A 51 6.081 5.801 -9.370 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.900 6.461 -10.484 1.00 0.00 H new ATOM 0 HD21 ASN A 51 7.782 3.808 -11.846 1.00 0.00 H new ATOM 0 HD22 ASN A 51 7.801 4.447 -10.199 1.00 0.00 H new ATOM 796 N PRO A 52 5.866 9.761 -10.841 1.00 0.00 N ATOM 797 CA PRO A 52 5.670 11.150 -10.381 1.00 0.00 C ATOM 798 C PRO A 52 4.330 11.413 -9.666 1.00 0.00 C ATOM 799 O PRO A 52 4.142 12.456 -9.037 1.00 0.00 O ATOM 800 CB PRO A 52 5.814 12.003 -11.648 1.00 0.00 C ATOM 801 CG PRO A 52 5.352 11.066 -12.763 1.00 0.00 C ATOM 802 CD PRO A 52 5.884 9.713 -12.297 1.00 0.00 C ATOM 0 HA PRO A 52 6.403 11.394 -9.612 1.00 0.00 H new ATOM 0 HB2 PRO A 52 5.199 12.902 -11.599 1.00 0.00 H new ATOM 0 HB3 PRO A 52 6.843 12.328 -11.798 1.00 0.00 H new ATOM 0 HG2 PRO A 52 4.267 11.062 -12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 52 5.763 11.353 -13.731 1.00 0.00 H new ATOM 0 HD2 PRO A 52 5.262 8.899 -12.669 1.00 0.00 H new ATOM 0 HD3 PRO A 52 6.893 9.540 -12.670 1.00 0.00 H new ATOM 810 N GLN A 53 3.403 10.460 -9.762 1.00 0.00 N ATOM 811 CA GLN A 53 2.034 10.478 -9.239 1.00 0.00 C ATOM 812 C GLN A 53 1.852 9.306 -8.254 1.00 0.00 C ATOM 813 O GLN A 53 0.764 8.737 -8.200 1.00 0.00 O ATOM 814 CB GLN A 53 1.078 10.423 -10.451 1.00 0.00 C ATOM 815 CG GLN A 53 1.159 11.698 -11.314 1.00 0.00 C ATOM 816 CD GLN A 53 0.294 11.661 -12.579 1.00 0.00 C ATOM 817 OE1 GLN A 53 -0.211 10.636 -13.019 1.00 0.00 O ATOM 818 NE2 GLN A 53 0.101 12.789 -13.230 1.00 0.00 N ATOM 0 H GLN A 53 3.605 9.585 -10.246 1.00 0.00 H new ATOM 0 HA GLN A 53 1.813 11.384 -8.675 1.00 0.00 H new ATOM 0 HB2 GLN A 53 1.321 9.555 -11.064 1.00 0.00 H new ATOM 0 HB3 GLN A 53 0.055 10.289 -10.099 1.00 0.00 H new ATOM 0 HG2 GLN A 53 0.858 12.552 -10.708 1.00 0.00 H new ATOM 0 HG3 GLN A 53 2.197 11.862 -11.603 1.00 0.00 H new ATOM 0 HE21 GLN A 53 0.512 13.655 -12.882 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -0.460 12.797 -14.082 1.00 0.00 H new ATOM 827 N GLY A 54 2.882 8.951 -7.458 1.00 0.00 N ATOM 828 CA GLY A 54 2.843 7.746 -6.611 1.00 0.00 C ATOM 829 C GLY A 54 2.502 7.744 -5.118 1.00 0.00 C ATOM 830 O GLY A 54 3.140 8.369 -4.275 1.00 0.00 O ATOM 0 H GLY A 54 3.749 9.483 -7.386 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.132 7.068 -7.084 1.00 0.00 H new ATOM 0 HA3 GLY A 54 3.827 7.286 -6.696 1.00 0.00 H new ATOM 834 N PHE A 55 1.469 6.935 -4.867 1.00 0.00 N ATOM 835 CA PHE A 55 0.830 6.492 -3.618 1.00 0.00 C ATOM 836 C PHE A 55 0.354 5.016 -3.765 1.00 0.00 C ATOM 837 O PHE A 55 -0.823 4.751 -4.009 1.00 0.00 O ATOM 838 CB PHE A 55 -0.337 7.451 -3.282 1.00 0.00 C ATOM 839 CG PHE A 55 -0.017 8.933 -3.398 1.00 0.00 C ATOM 840 CD1 PHE A 55 0.510 9.638 -2.300 1.00 0.00 C ATOM 841 CD2 PHE A 55 -0.221 9.601 -4.625 1.00 0.00 C ATOM 842 CE1 PHE A 55 0.838 11.000 -2.430 1.00 0.00 C ATOM 843 CE2 PHE A 55 0.122 10.957 -4.760 1.00 0.00 C ATOM 844 CZ PHE A 55 0.648 11.659 -3.659 1.00 0.00 C ATOM 0 H PHE A 55 0.986 6.509 -5.658 1.00 0.00 H new ATOM 0 HA PHE A 55 1.541 6.522 -2.792 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -1.173 7.224 -3.943 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -0.671 7.247 -2.265 1.00 0.00 H new ATOM 0 HD1 PHE A 55 0.663 9.133 -1.357 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -0.643 9.067 -5.464 1.00 0.00 H new ATOM 0 HE1 PHE A 55 1.237 11.541 -1.585 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -0.018 11.459 -5.706 1.00 0.00 H new ATOM 0 HZ PHE A 55 0.906 12.703 -3.757 1.00 0.00 H new ATOM 854 N VAL A 56 1.254 4.035 -3.674 1.00 0.00 N ATOM 855 CA VAL A 56 1.026 2.588 -3.895 1.00 0.00 C ATOM 856 C VAL A 56 0.801 1.819 -2.591 1.00 0.00 C ATOM 857 O VAL A 56 1.241 2.193 -1.509 1.00 0.00 O ATOM 858 CB VAL A 56 2.169 1.901 -4.737 1.00 0.00 C ATOM 859 CG1 VAL A 56 3.328 2.832 -5.124 1.00 0.00 C ATOM 860 CG2 VAL A 56 2.788 0.646 -4.109 1.00 0.00 C ATOM 0 H VAL A 56 2.224 4.232 -3.429 1.00 0.00 H new ATOM 0 HA VAL A 56 0.108 2.539 -4.481 1.00 0.00 H new ATOM 0 HB VAL A 56 1.611 1.613 -5.628 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.066 2.274 -5.700 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.947 3.657 -5.725 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.795 3.226 -4.221 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.562 0.253 -4.768 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.228 0.901 -3.145 1.00 0.00 H new ATOM 0 HG23 VAL A 56 2.015 -0.109 -3.967 1.00 0.00 H new ATOM 870 N LEU A 57 0.081 0.710 -2.743 1.00 0.00 N ATOM 871 CA LEU A 57 -0.164 -0.303 -1.730 1.00 0.00 C ATOM 872 C LEU A 57 0.580 -1.532 -2.275 1.00 0.00 C ATOM 873 O LEU A 57 0.434 -1.851 -3.452 1.00 0.00 O ATOM 874 CB LEU A 57 -1.675 -0.528 -1.529 1.00 0.00 C ATOM 875 CG LEU A 57 -2.134 -0.346 -0.075 1.00 0.00 C ATOM 876 CD1 LEU A 57 -3.605 -0.740 0.025 1.00 0.00 C ATOM 877 CD2 LEU A 57 -1.316 -1.202 0.895 1.00 0.00 C ATOM 0 H LEU A 57 -0.371 0.485 -3.629 1.00 0.00 H new ATOM 0 HA LEU A 57 0.190 -0.034 -0.735 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.225 0.166 -2.165 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.931 -1.535 -1.859 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.988 0.698 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.946 -0.616 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.197 -0.104 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.724 -1.782 -0.273 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.674 -1.042 1.912 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.425 -2.254 0.633 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.265 -0.920 0.832 1.00 0.00 H new ATOM 889 N SER A 58 1.420 -2.187 -1.485 1.00 0.00 N ATOM 890 CA SER A 58 2.266 -3.301 -1.945 1.00 0.00 C ATOM 891 C SER A 58 1.717 -4.527 -1.261 1.00 0.00 C ATOM 892 O SER A 58 1.759 -4.594 -0.041 1.00 0.00 O ATOM 893 CB SER A 58 3.749 -3.022 -1.681 1.00 0.00 C ATOM 894 OG SER A 58 4.045 -2.735 -0.331 1.00 0.00 O ATOM 0 H SER A 58 1.541 -1.965 -0.497 1.00 0.00 H new ATOM 0 HA SER A 58 2.232 -3.445 -3.025 1.00 0.00 H new ATOM 0 HB2 SER A 58 4.333 -3.887 -1.995 1.00 0.00 H new ATOM 0 HB3 SER A 58 4.066 -2.182 -2.299 1.00 0.00 H new ATOM 0 HG SER A 58 3.435 -2.041 -0.003 1.00 0.00 H new ATOM 900 N LEU A 59 1.234 -5.500 -2.025 1.00 0.00 N ATOM 901 CA LEU A 59 0.529 -6.667 -1.494 1.00 0.00 C ATOM 902 C LEU A 59 1.459 -7.868 -1.331 1.00 0.00 C ATOM 903 O LEU A 59 2.372 -8.050 -2.135 1.00 0.00 O ATOM 904 CB LEU A 59 -0.645 -6.973 -2.457 1.00 0.00 C ATOM 905 CG LEU A 59 -1.517 -5.758 -2.862 1.00 0.00 C ATOM 906 CD1 LEU A 59 -2.581 -6.174 -3.876 1.00 0.00 C ATOM 907 CD2 LEU A 59 -2.206 -5.119 -1.656 1.00 0.00 C ATOM 0 H LEU A 59 1.320 -5.504 -3.041 1.00 0.00 H new ATOM 0 HA LEU A 59 0.150 -6.455 -0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.239 -7.424 -3.363 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.288 -7.719 -1.990 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.845 -5.024 -3.306 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.183 -5.307 -4.148 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.098 -6.574 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.223 -6.938 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.806 -4.272 -1.987 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.850 -5.854 -1.174 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.453 -4.775 -0.947 1.00 0.00 H new ATOM 919 N CYS A 60 1.209 -8.711 -0.322 1.00 0.00 N ATOM 920 CA CYS A 60 2.047 -9.906 -0.089 1.00 0.00 C ATOM 921 C CYS A 60 1.139 -11.095 -0.333 1.00 0.00 C ATOM 922 O CYS A 60 0.738 -11.817 0.578 1.00 0.00 O ATOM 923 CB CYS A 60 2.747 -9.931 1.271 1.00 0.00 C ATOM 924 SG CYS A 60 3.940 -11.295 1.298 1.00 0.00 S ATOM 0 H CYS A 60 0.444 -8.595 0.342 1.00 0.00 H new ATOM 0 HA CYS A 60 2.896 -9.915 -0.773 1.00 0.00 H new ATOM 0 HB2 CYS A 60 3.255 -8.983 1.450 1.00 0.00 H new ATOM 0 HB3 CYS A 60 2.015 -10.056 2.069 1.00 0.00 H new ATOM 0 HG CYS A 60 5.139 -10.827 1.115 1.00 0.00 H new ATOM 930 N HIS A 61 0.748 -11.195 -1.601 1.00 0.00 N ATOM 931 CA HIS A 61 -0.222 -12.153 -2.082 1.00 0.00 C ATOM 932 C HIS A 61 0.319 -13.599 -2.061 1.00 0.00 C ATOM 933 O HIS A 61 1.398 -13.876 -1.528 1.00 0.00 O ATOM 934 CB HIS A 61 -0.799 -11.573 -3.377 1.00 0.00 C ATOM 935 CG HIS A 61 -1.187 -12.463 -4.528 1.00 0.00 C ATOM 936 ND1 HIS A 61 -0.328 -12.849 -5.554 1.00 0.00 N ATOM 937 CD2 HIS A 61 -2.430 -12.954 -4.790 1.00 0.00 C ATOM 938 CE1 HIS A 61 -1.074 -13.548 -6.423 1.00 0.00 C ATOM 939 NE2 HIS A 61 -2.338 -13.637 -5.982 1.00 0.00 N ATOM 0 H HIS A 61 1.113 -10.590 -2.337 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.077 -12.292 -1.420 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -1.687 -11.004 -3.102 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -0.069 -10.860 -3.759 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -3.314 -12.832 -4.182 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -0.710 -13.977 -7.345 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -3.101 -14.127 -6.450 1.00 0.00 H new ATOM 947 N LEU A 62 -0.396 -14.517 -2.703 1.00 0.00 N ATOM 948 CA LEU A 62 -0.100 -15.972 -2.669 1.00 0.00 C ATOM 949 C LEU A 62 0.686 -16.597 -3.776 1.00 0.00 C ATOM 950 O LEU A 62 0.914 -17.811 -3.755 1.00 0.00 O ATOM 951 CB LEU A 62 -1.261 -16.805 -2.082 1.00 0.00 C ATOM 952 CG LEU A 62 -2.195 -17.490 -3.103 1.00 0.00 C ATOM 953 CD1 LEU A 62 -3.362 -18.144 -2.363 1.00 0.00 C ATOM 954 CD2 LEU A 62 -2.757 -16.551 -4.172 1.00 0.00 C ATOM 0 H LEU A 62 -1.210 -14.284 -3.272 1.00 0.00 H new ATOM 0 HA LEU A 62 0.709 -16.014 -1.939 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.838 -17.574 -1.436 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -1.864 -16.153 -1.450 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.581 -18.225 -3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -4.023 -18.628 -3.082 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.979 -18.887 -1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.917 -17.383 -1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.402 -17.113 -4.847 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.334 -15.759 -3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.936 -16.111 -4.737 1.00 0.00 H new ATOM 966 N GLN A 63 1.153 -15.762 -4.696 1.00 0.00 N ATOM 967 CA GLN A 63 2.102 -16.267 -5.664 1.00 0.00 C ATOM 968 C GLN A 63 3.103 -15.222 -6.174 1.00 0.00 C ATOM 969 O GLN A 63 4.144 -15.589 -6.727 1.00 0.00 O ATOM 970 CB GLN A 63 1.492 -17.155 -6.771 1.00 0.00 C ATOM 971 CG GLN A 63 0.468 -16.438 -7.657 1.00 0.00 C ATOM 972 CD GLN A 63 0.033 -17.308 -8.836 1.00 0.00 C ATOM 973 OE1 GLN A 63 0.474 -17.138 -9.966 1.00 0.00 O ATOM 974 NE2 GLN A 63 -0.841 -18.273 -8.627 1.00 0.00 N ATOM 0 H GLN A 63 0.902 -14.778 -4.788 1.00 0.00 H new ATOM 0 HA GLN A 63 2.710 -16.962 -5.084 1.00 0.00 H new ATOM 0 HB2 GLN A 63 2.296 -17.536 -7.400 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.014 -18.018 -6.307 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.404 -16.170 -7.061 1.00 0.00 H new ATOM 0 HG3 GLN A 63 0.897 -15.508 -8.030 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.217 -18.427 -7.691 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -1.141 -18.866 -9.401 1.00 0.00 H new ATOM 983 N LYS A 64 2.815 -13.934 -5.958 1.00 0.00 N ATOM 984 CA LYS A 64 3.716 -12.818 -6.265 1.00 0.00 C ATOM 985 C LYS A 64 3.473 -11.645 -5.308 1.00 0.00 C ATOM 986 O LYS A 64 2.516 -11.664 -4.536 1.00 0.00 O ATOM 987 CB LYS A 64 3.548 -12.422 -7.747 1.00 0.00 C ATOM 988 CG LYS A 64 2.223 -11.689 -8.043 1.00 0.00 C ATOM 989 CD LYS A 64 1.632 -12.070 -9.411 1.00 0.00 C ATOM 990 CE LYS A 64 2.571 -11.723 -10.580 1.00 0.00 C ATOM 991 NZ LYS A 64 2.004 -12.157 -11.889 1.00 0.00 N ATOM 0 H LYS A 64 1.928 -13.632 -5.555 1.00 0.00 H new ATOM 0 HA LYS A 64 4.751 -13.124 -6.116 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.381 -11.783 -8.040 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.603 -13.320 -8.363 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.500 -11.922 -7.261 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.392 -10.613 -8.011 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.420 -13.139 -9.426 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.682 -11.554 -9.548 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.748 -10.648 -10.598 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.538 -12.202 -10.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.664 -11.907 -12.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.859 -13.187 -11.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.093 -11.680 -12.048 1.00 0.00 H new ATOM 1005 N VAL A 65 4.313 -10.612 -5.374 1.00 0.00 N ATOM 1006 CA VAL A 65 4.120 -9.370 -4.603 1.00 0.00 C ATOM 1007 C VAL A 65 4.081 -8.209 -5.601 1.00 0.00 C ATOM 1008 O VAL A 65 5.065 -7.906 -6.278 1.00 0.00 O ATOM 1009 CB VAL A 65 5.095 -9.228 -3.416 1.00 0.00 C ATOM 1010 CG1 VAL A 65 5.014 -10.459 -2.506 1.00 0.00 C ATOM 1011 CG2 VAL A 65 6.554 -9.031 -3.802 1.00 0.00 C ATOM 0 H VAL A 65 5.147 -10.606 -5.961 1.00 0.00 H new ATOM 0 HA VAL A 65 3.165 -9.380 -4.078 1.00 0.00 H new ATOM 0 HB VAL A 65 4.771 -8.320 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.708 -10.343 -1.674 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.999 -10.561 -2.121 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.277 -11.350 -3.076 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.160 -8.942 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 65 6.895 -9.887 -4.385 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.653 -8.123 -4.398 1.00 0.00 H new ATOM 1021 N LYS A 66 2.891 -7.622 -5.754 1.00 0.00 N ATOM 1022 CA LYS A 66 2.571 -6.571 -6.733 1.00 0.00 C ATOM 1023 C LYS A 66 2.088 -5.290 -6.060 1.00 0.00 C ATOM 1024 O LYS A 66 1.678 -5.300 -4.899 1.00 0.00 O ATOM 1025 CB LYS A 66 1.613 -7.122 -7.812 1.00 0.00 C ATOM 1026 CG LYS A 66 0.300 -7.706 -7.259 1.00 0.00 C ATOM 1027 CD LYS A 66 -0.577 -8.243 -8.402 1.00 0.00 C ATOM 1028 CE LYS A 66 -1.892 -8.861 -7.896 1.00 0.00 C ATOM 1029 NZ LYS A 66 -1.719 -10.262 -7.391 1.00 0.00 N ATOM 0 H LYS A 66 2.089 -7.874 -5.177 1.00 0.00 H new ATOM 0 HA LYS A 66 3.484 -6.277 -7.251 1.00 0.00 H new ATOM 0 HB2 LYS A 66 1.374 -6.321 -8.511 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.130 -7.896 -8.379 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.521 -8.508 -6.555 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -0.242 -6.938 -6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -0.803 -7.432 -9.094 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -0.019 -8.993 -8.962 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.297 -8.239 -7.097 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.624 -8.859 -8.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.635 -10.628 -7.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.359 -10.865 -8.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.042 -10.265 -6.601 1.00 0.00 H new ATOM 1043 N HIS A 67 2.137 -4.192 -6.806 1.00 0.00 N ATOM 1044 CA HIS A 67 1.848 -2.837 -6.328 1.00 0.00 C ATOM 1045 C HIS A 67 0.499 -2.310 -6.821 1.00 0.00 C ATOM 1046 O HIS A 67 -0.054 -2.824 -7.778 1.00 0.00 O ATOM 1047 CB HIS A 67 3.073 -1.980 -6.657 1.00 0.00 C ATOM 1048 CG HIS A 67 4.290 -2.552 -5.972 1.00 0.00 C ATOM 1049 ND1 HIS A 67 4.687 -2.268 -4.666 1.00 0.00 N ATOM 1050 CD2 HIS A 67 5.079 -3.554 -6.454 1.00 0.00 C ATOM 1051 CE1 HIS A 67 5.727 -3.081 -4.409 1.00 0.00 C ATOM 1052 NE2 HIS A 67 5.993 -3.848 -5.471 1.00 0.00 N ATOM 0 H HIS A 67 2.387 -4.217 -7.795 1.00 0.00 H new ATOM 0 HA HIS A 67 1.703 -2.812 -5.248 1.00 0.00 H new ATOM 0 HB2 HIS A 67 3.230 -1.951 -7.735 1.00 0.00 H new ATOM 0 HB3 HIS A 67 2.909 -0.953 -6.331 1.00 0.00 H new ATOM 0 HD2 HIS A 67 5.001 -4.026 -7.422 1.00 0.00 H new ATOM 0 HE1 HIS A 67 6.271 -3.110 -3.476 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.745 -4.534 -5.540 1.00 0.00 H new ATOM 1060 N TYR A 68 -0.021 -1.250 -6.196 1.00 0.00 N ATOM 1061 CA TYR A 68 -1.375 -0.726 -6.457 1.00 0.00 C ATOM 1062 C TYR A 68 -1.509 0.706 -7.015 1.00 0.00 C ATOM 1063 O TYR A 68 -2.616 1.224 -7.068 1.00 0.00 O ATOM 1064 CB TYR A 68 -2.146 -0.911 -5.133 1.00 0.00 C ATOM 1065 CG TYR A 68 -3.641 -1.117 -5.225 1.00 0.00 C ATOM 1066 CD1 TYR A 68 -4.145 -2.363 -5.638 1.00 0.00 C ATOM 1067 CD2 TYR A 68 -4.523 -0.111 -4.796 1.00 0.00 C ATOM 1068 CE1 TYR A 68 -5.533 -2.590 -5.650 1.00 0.00 C ATOM 1069 CE2 TYR A 68 -5.911 -0.334 -4.812 1.00 0.00 C ATOM 1070 CZ TYR A 68 -6.424 -1.573 -5.251 1.00 0.00 C ATOM 1071 OH TYR A 68 -7.766 -1.798 -5.285 1.00 0.00 O ATOM 0 H TYR A 68 0.487 -0.722 -5.486 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.787 -1.289 -7.294 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -1.719 -1.767 -4.611 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -1.964 -0.035 -4.511 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -3.467 -3.145 -5.946 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -4.134 0.836 -4.453 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.918 -3.548 -5.966 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -6.586 0.444 -4.488 1.00 0.00 H new ATOM 0 HH TYR A 68 -8.239 -1.003 -4.962 1.00 0.00 H new ATOM 1081 N LEU A 69 -0.452 1.360 -7.506 1.00 0.00 N ATOM 1082 CA LEU A 69 -0.496 2.776 -7.923 1.00 0.00 C ATOM 1083 C LEU A 69 -0.321 3.100 -9.404 1.00 0.00 C ATOM 1084 O LEU A 69 0.588 2.568 -10.019 1.00 0.00 O ATOM 1085 CB LEU A 69 0.675 3.450 -7.235 1.00 0.00 C ATOM 1086 CG LEU A 69 1.000 4.915 -7.514 1.00 0.00 C ATOM 1087 CD1 LEU A 69 1.780 5.137 -8.814 1.00 0.00 C ATOM 1088 CD2 LEU A 69 -0.258 5.787 -7.368 1.00 0.00 C ATOM 0 H LEU A 69 0.463 0.927 -7.628 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.502 3.107 -7.666 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.515 3.355 -6.161 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.566 2.871 -7.477 1.00 0.00 H new ATOM 0 HG LEU A 69 1.701 5.248 -6.748 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.974 6.202 -8.945 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.727 4.599 -8.767 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.195 4.769 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.005 6.828 -7.571 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.016 5.453 -8.076 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.646 5.699 -6.353 1.00 0.00 H new ATOM 1100 N ILE A 70 -1.172 3.969 -9.963 1.00 0.00 N ATOM 1101 CA ILE A 70 -1.007 4.518 -11.330 1.00 0.00 C ATOM 1102 C ILE A 70 -1.417 6.001 -11.378 1.00 0.00 C ATOM 1103 O ILE A 70 -0.696 6.802 -11.974 1.00 0.00 O ATOM 1104 CB ILE A 70 -1.639 3.674 -12.460 1.00 0.00 C ATOM 1105 CG1 ILE A 70 -0.928 2.309 -12.456 1.00 0.00 C ATOM 1106 CG2 ILE A 70 -1.437 4.318 -13.845 1.00 0.00 C ATOM 1107 CD1 ILE A 70 -1.193 1.375 -13.608 1.00 0.00 C ATOM 0 H ILE A 70 -2.002 4.318 -9.483 1.00 0.00 H new ATOM 0 HA ILE A 70 0.059 4.454 -11.547 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.711 3.591 -12.283 1.00 0.00 H new ATOM 0 HG12 ILE A 70 0.146 2.491 -12.413 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.201 1.792 -11.536 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.897 3.691 -14.609 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.900 5.305 -13.858 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.371 4.415 -14.049 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.625 0.455 -13.469 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.257 1.142 -13.650 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.889 1.851 -14.540 1.00 0.00 H new ATOM 1119 N LEU A 71 -2.524 6.384 -10.718 1.00 0.00 N ATOM 1120 CA LEU A 71 -3.076 7.748 -10.801 1.00 0.00 C ATOM 1121 C LEU A 71 -3.140 8.482 -9.434 1.00 0.00 C ATOM 1122 O LEU A 71 -3.310 7.827 -8.401 1.00 0.00 O ATOM 1123 CB LEU A 71 -4.487 7.659 -11.449 1.00 0.00 C ATOM 1124 CG LEU A 71 -4.766 6.553 -12.505 1.00 0.00 C ATOM 1125 CD1 LEU A 71 -6.269 6.373 -12.721 1.00 0.00 C ATOM 1126 CD2 LEU A 71 -4.110 6.815 -13.861 1.00 0.00 C ATOM 0 H LEU A 71 -3.059 5.760 -10.114 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.401 8.348 -11.412 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.211 7.534 -10.644 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.694 8.621 -11.918 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.323 5.647 -12.092 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.439 5.594 -13.464 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.740 6.087 -11.781 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.701 7.310 -13.072 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.350 6.001 -14.545 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.483 7.754 -14.270 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.029 6.877 -13.736 1.00 0.00 H new ATOM 1138 N PRO A 72 -3.052 9.830 -9.410 1.00 0.00 N ATOM 1139 CA PRO A 72 -3.120 10.655 -8.197 1.00 0.00 C ATOM 1140 C PRO A 72 -4.559 11.116 -7.892 1.00 0.00 C ATOM 1141 O PRO A 72 -5.511 10.732 -8.581 1.00 0.00 O ATOM 1142 CB PRO A 72 -2.202 11.840 -8.531 1.00 0.00 C ATOM 1143 CG PRO A 72 -2.526 12.097 -10.002 1.00 0.00 C ATOM 1144 CD PRO A 72 -2.778 10.694 -10.557 1.00 0.00 C ATOM 0 HA PRO A 72 -2.813 10.116 -7.301 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.417 12.709 -7.909 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -1.150 11.594 -8.383 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.401 12.738 -10.115 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.701 12.591 -10.515 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.620 10.697 -11.249 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.911 10.336 -11.112 1.00 0.00 H new ATOM 1152 N SER A 73 -4.731 11.971 -6.876 1.00 0.00 N ATOM 1153 CA SER A 73 -6.026 12.586 -6.540 1.00 0.00 C ATOM 1154 C SER A 73 -6.586 13.429 -7.697 1.00 0.00 C ATOM 1155 O SER A 73 -5.834 14.066 -8.439 1.00 0.00 O ATOM 1156 CB SER A 73 -5.927 13.433 -5.268 1.00 0.00 C ATOM 1157 OG SER A 73 -5.623 12.598 -4.164 1.00 0.00 O ATOM 0 H SER A 73 -3.972 12.259 -6.259 1.00 0.00 H new ATOM 0 HA SER A 73 -6.721 11.766 -6.360 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.155 14.194 -5.385 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.867 13.956 -5.093 1.00 0.00 H new ATOM 0 HG SER A 73 -5.558 13.141 -3.351 1.00 0.00 H new ATOM 1163 N GLU A 74 -7.915 13.432 -7.853 1.00 0.00 N ATOM 1164 CA GLU A 74 -8.639 14.077 -8.959 1.00 0.00 C ATOM 1165 C GLU A 74 -9.636 15.149 -8.451 1.00 0.00 C ATOM 1166 O GLU A 74 -9.644 15.507 -7.271 1.00 0.00 O ATOM 1167 CB GLU A 74 -9.333 12.969 -9.788 1.00 0.00 C ATOM 1168 CG GLU A 74 -8.395 11.857 -10.298 1.00 0.00 C ATOM 1169 CD GLU A 74 -7.286 12.364 -11.225 1.00 0.00 C ATOM 1170 OE1 GLU A 74 -7.468 13.144 -12.159 1.00 0.00 O ATOM 1171 OE2 GLU A 74 -6.043 11.878 -10.969 1.00 0.00 O ATOM 0 H GLU A 74 -8.539 12.970 -7.191 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.938 14.618 -9.595 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.114 12.514 -9.178 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.825 13.430 -10.644 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.941 11.356 -9.443 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.986 11.110 -10.828 1.00 0.00 H new ATOM 1179 N GLU A 75 -10.497 15.659 -9.342 1.00 0.00 N ATOM 1180 CA GLU A 75 -11.578 16.609 -9.001 1.00 0.00 C ATOM 1181 C GLU A 75 -12.952 15.922 -8.844 1.00 0.00 C ATOM 1182 O GLU A 75 -13.874 16.505 -8.268 1.00 0.00 O ATOM 1183 CB GLU A 75 -11.646 17.724 -10.058 1.00 0.00 C ATOM 1184 CG GLU A 75 -10.378 18.589 -10.087 1.00 0.00 C ATOM 1185 CD GLU A 75 -10.525 19.757 -11.078 1.00 0.00 C ATOM 1186 OE1 GLU A 75 -10.192 19.589 -12.277 1.00 0.00 O ATOM 1187 OE2 GLU A 75 -10.969 20.859 -10.667 1.00 0.00 O ATOM 0 H GLU A 75 -10.466 15.424 -10.334 1.00 0.00 H new ATOM 0 HA GLU A 75 -11.336 17.040 -8.030 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -11.800 17.279 -11.041 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.509 18.358 -9.857 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -10.177 18.978 -9.089 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -9.522 17.975 -10.368 1.00 0.00 H new ATOM 1194 N GLU A 76 -13.087 14.671 -9.305 1.00 0.00 N ATOM 1195 CA GLU A 76 -14.289 13.823 -9.158 1.00 0.00 C ATOM 1196 C GLU A 76 -14.088 12.621 -8.205 1.00 0.00 C ATOM 1197 O GLU A 76 -14.938 11.730 -8.123 1.00 0.00 O ATOM 1198 CB GLU A 76 -14.808 13.412 -10.549 1.00 0.00 C ATOM 1199 CG GLU A 76 -13.871 12.459 -11.308 1.00 0.00 C ATOM 1200 CD GLU A 76 -14.449 12.117 -12.693 1.00 0.00 C ATOM 1201 OE1 GLU A 76 -15.343 11.240 -12.788 1.00 0.00 O ATOM 1202 OE2 GLU A 76 -14.015 12.726 -13.704 1.00 0.00 O ATOM 0 H GLU A 76 -12.337 14.200 -9.810 1.00 0.00 H new ATOM 0 HA GLU A 76 -15.058 14.420 -8.668 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -15.781 12.935 -10.436 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -14.961 14.309 -11.149 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -12.890 12.920 -11.422 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -13.729 11.545 -10.732 1.00 0.00 H new ATOM 1209 N GLY A 77 -12.953 12.579 -7.496 1.00 0.00 N ATOM 1210 CA GLY A 77 -12.578 11.532 -6.537 1.00 0.00 C ATOM 1211 C GLY A 77 -11.200 11.772 -5.900 1.00 0.00 C ATOM 1212 O GLY A 77 -10.444 12.640 -6.341 1.00 0.00 O ATOM 0 H GLY A 77 -12.241 13.304 -7.578 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -13.332 11.479 -5.751 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.576 10.566 -7.043 1.00 0.00 H new ATOM 1216 N ARG A 78 -10.879 11.003 -4.852 1.00 0.00 N ATOM 1217 CA ARG A 78 -9.616 11.101 -4.082 1.00 0.00 C ATOM 1218 C ARG A 78 -8.493 10.308 -4.772 1.00 0.00 C ATOM 1219 O ARG A 78 -8.467 10.261 -5.998 1.00 0.00 O ATOM 1220 CB ARG A 78 -9.868 10.666 -2.626 1.00 0.00 C ATOM 1221 CG ARG A 78 -11.079 11.305 -1.924 1.00 0.00 C ATOM 1222 CD ARG A 78 -10.937 12.820 -1.748 1.00 0.00 C ATOM 1223 NE ARG A 78 -9.744 13.145 -0.943 1.00 0.00 N ATOM 1224 CZ ARG A 78 -9.326 14.353 -0.601 1.00 0.00 C ATOM 1225 NH1 ARG A 78 -9.970 15.428 -0.953 1.00 0.00 N ATOM 1226 NH2 ARG A 78 -8.245 14.505 0.110 1.00 0.00 N ATOM 0 H ARG A 78 -11.501 10.275 -4.501 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.274 12.136 -4.055 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.995 9.584 -2.609 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.976 10.892 -2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.979 11.094 -2.501 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.211 10.842 -0.946 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -10.864 13.299 -2.725 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -11.828 13.219 -1.263 1.00 0.00 H new ATOM 0 HE ARG A 78 -9.184 12.358 -0.617 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -10.822 15.353 -1.508 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.622 16.345 -0.674 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.712 13.688 0.409 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.932 15.441 0.368 1.00 0.00 H new ATOM 1240 N LEU A 79 -7.574 9.679 -4.021 1.00 0.00 N ATOM 1241 CA LEU A 79 -6.521 8.811 -4.586 1.00 0.00 C ATOM 1242 C LEU A 79 -7.171 7.763 -5.509 1.00 0.00 C ATOM 1243 O LEU A 79 -7.966 6.954 -5.038 1.00 0.00 O ATOM 1244 CB LEU A 79 -5.713 8.131 -3.462 1.00 0.00 C ATOM 1245 CG LEU A 79 -4.773 9.061 -2.671 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -4.123 8.270 -1.536 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -3.657 9.636 -3.545 1.00 0.00 C ATOM 0 H LEU A 79 -7.538 9.756 -3.005 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.827 9.417 -5.168 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.411 7.668 -2.764 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.119 7.328 -3.899 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.376 9.886 -2.292 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.457 8.923 -0.973 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.897 7.882 -0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.552 7.440 -1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.021 10.285 -2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.060 8.822 -3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.094 10.212 -4.361 1.00 0.00 H new ATOM 1259 N TYR A 80 -6.866 7.783 -6.811 1.00 0.00 N ATOM 1260 CA TYR A 80 -7.529 6.915 -7.794 1.00 0.00 C ATOM 1261 C TYR A 80 -6.997 5.472 -7.848 1.00 0.00 C ATOM 1262 O TYR A 80 -5.789 5.248 -7.925 1.00 0.00 O ATOM 1263 CB TYR A 80 -7.556 7.573 -9.179 1.00 0.00 C ATOM 1264 CG TYR A 80 -8.941 7.932 -9.682 1.00 0.00 C ATOM 1265 CD1 TYR A 80 -9.650 8.991 -9.086 1.00 0.00 C ATOM 1266 CD2 TYR A 80 -9.515 7.214 -10.750 1.00 0.00 C ATOM 1267 CE1 TYR A 80 -10.921 9.352 -9.572 1.00 0.00 C ATOM 1268 CE2 TYR A 80 -10.787 7.573 -11.239 1.00 0.00 C ATOM 1269 CZ TYR A 80 -11.488 8.648 -10.654 1.00 0.00 C ATOM 1270 OH TYR A 80 -12.731 8.977 -11.093 1.00 0.00 O ATOM 0 H TYR A 80 -6.157 8.397 -7.213 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.554 6.807 -7.440 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.949 8.478 -9.148 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.087 6.899 -9.896 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.218 9.528 -8.254 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -8.980 6.388 -11.194 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.462 10.168 -9.116 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -11.225 7.026 -12.061 1.00 0.00 H new ATOM 0 HH TYR A 80 -12.976 8.399 -11.845 1.00 0.00 H new ATOM 1280 N PHE A 81 -7.927 4.503 -7.893 1.00 0.00 N ATOM 1281 CA PHE A 81 -7.670 3.061 -7.978 1.00 0.00 C ATOM 1282 C PHE A 81 -8.664 2.311 -8.878 1.00 0.00 C ATOM 1283 O PHE A 81 -9.872 2.509 -8.753 1.00 0.00 O ATOM 1284 CB PHE A 81 -7.406 2.382 -6.623 1.00 0.00 C ATOM 1285 CG PHE A 81 -6.415 3.088 -5.701 1.00 0.00 C ATOM 1286 CD1 PHE A 81 -5.035 2.961 -5.934 1.00 0.00 C ATOM 1287 CD2 PHE A 81 -6.853 3.844 -4.593 1.00 0.00 C ATOM 1288 CE1 PHE A 81 -4.098 3.551 -5.060 1.00 0.00 C ATOM 1289 CE2 PHE A 81 -5.921 4.433 -3.717 1.00 0.00 C ATOM 1290 CZ PHE A 81 -4.544 4.283 -3.948 1.00 0.00 C ATOM 0 H PHE A 81 -8.924 4.717 -7.870 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.714 2.983 -8.496 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -8.356 2.285 -6.097 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.041 1.372 -6.810 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -4.688 2.405 -6.792 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -7.911 3.972 -4.416 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -3.040 3.440 -5.246 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -6.266 5.001 -2.866 1.00 0.00 H new ATOM 0 HZ PHE A 81 -3.830 4.730 -3.272 1.00 0.00 H new ATOM 1300 N SER A 82 -8.136 1.435 -9.746 1.00 0.00 N ATOM 1301 CA SER A 82 -8.849 0.697 -10.804 1.00 0.00 C ATOM 1302 C SER A 82 -8.480 -0.790 -11.081 1.00 0.00 C ATOM 1303 O SER A 82 -8.693 -1.246 -12.205 1.00 0.00 O ATOM 1304 CB SER A 82 -8.764 1.502 -12.106 1.00 0.00 C ATOM 1305 OG SER A 82 -9.237 2.833 -11.957 1.00 0.00 O ATOM 0 H SER A 82 -7.142 1.208 -9.729 1.00 0.00 H new ATOM 0 HA SER A 82 -9.858 0.605 -10.402 1.00 0.00 H new ATOM 0 HB2 SER A 82 -7.729 1.524 -12.448 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.345 0.998 -12.879 1.00 0.00 H new ATOM 0 HG SER A 82 -9.161 3.305 -12.812 1.00 0.00 H new ATOM 1311 N MET A 83 -7.851 -1.518 -10.139 1.00 0.00 N ATOM 1312 CA MET A 83 -7.582 -2.985 -10.201 1.00 0.00 C ATOM 1313 C MET A 83 -8.571 -3.821 -11.059 1.00 0.00 C ATOM 1314 O MET A 83 -9.767 -3.545 -11.094 1.00 0.00 O ATOM 1315 CB MET A 83 -7.739 -3.485 -8.740 1.00 0.00 C ATOM 1316 CG MET A 83 -7.629 -5.007 -8.542 1.00 0.00 C ATOM 1317 SD MET A 83 -7.511 -5.596 -6.827 1.00 0.00 S ATOM 1318 CE MET A 83 -9.137 -5.126 -6.177 1.00 0.00 C ATOM 0 H MET A 83 -7.500 -1.095 -9.280 1.00 0.00 H new ATOM 0 HA MET A 83 -6.602 -3.116 -10.660 1.00 0.00 H new ATOM 0 HB2 MET A 83 -6.980 -3.001 -8.126 1.00 0.00 H new ATOM 0 HB3 MET A 83 -8.709 -3.157 -8.365 1.00 0.00 H new ATOM 0 HG2 MET A 83 -8.498 -5.475 -9.004 1.00 0.00 H new ATOM 0 HG3 MET A 83 -6.752 -5.359 -9.085 1.00 0.00 H new ATOM 0 HE1 MET A 83 -9.211 -5.425 -5.131 1.00 0.00 H new ATOM 0 HE2 MET A 83 -9.262 -4.046 -6.256 1.00 0.00 H new ATOM 0 HE3 MET A 83 -9.917 -5.624 -6.753 1.00 0.00 H new ATOM 1328 N ASP A 84 -8.112 -4.924 -11.672 1.00 0.00 N ATOM 1329 CA ASP A 84 -8.918 -5.743 -12.607 1.00 0.00 C ATOM 1330 C ASP A 84 -10.304 -6.227 -12.104 1.00 0.00 C ATOM 1331 O ASP A 84 -11.185 -6.494 -12.924 1.00 0.00 O ATOM 1332 CB ASP A 84 -8.100 -6.937 -13.118 1.00 0.00 C ATOM 1333 CG ASP A 84 -6.908 -6.498 -13.981 1.00 0.00 C ATOM 1334 OD1 ASP A 84 -7.116 -6.171 -15.175 1.00 0.00 O ATOM 1335 OD2 ASP A 84 -5.762 -6.496 -13.475 1.00 0.00 O ATOM 0 H ASP A 84 -7.166 -5.279 -11.535 1.00 0.00 H new ATOM 0 HA ASP A 84 -9.156 -5.048 -13.412 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -7.738 -7.517 -12.269 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -8.745 -7.594 -13.701 1.00 0.00 H new ATOM 1340 N ASP A 85 -10.522 -6.314 -10.785 1.00 0.00 N ATOM 1341 CA ASP A 85 -11.816 -6.643 -10.155 1.00 0.00 C ATOM 1342 C ASP A 85 -12.255 -5.586 -9.106 1.00 0.00 C ATOM 1343 O ASP A 85 -13.072 -5.866 -8.226 1.00 0.00 O ATOM 1344 CB ASP A 85 -11.766 -8.075 -9.597 1.00 0.00 C ATOM 1345 CG ASP A 85 -13.159 -8.641 -9.263 1.00 0.00 C ATOM 1346 OD1 ASP A 85 -14.074 -8.567 -10.121 1.00 0.00 O ATOM 1347 OD2 ASP A 85 -13.336 -9.215 -8.159 1.00 0.00 O ATOM 0 H ASP A 85 -9.782 -6.153 -10.102 1.00 0.00 H new ATOM 0 HA ASP A 85 -12.595 -6.609 -10.916 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -11.281 -8.726 -10.325 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -11.150 -8.087 -8.698 1.00 0.00 H new ATOM 1352 N GLY A 86 -11.687 -4.372 -9.166 1.00 0.00 N ATOM 1353 CA GLY A 86 -11.925 -3.271 -8.223 1.00 0.00 C ATOM 1354 C GLY A 86 -12.005 -1.865 -8.848 1.00 0.00 C ATOM 1355 O GLY A 86 -11.565 -1.606 -9.964 1.00 0.00 O ATOM 0 H GLY A 86 -11.025 -4.122 -9.900 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.856 -3.466 -7.692 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.128 -3.274 -7.480 1.00 0.00 H new ATOM 1359 N GLN A 87 -12.573 -0.934 -8.082 1.00 0.00 N ATOM 1360 CA GLN A 87 -12.699 0.500 -8.403 1.00 0.00 C ATOM 1361 C GLN A 87 -12.461 1.310 -7.119 1.00 0.00 C ATOM 1362 O GLN A 87 -13.264 2.166 -6.745 1.00 0.00 O ATOM 1363 CB GLN A 87 -14.078 0.745 -9.054 1.00 0.00 C ATOM 1364 CG GLN A 87 -15.267 0.197 -8.242 1.00 0.00 C ATOM 1365 CD GLN A 87 -16.587 0.622 -8.875 1.00 0.00 C ATOM 1366 OE1 GLN A 87 -17.326 1.452 -8.356 1.00 0.00 O ATOM 1367 NE2 GLN A 87 -16.925 0.096 -10.034 1.00 0.00 N ATOM 0 H GLN A 87 -12.980 -1.164 -7.175 1.00 0.00 H new ATOM 0 HA GLN A 87 -11.952 0.828 -9.126 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -14.214 1.817 -9.198 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -14.087 0.287 -10.043 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -15.213 -0.891 -8.196 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -15.214 0.563 -7.217 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -16.319 -0.595 -10.476 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -17.792 0.380 -10.489 1.00 0.00 H new ATOM 1376 N THR A 88 -11.351 1.029 -6.418 1.00 0.00 N ATOM 1377 CA THR A 88 -11.076 1.606 -5.087 1.00 0.00 C ATOM 1378 C THR A 88 -10.603 3.035 -4.898 1.00 0.00 C ATOM 1379 O THR A 88 -10.233 3.403 -3.789 1.00 0.00 O ATOM 1380 CB THR A 88 -10.499 0.590 -4.094 1.00 0.00 C ATOM 1381 OG1 THR A 88 -9.140 0.379 -4.370 1.00 0.00 O ATOM 1382 CG2 THR A 88 -11.212 -0.762 -4.164 1.00 0.00 C ATOM 0 H THR A 88 -10.621 0.400 -6.753 1.00 0.00 H new ATOM 0 HA THR A 88 -12.108 1.835 -4.821 1.00 0.00 H new ATOM 0 HB THR A 88 -10.641 1.006 -3.097 1.00 0.00 H new ATOM 0 HG1 THR A 88 -8.646 1.216 -4.241 1.00 0.00 H new ATOM 0 HG21 THR A 88 -10.766 -1.446 -3.442 1.00 0.00 H new ATOM 0 HG22 THR A 88 -12.269 -0.628 -3.933 1.00 0.00 H new ATOM 0 HG23 THR A 88 -11.109 -1.176 -5.167 1.00 0.00 H new ATOM 1390 N ARG A 89 -10.666 3.810 -5.978 1.00 0.00 N ATOM 1391 CA ARG A 89 -10.427 5.275 -6.139 1.00 0.00 C ATOM 1392 C ARG A 89 -10.905 6.286 -5.043 1.00 0.00 C ATOM 1393 O ARG A 89 -11.500 7.323 -5.342 1.00 0.00 O ATOM 1394 CB ARG A 89 -11.025 5.683 -7.515 1.00 0.00 C ATOM 1395 CG ARG A 89 -12.560 5.530 -7.604 1.00 0.00 C ATOM 1396 CD ARG A 89 -13.166 6.503 -8.626 1.00 0.00 C ATOM 1397 NE ARG A 89 -14.601 6.746 -8.358 1.00 0.00 N ATOM 1398 CZ ARG A 89 -15.206 7.923 -8.336 1.00 0.00 C ATOM 1399 NH1 ARG A 89 -14.647 8.999 -8.813 1.00 0.00 N ATOM 1400 NH2 ARG A 89 -16.393 8.050 -7.821 1.00 0.00 N ATOM 0 H ARG A 89 -10.913 3.395 -6.876 1.00 0.00 H new ATOM 0 HA ARG A 89 -9.345 5.368 -6.041 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -10.761 6.720 -7.721 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -10.564 5.076 -8.294 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.809 4.506 -7.883 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -13.002 5.709 -6.624 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -12.624 7.448 -8.596 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -13.046 6.098 -9.631 1.00 0.00 H new ATOM 0 HE ARG A 89 -15.180 5.927 -8.172 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.713 8.951 -9.220 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -15.143 9.889 -8.779 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -16.868 7.237 -7.428 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -16.849 8.962 -7.810 1.00 0.00 H new ATOM 1414 N PHE A 90 -10.603 6.037 -3.774 1.00 0.00 N ATOM 1415 CA PHE A 90 -10.846 6.881 -2.603 1.00 0.00 C ATOM 1416 C PHE A 90 -9.606 6.872 -1.682 1.00 0.00 C ATOM 1417 O PHE A 90 -8.717 6.030 -1.829 1.00 0.00 O ATOM 1418 CB PHE A 90 -12.118 6.397 -1.887 1.00 0.00 C ATOM 1419 CG PHE A 90 -12.650 7.378 -0.859 1.00 0.00 C ATOM 1420 CD1 PHE A 90 -13.308 8.548 -1.285 1.00 0.00 C ATOM 1421 CD2 PHE A 90 -12.469 7.141 0.517 1.00 0.00 C ATOM 1422 CE1 PHE A 90 -13.771 9.484 -0.340 1.00 0.00 C ATOM 1423 CE2 PHE A 90 -12.926 8.080 1.461 1.00 0.00 C ATOM 1424 CZ PHE A 90 -13.574 9.251 1.033 1.00 0.00 C ATOM 0 H PHE A 90 -10.142 5.165 -3.512 1.00 0.00 H new ATOM 0 HA PHE A 90 -11.009 7.916 -2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -12.893 6.207 -2.630 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -11.908 5.447 -1.395 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -13.458 8.728 -2.339 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -11.979 6.238 0.849 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -14.277 10.380 -0.669 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -12.778 7.900 2.516 1.00 0.00 H new ATOM 0 HZ PHE A 90 -13.921 9.972 1.758 1.00 0.00 H new ATOM 1434 N THR A 91 -9.522 7.812 -0.729 1.00 0.00 N ATOM 1435 CA THR A 91 -8.426 7.878 0.257 1.00 0.00 C ATOM 1436 C THR A 91 -8.344 6.558 1.051 1.00 0.00 C ATOM 1437 O THR A 91 -9.380 5.979 1.388 1.00 0.00 O ATOM 1438 CB THR A 91 -8.653 9.034 1.246 1.00 0.00 C ATOM 1439 OG1 THR A 91 -8.966 10.229 0.567 1.00 0.00 O ATOM 1440 CG2 THR A 91 -7.427 9.341 2.107 1.00 0.00 C ATOM 0 H THR A 91 -10.214 8.553 -0.618 1.00 0.00 H new ATOM 0 HA THR A 91 -7.496 8.043 -0.287 1.00 0.00 H new ATOM 0 HB THR A 91 -9.474 8.699 1.880 1.00 0.00 H new ATOM 0 HG1 THR A 91 -9.107 10.948 1.218 1.00 0.00 H new ATOM 0 HG21 THR A 91 -7.654 10.166 2.782 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.161 8.458 2.689 1.00 0.00 H new ATOM 0 HG23 THR A 91 -6.591 9.618 1.464 1.00 0.00 H new ATOM 1448 N ASP A 92 -7.128 6.085 1.362 1.00 0.00 N ATOM 1449 CA ASP A 92 -6.937 4.777 2.017 1.00 0.00 C ATOM 1450 C ASP A 92 -6.039 4.763 3.270 1.00 0.00 C ATOM 1451 O ASP A 92 -6.324 4.018 4.202 1.00 0.00 O ATOM 1452 CB ASP A 92 -6.410 3.798 0.963 1.00 0.00 C ATOM 1453 CG ASP A 92 -6.325 2.366 1.517 1.00 0.00 C ATOM 1454 OD1 ASP A 92 -7.387 1.705 1.642 1.00 0.00 O ATOM 1455 OD2 ASP A 92 -5.196 1.901 1.796 1.00 0.00 O ATOM 0 H ASP A 92 -6.261 6.587 1.172 1.00 0.00 H new ATOM 0 HA ASP A 92 -7.912 4.485 2.407 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.064 3.814 0.091 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.424 4.119 0.628 1.00 0.00 H new ATOM 1460 N LEU A 93 -4.993 5.601 3.362 1.00 0.00 N ATOM 1461 CA LEU A 93 -4.027 5.554 4.475 1.00 0.00 C ATOM 1462 C LEU A 93 -4.630 5.827 5.868 1.00 0.00 C ATOM 1463 O LEU A 93 -4.175 5.238 6.850 1.00 0.00 O ATOM 1464 CB LEU A 93 -2.872 6.519 4.136 1.00 0.00 C ATOM 1465 CG LEU A 93 -1.686 6.517 5.123 1.00 0.00 C ATOM 1466 CD1 LEU A 93 -0.988 5.158 5.210 1.00 0.00 C ATOM 1467 CD2 LEU A 93 -0.652 7.548 4.668 1.00 0.00 C ATOM 0 H LEU A 93 -4.793 6.326 2.673 1.00 0.00 H new ATOM 0 HA LEU A 93 -3.662 4.531 4.563 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.495 6.271 3.144 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.273 7.531 4.081 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.092 6.755 6.106 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.162 5.218 5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.700 4.404 5.545 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.603 4.883 4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.189 7.551 5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.297 7.292 3.670 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.109 8.537 4.648 1.00 0.00 H new ATOM 1479 N LEU A 94 -5.667 6.667 5.967 1.00 0.00 N ATOM 1480 CA LEU A 94 -6.363 6.928 7.240 1.00 0.00 C ATOM 1481 C LEU A 94 -7.359 5.807 7.591 1.00 0.00 C ATOM 1482 O LEU A 94 -7.530 5.460 8.761 1.00 0.00 O ATOM 1483 CB LEU A 94 -7.066 8.299 7.179 1.00 0.00 C ATOM 1484 CG LEU A 94 -6.146 9.506 6.912 1.00 0.00 C ATOM 1485 CD1 LEU A 94 -6.980 10.785 6.864 1.00 0.00 C ATOM 1486 CD2 LEU A 94 -5.070 9.676 7.987 1.00 0.00 C ATOM 0 H LEU A 94 -6.048 7.184 5.174 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.619 6.947 8.037 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.825 8.264 6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.586 8.463 8.123 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.650 9.320 5.960 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.328 11.638 6.675 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.718 10.708 6.065 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -7.490 10.923 7.817 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.451 10.541 7.749 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.545 9.826 8.957 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.447 8.782 8.023 1.00 0.00 H new ATOM 1498 N GLN A 95 -7.987 5.208 6.578 1.00 0.00 N ATOM 1499 CA GLN A 95 -8.979 4.157 6.653 1.00 0.00 C ATOM 1500 C GLN A 95 -8.345 2.791 6.982 1.00 0.00 C ATOM 1501 O GLN A 95 -8.921 2.012 7.742 1.00 0.00 O ATOM 1502 CB GLN A 95 -9.666 4.150 5.279 1.00 0.00 C ATOM 1503 CG GLN A 95 -10.579 5.360 4.987 1.00 0.00 C ATOM 1504 CD GLN A 95 -9.864 6.677 4.649 1.00 0.00 C ATOM 1505 OE1 GLN A 95 -8.679 6.742 4.340 1.00 0.00 O ATOM 1506 NE2 GLN A 95 -10.558 7.793 4.717 1.00 0.00 N ATOM 0 H GLN A 95 -7.793 5.473 5.612 1.00 0.00 H new ATOM 0 HA GLN A 95 -9.692 4.338 7.457 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -8.897 4.103 4.508 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.260 3.240 5.194 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -11.236 5.102 4.156 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -11.215 5.528 5.856 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -11.545 7.765 4.972 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -10.109 8.686 4.515 1.00 0.00 H new ATOM 1515 N LEU A 96 -7.134 2.534 6.471 1.00 0.00 N ATOM 1516 CA LEU A 96 -6.317 1.336 6.705 1.00 0.00 C ATOM 1517 C LEU A 96 -6.093 1.065 8.196 1.00 0.00 C ATOM 1518 O LEU A 96 -6.162 -0.090 8.615 1.00 0.00 O ATOM 1519 CB LEU A 96 -4.994 1.538 5.939 1.00 0.00 C ATOM 1520 CG LEU A 96 -3.941 0.412 6.043 1.00 0.00 C ATOM 1521 CD1 LEU A 96 -2.988 0.529 4.855 1.00 0.00 C ATOM 1522 CD2 LEU A 96 -3.060 0.490 7.297 1.00 0.00 C ATOM 0 H LEU A 96 -6.671 3.195 5.847 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.833 0.449 6.339 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.232 1.682 4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.537 2.462 6.292 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.504 -0.521 6.073 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.237 -0.259 4.912 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -3.550 0.428 3.926 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.496 1.501 4.878 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.348 -0.336 7.294 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.518 1.436 7.303 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.687 0.425 8.187 1.00 0.00 H new ATOM 1534 N VAL A 97 -5.860 2.112 8.997 1.00 0.00 N ATOM 1535 CA VAL A 97 -5.646 2.002 10.457 1.00 0.00 C ATOM 1536 C VAL A 97 -6.753 1.154 11.100 1.00 0.00 C ATOM 1537 O VAL A 97 -6.459 0.217 11.842 1.00 0.00 O ATOM 1538 CB VAL A 97 -5.559 3.396 11.116 1.00 0.00 C ATOM 1539 CG1 VAL A 97 -5.286 3.298 12.621 1.00 0.00 C ATOM 1540 CG2 VAL A 97 -4.434 4.242 10.498 1.00 0.00 C ATOM 0 H VAL A 97 -5.813 3.071 8.653 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.692 1.501 10.623 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.526 3.868 10.942 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.232 4.300 13.047 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.091 2.742 13.101 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.340 2.782 12.786 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.402 5.216 10.986 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.479 3.735 10.637 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.622 4.375 9.433 1.00 0.00 H new ATOM 1550 N GLU A 98 -8.017 1.470 10.807 1.00 0.00 N ATOM 1551 CA GLU A 98 -9.193 0.702 11.222 1.00 0.00 C ATOM 1552 C GLU A 98 -9.485 -0.487 10.298 1.00 0.00 C ATOM 1553 O GLU A 98 -8.946 -1.563 10.518 1.00 0.00 O ATOM 1554 CB GLU A 98 -10.387 1.653 11.445 1.00 0.00 C ATOM 1555 CG GLU A 98 -11.632 0.981 12.044 1.00 0.00 C ATOM 1556 CD GLU A 98 -11.394 0.523 13.496 1.00 0.00 C ATOM 1557 OE1 GLU A 98 -10.914 -0.618 13.704 1.00 0.00 O ATOM 1558 OE2 GLU A 98 -11.681 1.301 14.437 1.00 0.00 O ATOM 0 H GLU A 98 -8.257 2.294 10.256 1.00 0.00 H new ATOM 0 HA GLU A 98 -8.984 0.229 12.181 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.073 2.462 12.105 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -10.657 2.106 10.491 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -12.470 1.678 12.016 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.911 0.122 11.433 1.00 0.00 H new ATOM 1565 N PHE A 99 -10.259 -0.263 9.231 1.00 0.00 N ATOM 1566 CA PHE A 99 -10.821 -1.214 8.258 1.00 0.00 C ATOM 1567 C PHE A 99 -9.945 -2.304 7.599 1.00 0.00 C ATOM 1568 O PHE A 99 -10.491 -3.092 6.822 1.00 0.00 O ATOM 1569 CB PHE A 99 -11.576 -0.401 7.190 1.00 0.00 C ATOM 1570 CG PHE A 99 -12.585 0.581 7.766 1.00 0.00 C ATOM 1571 CD1 PHE A 99 -13.736 0.103 8.420 1.00 0.00 C ATOM 1572 CD2 PHE A 99 -12.356 1.970 7.690 1.00 0.00 C ATOM 1573 CE1 PHE A 99 -14.648 1.005 8.999 1.00 0.00 C ATOM 1574 CE2 PHE A 99 -13.267 2.871 8.267 1.00 0.00 C ATOM 1575 CZ PHE A 99 -14.413 2.390 8.925 1.00 0.00 C ATOM 0 H PHE A 99 -10.539 0.691 9.001 1.00 0.00 H new ATOM 0 HA PHE A 99 -11.445 -1.853 8.883 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.853 0.147 6.586 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -12.093 -1.089 6.521 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.920 -0.960 8.478 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.477 2.343 7.186 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -15.529 0.633 9.501 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -13.087 3.934 8.205 1.00 0.00 H new ATOM 0 HZ PHE A 99 -15.111 3.082 9.372 1.00 0.00 H new ATOM 1585 N HIS A 100 -8.644 -2.435 7.886 1.00 0.00 N ATOM 1586 CA HIS A 100 -7.791 -3.500 7.309 1.00 0.00 C ATOM 1587 C HIS A 100 -8.327 -4.920 7.568 1.00 0.00 C ATOM 1588 O HIS A 100 -8.272 -5.771 6.680 1.00 0.00 O ATOM 1589 CB HIS A 100 -6.334 -3.358 7.800 1.00 0.00 C ATOM 1590 CG HIS A 100 -6.136 -3.464 9.297 1.00 0.00 C ATOM 1591 ND1 HIS A 100 -6.021 -2.399 10.168 1.00 0.00 N ATOM 1592 CD2 HIS A 100 -6.005 -4.611 10.034 1.00 0.00 C ATOM 1593 CE1 HIS A 100 -5.843 -2.883 11.415 1.00 0.00 C ATOM 1594 NE2 HIS A 100 -5.828 -4.231 11.354 1.00 0.00 N ATOM 0 H HIS A 100 -8.147 -1.811 8.522 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.815 -3.362 6.228 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -5.730 -4.126 7.316 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -5.950 -2.394 7.468 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -6.063 -1.413 9.912 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -6.034 -5.622 9.656 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -5.731 -2.291 12.311 1.00 0.00 H new ATOM 1603 N GLN A 101 -8.905 -5.166 8.748 1.00 0.00 N ATOM 1604 CA GLN A 101 -9.368 -6.493 9.191 1.00 0.00 C ATOM 1605 C GLN A 101 -10.635 -7.018 8.485 1.00 0.00 C ATOM 1606 O GLN A 101 -10.894 -8.220 8.544 1.00 0.00 O ATOM 1607 CB GLN A 101 -9.452 -6.555 10.736 1.00 0.00 C ATOM 1608 CG GLN A 101 -10.602 -5.787 11.418 1.00 0.00 C ATOM 1609 CD GLN A 101 -10.481 -4.272 11.278 1.00 0.00 C ATOM 1610 OE1 GLN A 101 -10.907 -3.706 10.286 1.00 0.00 O ATOM 1611 NE2 GLN A 101 -9.853 -3.572 12.200 1.00 0.00 N ATOM 0 H GLN A 101 -9.069 -4.435 9.440 1.00 0.00 H new ATOM 0 HA GLN A 101 -8.605 -7.200 8.866 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -9.528 -7.603 11.027 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.511 -6.180 11.139 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -11.550 -6.110 10.989 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -10.626 -6.047 12.476 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -9.492 -4.035 13.034 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -9.727 -2.567 12.080 1.00 0.00 H new ATOM 1620 N LEU A 102 -11.401 -6.163 7.789 1.00 0.00 N ATOM 1621 CA LEU A 102 -12.577 -6.540 6.976 1.00 0.00 C ATOM 1622 C LEU A 102 -12.666 -5.740 5.652 1.00 0.00 C ATOM 1623 O LEU A 102 -13.738 -5.307 5.224 1.00 0.00 O ATOM 1624 CB LEU A 102 -13.865 -6.571 7.837 1.00 0.00 C ATOM 1625 CG LEU A 102 -14.593 -5.252 8.185 1.00 0.00 C ATOM 1626 CD1 LEU A 102 -15.764 -5.561 9.121 1.00 0.00 C ATOM 1627 CD2 LEU A 102 -13.711 -4.218 8.876 1.00 0.00 C ATOM 0 H LEU A 102 -11.217 -5.160 7.773 1.00 0.00 H new ATOM 0 HA LEU A 102 -12.450 -7.567 6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -14.582 -7.212 7.325 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -13.615 -7.061 8.778 1.00 0.00 H new ATOM 0 HG LEU A 102 -14.915 -4.826 7.235 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.283 -4.636 9.372 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -16.456 -6.243 8.626 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -15.388 -6.025 10.033 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.296 -3.323 9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.331 -4.630 9.811 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.875 -3.961 8.226 1.00 0.00 H new ATOM 1639 N ASN A 103 -11.509 -5.525 5.018 1.00 0.00 N ATOM 1640 CA ASN A 103 -11.341 -4.704 3.811 1.00 0.00 C ATOM 1641 C ASN A 103 -11.844 -5.400 2.514 1.00 0.00 C ATOM 1642 O ASN A 103 -12.625 -6.353 2.545 1.00 0.00 O ATOM 1643 CB ASN A 103 -9.843 -4.313 3.749 1.00 0.00 C ATOM 1644 CG ASN A 103 -9.556 -3.028 2.984 1.00 0.00 C ATOM 1645 OD1 ASN A 103 -10.444 -2.341 2.501 1.00 0.00 O ATOM 1646 ND2 ASN A 103 -8.303 -2.680 2.814 1.00 0.00 N ATOM 0 H ASN A 103 -10.631 -5.932 5.341 1.00 0.00 H new ATOM 0 HA ASN A 103 -11.966 -3.813 3.873 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -9.466 -4.207 4.766 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.287 -5.128 3.286 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.075 -1.841 2.281 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.557 -3.249 3.214 1.00 0.00 H new ATOM 1653 N ARG A 104 -11.399 -4.905 1.346 1.00 0.00 N ATOM 1654 CA ARG A 104 -11.657 -5.478 0.007 1.00 0.00 C ATOM 1655 C ARG A 104 -10.584 -6.490 -0.453 1.00 0.00 C ATOM 1656 O ARG A 104 -10.698 -7.042 -1.548 1.00 0.00 O ATOM 1657 CB ARG A 104 -11.828 -4.339 -1.021 1.00 0.00 C ATOM 1658 CG ARG A 104 -12.882 -3.276 -0.660 1.00 0.00 C ATOM 1659 CD ARG A 104 -14.274 -3.870 -0.398 1.00 0.00 C ATOM 1660 NE ARG A 104 -15.269 -2.811 -0.136 1.00 0.00 N ATOM 1661 CZ ARG A 104 -16.554 -2.986 0.131 1.00 0.00 C ATOM 1662 NH1 ARG A 104 -17.095 -4.170 0.190 1.00 0.00 N ATOM 1663 NH2 ARG A 104 -17.328 -1.960 0.350 1.00 0.00 N ATOM 0 H ARG A 104 -10.827 -4.062 1.304 1.00 0.00 H new ATOM 0 HA ARG A 104 -12.581 -6.051 0.078 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -10.866 -3.843 -1.151 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -12.094 -4.778 -1.983 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -12.553 -2.733 0.226 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.950 -2.551 -1.471 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -14.587 -4.461 -1.258 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -14.228 -4.548 0.455 1.00 0.00 H new ATOM 0 HE ARG A 104 -14.933 -1.848 -0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -16.525 -5.000 0.028 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -18.089 -4.267 0.398 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -16.945 -1.015 0.316 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -18.317 -2.102 0.555 1.00 0.00 H new ATOM 1677 N GLY A 105 -9.558 -6.736 0.370 1.00 0.00 N ATOM 1678 CA GLY A 105 -8.440 -7.657 0.104 1.00 0.00 C ATOM 1679 C GLY A 105 -7.681 -7.402 -1.200 1.00 0.00 C ATOM 1680 O GLY A 105 -7.597 -6.274 -1.693 1.00 0.00 O ATOM 0 H GLY A 105 -9.478 -6.281 1.279 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.735 -7.596 0.933 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.826 -8.676 0.087 1.00 0.00 H new ATOM 1684 N ILE A 106 -7.107 -8.482 -1.732 1.00 0.00 N ATOM 1685 CA ILE A 106 -6.413 -8.519 -3.038 1.00 0.00 C ATOM 1686 C ILE A 106 -7.319 -9.105 -4.152 1.00 0.00 C ATOM 1687 O ILE A 106 -8.426 -9.565 -3.865 1.00 0.00 O ATOM 1688 CB ILE A 106 -5.041 -9.229 -2.907 1.00 0.00 C ATOM 1689 CG1 ILE A 106 -5.074 -10.761 -3.038 1.00 0.00 C ATOM 1690 CG2 ILE A 106 -4.287 -8.828 -1.622 1.00 0.00 C ATOM 1691 CD1 ILE A 106 -6.044 -11.516 -2.122 1.00 0.00 C ATOM 0 H ILE A 106 -7.107 -9.386 -1.259 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.201 -7.497 -3.352 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.494 -8.864 -3.776 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.321 -11.008 -4.071 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -4.069 -11.139 -2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.333 -9.354 -1.581 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.109 -7.753 -1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.886 -9.094 -0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.968 -12.586 -2.315 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.791 -11.316 -1.081 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.063 -11.183 -2.318 1.00 0.00 H new ATOM 1703 N LEU A 107 -6.856 -9.112 -5.417 1.00 0.00 N ATOM 1704 CA LEU A 107 -7.605 -9.627 -6.580 1.00 0.00 C ATOM 1705 C LEU A 107 -8.393 -10.956 -6.357 1.00 0.00 C ATOM 1706 O LEU A 107 -9.614 -10.909 -6.541 1.00 0.00 O ATOM 1707 CB LEU A 107 -6.662 -9.686 -7.810 1.00 0.00 C ATOM 1708 CG LEU A 107 -7.085 -8.788 -8.980 1.00 0.00 C ATOM 1709 CD1 LEU A 107 -5.936 -8.693 -9.984 1.00 0.00 C ATOM 1710 CD2 LEU A 107 -8.324 -9.343 -9.682 1.00 0.00 C ATOM 0 H LEU A 107 -5.934 -8.753 -5.664 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.410 -8.915 -6.762 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.658 -9.403 -7.496 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -6.607 -10.717 -8.161 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.326 -7.801 -8.586 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.233 -8.056 -10.817 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.060 -8.267 -9.495 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -5.695 -9.689 -10.357 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -8.600 -8.686 -10.507 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -8.108 -10.339 -10.069 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -9.149 -9.401 -8.972 1.00 0.00 H new ATOM 1722 N PRO A 108 -7.785 -12.116 -5.985 1.00 0.00 N ATOM 1723 CA PRO A 108 -8.491 -13.407 -6.064 1.00 0.00 C ATOM 1724 C PRO A 108 -8.874 -14.072 -4.722 1.00 0.00 C ATOM 1725 O PRO A 108 -10.009 -14.531 -4.575 1.00 0.00 O ATOM 1726 CB PRO A 108 -7.559 -14.328 -6.874 1.00 0.00 C ATOM 1727 CG PRO A 108 -6.265 -13.533 -7.086 1.00 0.00 C ATOM 1728 CD PRO A 108 -6.363 -12.420 -6.049 1.00 0.00 C ATOM 0 HA PRO A 108 -9.463 -13.230 -6.524 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -7.364 -15.256 -6.337 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -8.011 -14.600 -7.828 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.382 -14.153 -6.929 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -6.199 -13.135 -8.098 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.981 -12.743 -5.081 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -5.782 -11.547 -6.346 1.00 0.00 H new ATOM 1736 N CYS A 109 -7.954 -14.136 -3.747 1.00 0.00 N ATOM 1737 CA CYS A 109 -8.092 -14.837 -2.478 1.00 0.00 C ATOM 1738 C CYS A 109 -8.583 -13.985 -1.276 1.00 0.00 C ATOM 1739 O CYS A 109 -9.640 -13.355 -1.360 1.00 0.00 O ATOM 1740 CB CYS A 109 -6.740 -15.548 -2.297 1.00 0.00 C ATOM 1741 SG CYS A 109 -6.482 -16.772 -3.624 1.00 0.00 S ATOM 0 H CYS A 109 -7.049 -13.673 -3.835 1.00 0.00 H new ATOM 0 HA CYS A 109 -8.917 -15.549 -2.503 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -5.933 -14.816 -2.307 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -6.709 -16.043 -1.326 1.00 0.00 H new ATOM 0 HG CYS A 109 -6.137 -17.912 -3.102 1.00 0.00 H new ATOM 1747 N LEU A 110 -7.862 -14.006 -0.141 1.00 0.00 N ATOM 1748 CA LEU A 110 -8.219 -13.370 1.140 1.00 0.00 C ATOM 1749 C LEU A 110 -8.680 -11.902 1.035 1.00 0.00 C ATOM 1750 O LEU A 110 -8.038 -11.062 0.400 1.00 0.00 O ATOM 1751 CB LEU A 110 -7.033 -13.490 2.131 1.00 0.00 C ATOM 1752 CG LEU A 110 -6.951 -14.766 2.996 1.00 0.00 C ATOM 1753 CD1 LEU A 110 -8.074 -14.812 4.034 1.00 0.00 C ATOM 1754 CD2 LEU A 110 -6.984 -16.060 2.184 1.00 0.00 C ATOM 0 H LEU A 110 -6.967 -14.493 -0.090 1.00 0.00 H new ATOM 0 HA LEU A 110 -9.090 -13.914 1.506 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -6.108 -13.412 1.559 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -7.067 -12.631 2.801 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.982 -14.706 3.491 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -7.986 -15.723 4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -7.999 -13.945 4.690 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.039 -14.800 3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -6.923 -16.914 2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -7.914 -16.111 1.618 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -6.139 -16.079 1.496 1.00 0.00 H new ATOM 1766 N LEU A 111 -9.770 -11.594 1.747 1.00 0.00 N ATOM 1767 CA LEU A 111 -10.426 -10.278 1.755 1.00 0.00 C ATOM 1768 C LEU A 111 -9.877 -9.278 2.791 1.00 0.00 C ATOM 1769 O LEU A 111 -10.249 -8.107 2.764 1.00 0.00 O ATOM 1770 CB LEU A 111 -11.960 -10.450 1.793 1.00 0.00 C ATOM 1771 CG LEU A 111 -12.673 -10.839 3.108 1.00 0.00 C ATOM 1772 CD1 LEU A 111 -12.084 -12.084 3.780 1.00 0.00 C ATOM 1773 CD2 LEU A 111 -12.725 -9.707 4.135 1.00 0.00 C ATOM 0 H LEU A 111 -10.235 -12.272 2.351 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.166 -9.792 0.815 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -12.398 -9.511 1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -12.218 -11.206 1.051 1.00 0.00 H new ATOM 0 HG LEU A 111 -13.689 -11.064 2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -12.634 -12.297 4.697 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.163 -12.935 3.103 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.035 -11.907 4.019 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -13.239 -10.053 5.032 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.711 -9.403 4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -13.262 -8.857 3.713 1.00 0.00 H new ATOM 1785 N ARG A 112 -8.998 -9.706 3.706 1.00 0.00 N ATOM 1786 CA ARG A 112 -8.464 -8.857 4.791 1.00 0.00 C ATOM 1787 C ARG A 112 -6.952 -8.646 4.698 1.00 0.00 C ATOM 1788 O ARG A 112 -6.216 -9.526 4.251 1.00 0.00 O ATOM 1789 CB ARG A 112 -8.935 -9.384 6.161 1.00 0.00 C ATOM 1790 CG ARG A 112 -8.272 -10.694 6.614 1.00 0.00 C ATOM 1791 CD ARG A 112 -8.967 -11.275 7.854 1.00 0.00 C ATOM 1792 NE ARG A 112 -10.112 -12.141 7.489 1.00 0.00 N ATOM 1793 CZ ARG A 112 -11.404 -11.937 7.686 1.00 0.00 C ATOM 1794 NH1 ARG A 112 -11.893 -10.816 8.138 1.00 0.00 N ATOM 1795 NH2 ARG A 112 -12.255 -12.886 7.422 1.00 0.00 N ATOM 0 H ARG A 112 -8.631 -10.658 3.719 1.00 0.00 H new ATOM 0 HA ARG A 112 -8.878 -7.856 4.671 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -8.744 -8.619 6.913 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.014 -9.534 6.125 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -8.306 -11.420 5.802 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -7.220 -10.513 6.836 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -8.248 -11.850 8.437 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -9.315 -10.461 8.490 1.00 0.00 H new ATOM 0 HE ARG A 112 -9.871 -13.015 7.021 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.269 -10.040 8.359 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -12.899 -10.715 8.270 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -11.925 -13.782 7.065 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.252 -12.733 7.572 1.00 0.00 H new ATOM 1809 N HIS A 113 -6.507 -7.481 5.154 1.00 0.00 N ATOM 1810 CA HIS A 113 -5.107 -7.050 5.236 1.00 0.00 C ATOM 1811 C HIS A 113 -4.678 -6.894 6.700 1.00 0.00 C ATOM 1812 O HIS A 113 -5.507 -6.839 7.609 1.00 0.00 O ATOM 1813 CB HIS A 113 -4.923 -5.745 4.455 1.00 0.00 C ATOM 1814 CG HIS A 113 -5.473 -5.740 3.051 1.00 0.00 C ATOM 1815 ND1 HIS A 113 -6.673 -5.137 2.669 1.00 0.00 N ATOM 1816 CD2 HIS A 113 -4.804 -6.131 1.927 1.00 0.00 C ATOM 1817 CE1 HIS A 113 -6.685 -5.156 1.326 1.00 0.00 C ATOM 1818 NE2 HIS A 113 -5.581 -5.757 0.854 1.00 0.00 N ATOM 0 H HIS A 113 -7.148 -6.766 5.498 1.00 0.00 H new ATOM 0 HA HIS A 113 -4.468 -7.811 4.788 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -5.397 -4.939 5.014 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -3.858 -5.518 4.409 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -3.850 -6.636 1.887 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -7.473 -4.745 0.712 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.357 -5.910 -0.129 1.00 0.00 H new ATOM 1826 N CYS A 114 -3.369 -6.810 6.922 1.00 0.00 N ATOM 1827 CA CYS A 114 -2.726 -6.779 8.233 1.00 0.00 C ATOM 1828 C CYS A 114 -1.596 -5.722 8.302 1.00 0.00 C ATOM 1829 O CYS A 114 -1.416 -4.927 7.377 1.00 0.00 O ATOM 1830 CB CYS A 114 -2.184 -8.199 8.501 1.00 0.00 C ATOM 1831 SG CYS A 114 -3.314 -9.556 8.040 1.00 0.00 S ATOM 0 H CYS A 114 -2.696 -6.759 6.157 1.00 0.00 H new ATOM 0 HA CYS A 114 -3.447 -6.488 8.997 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -1.249 -8.324 7.955 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -1.948 -8.287 9.561 1.00 0.00 H new ATOM 0 HG CYS A 114 -2.753 -10.698 8.308 1.00 0.00 H new ATOM 1837 N CYS A 115 -0.805 -5.735 9.384 1.00 0.00 N ATOM 1838 CA CYS A 115 0.378 -4.873 9.558 1.00 0.00 C ATOM 1839 C CYS A 115 1.660 -5.658 9.216 1.00 0.00 C ATOM 1840 O CYS A 115 1.835 -6.795 9.665 1.00 0.00 O ATOM 1841 CB CYS A 115 0.406 -4.307 10.986 1.00 0.00 C ATOM 1842 SG CYS A 115 -1.029 -3.223 11.258 1.00 0.00 S ATOM 0 H CYS A 115 -0.970 -6.354 10.177 1.00 0.00 H new ATOM 0 HA CYS A 115 0.323 -4.028 8.871 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.397 -5.123 11.709 1.00 0.00 H new ATOM 0 HB3 CYS A 115 1.329 -3.749 11.146 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.994 -2.753 12.470 1.00 0.00 H new ATOM 1848 N THR A 116 2.573 -5.032 8.462 1.00 0.00 N ATOM 1849 CA THR A 116 3.802 -5.660 7.924 1.00 0.00 C ATOM 1850 C THR A 116 5.080 -4.894 8.294 1.00 0.00 C ATOM 1851 O THR A 116 5.021 -3.785 8.829 1.00 0.00 O ATOM 1852 CB THR A 116 3.677 -5.771 6.383 1.00 0.00 C ATOM 1853 OG1 THR A 116 2.365 -6.142 6.039 1.00 0.00 O ATOM 1854 CG2 THR A 116 4.591 -6.800 5.713 1.00 0.00 C ATOM 0 H THR A 116 2.482 -4.051 8.199 1.00 0.00 H new ATOM 0 HA THR A 116 3.892 -6.648 8.376 1.00 0.00 H new ATOM 0 HB THR A 116 3.969 -4.783 6.027 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.963 -5.443 5.483 1.00 0.00 H new ATOM 0 HG21 THR A 116 4.420 -6.793 4.637 1.00 0.00 H new ATOM 0 HG22 THR A 116 5.632 -6.549 5.917 1.00 0.00 H new ATOM 0 HG23 THR A 116 4.373 -7.792 6.108 1.00 0.00 H new ATOM 1862 N ARG A 117 6.254 -5.478 8.007 1.00 0.00 N ATOM 1863 CA ARG A 117 7.568 -4.834 8.189 1.00 0.00 C ATOM 1864 C ARG A 117 7.697 -3.601 7.277 1.00 0.00 C ATOM 1865 O ARG A 117 7.219 -3.608 6.144 1.00 0.00 O ATOM 1866 CB ARG A 117 8.682 -5.860 7.883 1.00 0.00 C ATOM 1867 CG ARG A 117 10.093 -5.385 8.287 1.00 0.00 C ATOM 1868 CD ARG A 117 11.175 -6.276 7.666 1.00 0.00 C ATOM 1869 NE ARG A 117 12.536 -5.840 8.041 1.00 0.00 N ATOM 1870 CZ ARG A 117 13.254 -4.876 7.486 1.00 0.00 C ATOM 1871 NH1 ARG A 117 12.808 -4.060 6.582 1.00 0.00 N ATOM 1872 NH2 ARG A 117 14.489 -4.662 7.819 1.00 0.00 N ATOM 0 H ARG A 117 6.320 -6.426 7.636 1.00 0.00 H new ATOM 0 HA ARG A 117 7.665 -4.496 9.221 1.00 0.00 H new ATOM 0 HB2 ARG A 117 8.459 -6.791 8.404 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.675 -6.083 6.816 1.00 0.00 H new ATOM 0 HG2 ARG A 117 10.239 -4.354 7.966 1.00 0.00 H new ATOM 0 HG3 ARG A 117 10.187 -5.397 9.373 1.00 0.00 H new ATOM 0 HD2 ARG A 117 11.024 -7.307 7.987 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.076 -6.262 6.581 1.00 0.00 H new ATOM 0 HE ARG A 117 12.972 -6.339 8.816 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.845 -4.138 6.255 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.420 -3.340 6.199 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.934 -5.245 8.528 1.00 0.00 H new ATOM 0 HH22 ARG A 117 15.015 -3.911 7.372 1.00 0.00 H new ATOM 1886 N VAL A 118 8.371 -2.561 7.770 1.00 0.00 N ATOM 1887 CA VAL A 118 8.697 -1.338 7.010 1.00 0.00 C ATOM 1888 C VAL A 118 9.744 -1.606 5.916 1.00 0.00 C ATOM 1889 O VAL A 118 10.482 -2.590 5.980 1.00 0.00 O ATOM 1890 CB VAL A 118 9.165 -0.211 7.956 1.00 0.00 C ATOM 1891 CG1 VAL A 118 8.003 0.279 8.826 1.00 0.00 C ATOM 1892 CG2 VAL A 118 10.334 -0.612 8.866 1.00 0.00 C ATOM 0 H VAL A 118 8.716 -2.538 8.730 1.00 0.00 H new ATOM 0 HA VAL A 118 7.784 -1.012 6.512 1.00 0.00 H new ATOM 0 HB VAL A 118 9.521 0.587 7.305 1.00 0.00 H new ATOM 0 HG11 VAL A 118 8.352 1.073 9.486 1.00 0.00 H new ATOM 0 HG12 VAL A 118 7.207 0.662 8.188 1.00 0.00 H new ATOM 0 HG13 VAL A 118 7.622 -0.549 9.424 1.00 0.00 H new ATOM 0 HG21 VAL A 118 10.606 0.231 9.501 1.00 0.00 H new ATOM 0 HG22 VAL A 118 10.037 -1.455 9.490 1.00 0.00 H new ATOM 0 HG23 VAL A 118 11.190 -0.897 8.254 1.00 0.00 H new ATOM 1902 N ALA A 119 9.856 -0.719 4.921 1.00 0.00 N ATOM 1903 CA ALA A 119 10.791 -0.845 3.789 1.00 0.00 C ATOM 1904 C ALA A 119 12.248 -0.415 4.115 1.00 0.00 C ATOM 1905 O ALA A 119 12.939 0.165 3.270 1.00 0.00 O ATOM 1906 CB ALA A 119 10.188 -0.110 2.584 1.00 0.00 C ATOM 0 H ALA A 119 9.288 0.127 4.876 1.00 0.00 H new ATOM 0 HA ALA A 119 10.904 -1.902 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.864 -0.190 1.733 1.00 0.00 H new ATOM 0 HB2 ALA A 119 9.228 -0.558 2.328 1.00 0.00 H new ATOM 0 HB3 ALA A 119 10.043 0.941 2.834 1.00 0.00 H new ATOM 1912 N LEU A 120 12.702 -0.664 5.352 1.00 0.00 N ATOM 1913 CA LEU A 120 14.009 -0.253 5.894 1.00 0.00 C ATOM 1914 C LEU A 120 15.117 -1.300 5.669 1.00 0.00 C ATOM 1915 O LEU A 120 14.970 -2.442 6.168 1.00 0.00 O ATOM 1916 CB LEU A 120 13.823 0.139 7.378 1.00 0.00 C ATOM 1917 CG LEU A 120 15.085 0.695 8.060 1.00 0.00 C ATOM 1918 CD1 LEU A 120 15.572 1.993 7.416 1.00 0.00 C ATOM 1919 CD2 LEU A 120 14.772 0.974 9.529 1.00 0.00 C ATOM 1920 OXT LEU A 120 16.127 -0.974 5.002 1.00 0.00 O ATOM 0 H LEU A 120 12.145 -1.180 6.033 1.00 0.00 H new ATOM 0 HA LEU A 120 14.365 0.618 5.343 1.00 0.00 H new ATOM 0 HB2 LEU A 120 13.031 0.885 7.446 1.00 0.00 H new ATOM 0 HB3 LEU A 120 13.484 -0.737 7.931 1.00 0.00 H new ATOM 0 HG LEU A 120 15.872 -0.052 7.952 1.00 0.00 H new ATOM 0 HD11 LEU A 120 16.465 2.344 7.934 1.00 0.00 H new ATOM 0 HD12 LEU A 120 15.808 1.813 6.367 1.00 0.00 H new ATOM 0 HD13 LEU A 120 14.791 2.750 7.487 1.00 0.00 H new ATOM 0 HD21 LEU A 120 15.661 1.369 10.022 1.00 0.00 H new ATOM 0 HD22 LEU A 120 13.965 1.704 9.597 1.00 0.00 H new ATOM 0 HD23 LEU A 120 14.467 0.049 10.018 1.00 0.00 H new TER 1932 LEU A 120 ATOM 1933 N PRO B1135 11.842 -5.857 -13.760 1.00 0.00 N ATOM 1934 CA PRO B1135 11.033 -7.095 -13.668 1.00 0.00 C ATOM 1935 C PRO B1135 9.678 -7.014 -14.398 1.00 0.00 C ATOM 1936 O PRO B1135 9.263 -5.936 -14.821 1.00 0.00 O ATOM 1937 CB PRO B1135 10.884 -7.361 -12.166 1.00 0.00 C ATOM 1938 CG PRO B1135 12.243 -6.926 -11.603 1.00 0.00 C ATOM 1939 CD PRO B1135 12.851 -6.023 -12.685 1.00 0.00 C ATOM 0 HA PRO B1135 11.529 -7.919 -14.180 1.00 0.00 H new ATOM 0 HB2 PRO B1135 10.065 -6.786 -11.733 1.00 0.00 H new ATOM 0 HB3 PRO B1135 10.679 -8.412 -11.960 1.00 0.00 H new ATOM 0 HG2 PRO B1135 12.127 -6.390 -10.661 1.00 0.00 H new ATOM 0 HG3 PRO B1135 12.881 -7.787 -11.403 1.00 0.00 H new ATOM 0 HD2 PRO B1135 13.124 -5.055 -12.265 1.00 0.00 H new ATOM 0 HD3 PRO B1135 13.764 -6.466 -13.083 1.00 0.00 H new ATOM 1949 N GLN B1136 8.985 -8.153 -14.539 1.00 0.00 N ATOM 1950 CA GLN B1136 7.662 -8.226 -15.183 1.00 0.00 C ATOM 1951 C GLN B1136 6.493 -7.724 -14.300 1.00 0.00 C ATOM 1952 O GLN B1136 5.684 -6.945 -14.815 1.00 0.00 O ATOM 1953 CB GLN B1136 7.407 -9.647 -15.718 1.00 0.00 C ATOM 1954 CG GLN B1136 8.361 -10.016 -16.871 1.00 0.00 C ATOM 1955 CD GLN B1136 8.095 -11.399 -17.472 1.00 0.00 C ATOM 1956 OE1 GLN B1136 7.227 -12.160 -17.059 1.00 0.00 O ATOM 1957 NE2 GLN B1136 8.845 -11.788 -18.485 1.00 0.00 N ATOM 0 H GLN B1136 9.327 -9.055 -14.208 1.00 0.00 H new ATOM 0 HA GLN B1136 7.690 -7.529 -16.020 1.00 0.00 H new ATOM 0 HB2 GLN B1136 7.526 -10.365 -14.907 1.00 0.00 H new ATOM 0 HB3 GLN B1136 6.376 -9.724 -16.063 1.00 0.00 H new ATOM 0 HG2 GLN B1136 8.274 -9.265 -17.657 1.00 0.00 H new ATOM 0 HG3 GLN B1136 9.388 -9.979 -16.507 1.00 0.00 H new ATOM 0 HE21 GLN B1136 9.574 -11.172 -18.846 1.00 0.00 H new ATOM 0 HE22 GLN B1136 8.696 -12.705 -18.907 1.00 0.00 H new ATOM 1966 N PRO B1137 6.360 -8.104 -13.006 1.00 0.00 N ATOM 1967 CA PRO B1137 5.276 -7.605 -12.156 1.00 0.00 C ATOM 1968 C PRO B1137 5.544 -6.171 -11.662 1.00 0.00 C ATOM 1969 O PRO B1137 6.569 -5.901 -11.033 1.00 0.00 O ATOM 1970 CB PRO B1137 5.152 -8.613 -11.008 1.00 0.00 C ATOM 1971 CG PRO B1137 6.568 -9.167 -10.868 1.00 0.00 C ATOM 1972 CD PRO B1137 7.107 -9.141 -12.298 1.00 0.00 C ATOM 0 HA PRO B1137 4.339 -7.529 -12.707 1.00 0.00 H new ATOM 0 HB2 PRO B1137 4.815 -8.135 -10.088 1.00 0.00 H new ATOM 0 HB3 PRO B1137 4.434 -9.400 -11.240 1.00 0.00 H new ATOM 0 HG2 PRO B1137 7.174 -8.555 -10.200 1.00 0.00 H new ATOM 0 HG3 PRO B1137 6.565 -10.177 -10.459 1.00 0.00 H new ATOM 0 HD2 PRO B1137 8.175 -8.923 -12.306 1.00 0.00 H new ATOM 0 HD3 PRO B1137 6.976 -10.110 -12.779 1.00 0.00 H new ATOM 1980 N GLU B1138 4.589 -5.272 -11.917 1.00 0.00 N ATOM 1981 CA GLU B1138 4.630 -3.845 -11.559 1.00 0.00 C ATOM 1982 C GLU B1138 3.420 -3.474 -10.658 1.00 0.00 C ATOM 1983 O GLU B1138 3.296 -3.946 -9.526 1.00 0.00 O ATOM 1984 CB GLU B1138 4.652 -2.973 -12.839 1.00 0.00 C ATOM 1985 CG GLU B1138 5.763 -3.116 -13.868 1.00 0.00 C ATOM 1986 CD GLU B1138 7.047 -2.383 -13.461 1.00 0.00 C ATOM 1987 OE1 GLU B1138 7.923 -2.977 -12.792 1.00 0.00 O ATOM 1988 OE2 GLU B1138 7.176 -1.189 -13.831 1.00 0.00 O ATOM 0 H GLU B1138 3.727 -5.527 -12.400 1.00 0.00 H new ATOM 0 HA GLU B1138 5.543 -3.652 -10.995 1.00 0.00 H new ATOM 0 HB2 GLU B1138 3.711 -3.148 -13.360 1.00 0.00 H new ATOM 0 HB3 GLU B1138 4.649 -1.932 -12.516 1.00 0.00 H new ATOM 0 HG2 GLU B1138 5.984 -4.173 -14.013 1.00 0.00 H new ATOM 0 HG3 GLU B1138 5.417 -2.728 -14.826 1.00 0.00 H new HETATM 1995 N PTR B1139 2.538 -2.630 -11.197 1.00 0.00 N HETATM 1996 CA PTR B1139 1.341 -2.033 -10.641 1.00 0.00 C HETATM 1997 C PTR B1139 0.049 -2.939 -10.719 1.00 0.00 C HETATM 1998 O PTR B1139 0.153 -4.155 -10.919 1.00 0.00 O HETATM 1999 CB PTR B1139 1.425 -0.542 -11.037 1.00 0.00 C HETATM 2000 CG PTR B1139 2.663 0.232 -10.488 1.00 0.00 C HETATM 2001 CD1 PTR B1139 2.702 0.677 -9.134 1.00 0.00 C HETATM 2002 CD2 PTR B1139 3.745 0.607 -11.333 1.00 0.00 C HETATM 2003 CE1 PTR B1139 3.712 1.560 -8.671 1.00 0.00 C HETATM 2004 CE2 PTR B1139 4.700 1.558 -10.887 1.00 0.00 C HETATM 2005 CZ PTR B1139 4.701 2.037 -9.567 1.00 0.00 C HETATM 2006 OH PTR B1139 5.631 2.938 -9.325 1.00 0.00 O HETATM 2007 P PTR B1139 6.402 3.122 -7.957 1.00 0.00 P HETATM 2008 O1P PTR B1139 7.718 3.586 -8.426 1.00 0.00 O HETATM 2009 O2P PTR B1139 5.648 4.093 -7.160 1.00 0.00 O HETATM 2010 O3P PTR B1139 6.480 1.781 -7.374 1.00 0.00 O HETATM 0 HE2 PTR B1139 5.451 1.925 -11.586 1.00 0.00 H new HETATM 0 HE1 PTR B1139 3.727 1.871 -7.626 1.00 0.00 H new HETATM 0 HD2 PTR B1139 3.841 0.163 -12.324 1.00 0.00 H new HETATM 0 HD1 PTR B1139 1.938 0.331 -8.438 1.00 0.00 H new HETATM 0 HB3 PTR B1139 1.429 -0.473 -12.125 1.00 0.00 H new HETATM 0 HB2 PTR B1139 0.522 -0.041 -10.689 1.00 0.00 H new HETATM 0 HA PTR B1139 1.242 -2.001 -9.556 1.00 0.00 H new ATOM 2019 N VAL B1140 -1.164 -2.372 -10.535 1.00 0.00 N ATOM 2020 CA VAL B1140 -2.472 -3.121 -10.532 1.00 0.00 C ATOM 2021 C VAL B1140 -3.631 -2.458 -11.197 1.00 0.00 C ATOM 2022 O VAL B1140 -4.497 -3.169 -11.710 1.00 0.00 O ATOM 2023 CB VAL B1140 -2.923 -3.577 -9.110 1.00 0.00 C ATOM 2024 CG1 VAL B1140 -4.410 -3.796 -8.844 1.00 0.00 C ATOM 2025 CG2 VAL B1140 -2.261 -4.917 -8.759 1.00 0.00 C ATOM 0 H VAL B1140 -1.280 -1.370 -10.381 1.00 0.00 H new ATOM 0 HA VAL B1140 -2.209 -3.982 -11.147 1.00 0.00 H new ATOM 0 HB VAL B1140 -2.622 -2.720 -8.508 1.00 0.00 H new ATOM 0 HG11 VAL B1140 -4.552 -4.110 -7.810 1.00 0.00 H new ATOM 0 HG12 VAL B1140 -4.952 -2.866 -9.019 1.00 0.00 H new ATOM 0 HG13 VAL B1140 -4.789 -4.568 -9.513 1.00 0.00 H new ATOM 0 HG21 VAL B1140 -2.579 -5.231 -7.765 1.00 0.00 H new ATOM 0 HG22 VAL B1140 -2.556 -5.671 -9.489 1.00 0.00 H new ATOM 0 HG23 VAL B1140 -1.177 -4.802 -8.773 1.00 0.00 H new ATOM 2035 N ASN B1141 -3.675 -1.125 -11.236 1.00 0.00 N ATOM 2036 CA ASN B1141 -4.704 -0.473 -12.074 1.00 0.00 C ATOM 2037 C ASN B1141 -4.429 -1.086 -13.498 1.00 0.00 C ATOM 2038 O ASN B1141 -5.342 -1.373 -14.265 1.00 0.00 O ATOM 2039 CB ASN B1141 -4.681 1.037 -11.803 1.00 0.00 C ATOM 2040 CG ASN B1141 -4.558 1.263 -10.306 1.00 0.00 C ATOM 2041 OD1 ASN B1141 -5.457 0.984 -9.544 1.00 0.00 O ATOM 2042 ND2 ASN B1141 -3.374 1.516 -9.808 1.00 0.00 N ATOM 0 H ASN B1141 -3.051 -0.497 -10.730 1.00 0.00 H new ATOM 0 HA ASN B1141 -5.761 -0.657 -11.882 1.00 0.00 H new ATOM 0 HB2 ASN B1141 -3.844 1.502 -12.325 1.00 0.00 H new ATOM 0 HB3 ASN B1141 -5.591 1.502 -12.182 1.00 0.00 H new ATOM 0 HD21 ASN B1141 -3.226 1.476 -8.800 1.00 0.00 H new ATOM 0 HD22 ASN B1141 -2.600 1.753 -10.428 1.00 0.00 H new ATOM 2049 N GLN B1142 -3.139 -1.451 -13.681 1.00 0.00 N ATOM 2050 CA GLN B1142 -2.412 -2.210 -14.655 1.00 0.00 C ATOM 2051 C GLN B1142 -1.132 -2.649 -13.939 1.00 0.00 C ATOM 2052 O GLN B1142 -0.677 -1.865 -13.109 1.00 0.00 O ATOM 2053 CB GLN B1142 -1.845 -1.321 -15.754 1.00 0.00 C ATOM 2054 CG GLN B1142 -2.707 -0.740 -16.897 1.00 0.00 C ATOM 2055 CD GLN B1142 -3.890 0.177 -16.548 1.00 0.00 C ATOM 2056 OE1 GLN B1142 -5.034 -0.125 -16.867 1.00 0.00 O ATOM 2057 NE2 GLN B1142 -3.712 1.359 -15.977 1.00 0.00 N ATOM 0 H GLN B1142 -2.472 -1.133 -12.978 1.00 0.00 H new ATOM 0 HA GLN B1142 -3.068 -2.984 -15.054 1.00 0.00 H new ATOM 0 HB2 GLN B1142 -1.380 -0.471 -15.255 1.00 0.00 H new ATOM 0 HB3 GLN B1142 -1.045 -1.889 -16.228 1.00 0.00 H new ATOM 0 HG2 GLN B1142 -2.044 -0.183 -17.559 1.00 0.00 H new ATOM 0 HG3 GLN B1142 -3.100 -1.579 -17.472 1.00 0.00 H new ATOM 0 HE21 GLN B1142 -2.777 1.653 -15.694 1.00 0.00 H new ATOM 0 HE22 GLN B1142 -4.510 1.975 -15.820 1.00 0.00 H new ATOM 2066 N PRO B1143 -0.417 -3.709 -14.350 1.00 0.00 N ATOM 2067 CA PRO B1143 1.033 -3.759 -14.158 1.00 0.00 C ATOM 2068 C PRO B1143 1.716 -2.737 -15.112 1.00 0.00 C ATOM 2069 O PRO B1143 2.496 -3.076 -16.004 1.00 0.00 O ATOM 2070 CB PRO B1143 1.395 -5.223 -14.414 1.00 0.00 C ATOM 2071 CG PRO B1143 0.402 -5.622 -15.509 1.00 0.00 C ATOM 2072 CD PRO B1143 -0.863 -4.822 -15.175 1.00 0.00 C ATOM 0 HA PRO B1143 1.376 -3.469 -13.165 1.00 0.00 H new ATOM 0 HB2 PRO B1143 2.428 -5.334 -14.743 1.00 0.00 H new ATOM 0 HB3 PRO B1143 1.278 -5.833 -13.518 1.00 0.00 H new ATOM 0 HG2 PRO B1143 0.781 -5.374 -16.500 1.00 0.00 H new ATOM 0 HG3 PRO B1143 0.209 -6.695 -15.501 1.00 0.00 H new ATOM 0 HD2 PRO B1143 -1.352 -4.466 -16.082 1.00 0.00 H new ATOM 0 HD3 PRO B1143 -1.587 -5.439 -14.643 1.00 0.00 H new ATOM 2080 N ASP B1144 1.332 -1.477 -14.890 1.00 0.00 N ATOM 2081 CA ASP B1144 1.574 -0.205 -15.571 1.00 0.00 C ATOM 2082 C ASP B1144 1.739 -0.282 -17.113 1.00 0.00 C ATOM 2083 O ASP B1144 0.701 -0.271 -17.817 1.00 0.00 O ATOM 2084 CB ASP B1144 2.673 0.625 -14.882 1.00 0.00 C ATOM 2085 CG ASP B1144 2.955 1.971 -15.594 1.00 0.00 C ATOM 2086 OD1 ASP B1144 1.994 2.725 -15.890 1.00 0.00 O ATOM 2087 OD2 ASP B1144 4.145 2.306 -15.825 1.00 0.00 O ATOM 2088 OXT ASP B1144 2.882 -0.327 -17.628 1.00 0.00 O ATOM 0 H ASP B1144 0.737 -1.302 -14.080 1.00 0.00 H new ATOM 0 HA ASP B1144 0.637 0.339 -15.456 1.00 0.00 H new ATOM 0 HB2 ASP B1144 2.379 0.821 -13.851 1.00 0.00 H new ATOM 0 HB3 ASP B1144 3.592 0.041 -14.846 1.00 0.00 H new TER 2093 ASP B1144