USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 900 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 LYS NZ :NH3+ 170:sc= -1.5 (180deg=-1.89) USER MOD Set 1.2: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 9 SER OG : rot 2:sc= -0.697 USER MOD Set 2.2: A 42 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 33 GLN : amide:sc= -2.22! C(o=-3.8!,f=-1.2!) USER MOD Set 3.2: A 36 ASN : amide:sc= -1.55 K(o=-3.8,f=-1.2) USER MOD Set 4.1: A 12 TYR OH : rot 165:sc= 0.048 USER MOD Set 4.2: A 102 LYS NZ :NH3+ -142:sc= 0.0544 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0686 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -135:sc= -0.271 (180deg=-1.11!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= -0.315 X(o=-0.32,f=-0.56) USER MOD Single : A 20 LYS NZ :NH3+ -114:sc= -0.0748 (180deg=-2.26!) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= -1.54 K(o=-1.5,f=-2.3) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -85:sc= 0.888 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -159:sc= -1.15 (180deg=-1.95!) USER MOD Single : A 57 MET CE :methyl 151:sc= -0.146 (180deg=-0.593) USER MOD Single : A 60 GLN : amide:sc= -0.125 K(o=-0.13,f=-1.5!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0198 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc=-0.00426 X(o=-0.0043,f=-0.25) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -1.31 K(o=-1.3,f=-0.18) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 75 GLN : amide:sc= -0.178 X(o=-0.18,f=-0.0026) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -114:sc= -2.87 (180deg=-4.5!) USER MOD Single : A 91 ASN : amide:sc= -2.22! K(o=-2.2!,f=-0.27) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc=-0.00596 X(o=-0.006,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 172:sc= 0.422 (180deg=0.391) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 158:sc=-0.000308 (180deg=-0.0495) USER MOD Single : A 107 SER OG : rot 180:sc= 0.0485 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= -0.227 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.152 24.017 5.793 1.00 0.00 N ATOM 2 CA GLY A 1 9.531 22.693 6.073 1.00 0.00 C ATOM 3 C GLY A 1 9.490 22.372 7.553 1.00 0.00 C ATOM 4 O GLY A 1 10.474 21.896 8.119 1.00 0.00 O ATOM 0 H1 GLY A 1 10.156 24.189 4.767 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.605 24.764 6.267 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.129 24.024 6.149 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.517 22.679 5.673 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.090 21.916 5.551 1.00 0.00 H new ATOM 10 N SER A 2 8.350 22.634 8.182 1.00 0.00 N ATOM 11 CA SER A 2 8.184 22.370 9.607 1.00 0.00 C ATOM 12 C SER A 2 6.750 21.957 9.921 1.00 0.00 C ATOM 13 O SER A 2 6.232 22.248 11.000 1.00 0.00 O ATOM 14 CB SER A 2 8.560 23.608 10.423 1.00 0.00 C ATOM 15 OG SER A 2 9.525 24.393 9.744 1.00 0.00 O ATOM 0 H SER A 2 7.527 23.029 7.728 1.00 0.00 H new ATOM 0 HA SER A 2 8.847 21.549 9.878 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.669 24.206 10.614 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.952 23.303 11.393 1.00 0.00 H new ATOM 0 HG SER A 2 9.747 25.179 10.286 1.00 0.00 H new ATOM 21 N SER A 3 6.115 21.276 8.973 1.00 0.00 N ATOM 22 CA SER A 3 4.740 20.823 9.148 1.00 0.00 C ATOM 23 C SER A 3 4.689 19.314 9.373 1.00 0.00 C ATOM 24 O SER A 3 3.937 18.827 10.216 1.00 0.00 O ATOM 25 CB SER A 3 3.898 21.196 7.927 1.00 0.00 C ATOM 26 OG SER A 3 4.259 22.472 7.428 1.00 0.00 O ATOM 0 H SER A 3 6.531 21.026 8.076 1.00 0.00 H new ATOM 0 HA SER A 3 4.330 21.318 10.028 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.031 20.446 7.147 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.842 21.193 8.195 1.00 0.00 H new ATOM 0 HG SER A 3 3.707 22.686 6.647 1.00 0.00 H new ATOM 32 N GLY A 4 5.496 18.581 8.613 1.00 0.00 N ATOM 33 CA GLY A 4 5.528 17.136 8.744 1.00 0.00 C ATOM 34 C GLY A 4 4.232 16.484 8.303 1.00 0.00 C ATOM 35 O GLY A 4 3.671 15.654 9.019 1.00 0.00 O ATOM 0 H GLY A 4 6.128 18.962 7.909 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.351 16.739 8.150 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.728 16.873 9.783 1.00 0.00 H new ATOM 39 N SER A 5 3.755 16.860 7.121 1.00 0.00 N ATOM 40 CA SER A 5 2.517 16.307 6.585 1.00 0.00 C ATOM 41 C SER A 5 2.751 14.920 5.996 1.00 0.00 C ATOM 42 O SER A 5 2.184 13.932 6.463 1.00 0.00 O ATOM 43 CB SER A 5 1.938 17.236 5.517 1.00 0.00 C ATOM 44 OG SER A 5 1.013 18.149 6.081 1.00 0.00 O ATOM 0 H SER A 5 4.207 17.546 6.516 1.00 0.00 H new ATOM 0 HA SER A 5 1.804 16.219 7.405 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.745 17.785 5.032 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.445 16.645 4.745 1.00 0.00 H new ATOM 0 HG SER A 5 0.659 18.732 5.378 1.00 0.00 H new ATOM 50 N SER A 6 3.591 14.853 4.968 1.00 0.00 N ATOM 51 CA SER A 6 3.900 13.586 4.315 1.00 0.00 C ATOM 52 C SER A 6 5.283 13.628 3.672 1.00 0.00 C ATOM 53 O SER A 6 5.418 13.942 2.490 1.00 0.00 O ATOM 54 CB SER A 6 2.842 13.261 3.259 1.00 0.00 C ATOM 55 OG SER A 6 2.525 11.880 3.263 1.00 0.00 O ATOM 0 H SER A 6 4.070 15.661 4.569 1.00 0.00 H new ATOM 0 HA SER A 6 3.897 12.804 5.074 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.941 13.845 3.450 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.206 13.551 2.273 1.00 0.00 H new ATOM 0 HG SER A 6 1.845 11.698 2.581 1.00 0.00 H new ATOM 61 N GLY A 7 6.306 13.308 4.458 1.00 0.00 N ATOM 62 CA GLY A 7 7.665 13.315 3.947 1.00 0.00 C ATOM 63 C GLY A 7 8.402 12.021 4.233 1.00 0.00 C ATOM 64 O GLY A 7 9.632 11.991 4.237 1.00 0.00 O ATOM 0 H GLY A 7 6.219 13.044 5.439 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.644 13.486 2.871 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.212 14.146 4.391 1.00 0.00 H new ATOM 68 N ILE A 8 7.650 10.952 4.474 1.00 0.00 N ATOM 69 CA ILE A 8 8.243 9.651 4.763 1.00 0.00 C ATOM 70 C ILE A 8 7.255 8.524 4.482 1.00 0.00 C ATOM 71 O ILE A 8 6.111 8.768 4.103 1.00 0.00 O ATOM 72 CB ILE A 8 8.708 9.558 6.228 1.00 0.00 C ATOM 73 CG1 ILE A 8 7.583 9.990 7.171 1.00 0.00 C ATOM 74 CG2 ILE A 8 9.948 10.412 6.448 1.00 0.00 C ATOM 75 CD1 ILE A 8 7.859 9.673 8.626 1.00 0.00 C ATOM 0 H ILE A 8 6.630 10.961 4.475 1.00 0.00 H new ATOM 0 HA ILE A 8 9.108 9.545 4.109 1.00 0.00 H new ATOM 0 HB ILE A 8 8.963 8.521 6.447 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.423 11.063 7.065 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.658 9.498 6.869 1.00 0.00 H new ATOM 0 HG21 ILE A 8 10.263 10.335 7.489 1.00 0.00 H new ATOM 0 HG22 ILE A 8 10.751 10.062 5.799 1.00 0.00 H new ATOM 0 HG23 ILE A 8 9.720 11.452 6.214 1.00 0.00 H new ATOM 0 HD11 ILE A 8 7.020 10.007 9.237 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.990 8.597 8.746 1.00 0.00 H new ATOM 0 HD13 ILE A 8 8.766 10.186 8.944 1.00 0.00 H new ATOM 87 N SER A 9 7.707 7.288 4.670 1.00 0.00 N ATOM 88 CA SER A 9 6.862 6.123 4.435 1.00 0.00 C ATOM 89 C SER A 9 7.264 4.968 5.347 1.00 0.00 C ATOM 90 O SER A 9 8.269 5.041 6.053 1.00 0.00 O ATOM 91 CB SER A 9 6.950 5.688 2.972 1.00 0.00 C ATOM 92 OG SER A 9 6.373 6.658 2.116 1.00 0.00 O ATOM 0 H SER A 9 8.652 7.068 4.984 1.00 0.00 H new ATOM 0 HA SER A 9 5.832 6.400 4.661 1.00 0.00 H new ATOM 0 HB2 SER A 9 7.993 5.531 2.698 1.00 0.00 H new ATOM 0 HB3 SER A 9 6.440 4.734 2.842 1.00 0.00 H new ATOM 0 HG SER A 9 6.069 7.423 2.647 1.00 0.00 H new ATOM 98 N LEU A 10 6.470 3.901 5.326 1.00 0.00 N ATOM 99 CA LEU A 10 6.743 2.729 6.150 1.00 0.00 C ATOM 100 C LEU A 10 7.714 1.785 5.449 1.00 0.00 C ATOM 101 O LEU A 10 7.378 1.175 4.434 1.00 0.00 O ATOM 102 CB LEU A 10 5.442 1.993 6.473 1.00 0.00 C ATOM 103 CG LEU A 10 4.649 2.565 7.650 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.253 1.963 7.696 1.00 0.00 C ATOM 105 CD2 LEU A 10 5.384 2.313 8.958 1.00 0.00 C ATOM 0 H LEU A 10 5.633 3.824 4.748 1.00 0.00 H new ATOM 0 HA LEU A 10 7.201 3.068 7.079 1.00 0.00 H new ATOM 0 HB2 LEU A 10 4.807 2.004 5.587 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.676 0.950 6.685 1.00 0.00 H new ATOM 0 HG LEU A 10 4.553 3.642 7.511 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.704 2.382 8.539 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.727 2.194 6.770 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.327 0.882 7.812 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.807 2.726 9.785 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.510 1.240 9.104 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.362 2.792 8.924 1.00 0.00 H new ATOM 117 N LYS A 11 8.919 1.669 5.998 1.00 0.00 N ATOM 118 CA LYS A 11 9.939 0.799 5.426 1.00 0.00 C ATOM 119 C LYS A 11 9.948 -0.558 6.121 1.00 0.00 C ATOM 120 O LYS A 11 10.245 -0.656 7.312 1.00 0.00 O ATOM 121 CB LYS A 11 11.318 1.451 5.539 1.00 0.00 C ATOM 122 CG LYS A 11 11.380 2.850 4.944 1.00 0.00 C ATOM 123 CD LYS A 11 12.069 2.851 3.590 1.00 0.00 C ATOM 124 CE LYS A 11 13.577 2.988 3.731 1.00 0.00 C ATOM 125 NZ LYS A 11 13.953 4.200 4.512 1.00 0.00 N ATOM 0 H LYS A 11 9.212 2.167 6.838 1.00 0.00 H new ATOM 0 HA LYS A 11 9.702 0.647 4.373 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.603 1.499 6.590 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.052 0.819 5.038 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.370 3.247 4.839 1.00 0.00 H new ATOM 0 HG3 LYS A 11 11.914 3.513 5.625 1.00 0.00 H new ATOM 0 HD2 LYS A 11 11.835 1.927 3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 11 11.683 3.672 2.985 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.978 2.101 4.221 1.00 0.00 H new ATOM 0 HE3 LYS A 11 14.031 3.038 2.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.732 4.694 4.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 13.132 4.835 4.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.257 3.918 5.466 1.00 0.00 H new ATOM 139 N TYR A 12 9.620 -1.605 5.370 1.00 0.00 N ATOM 140 CA TYR A 12 9.589 -2.957 5.914 1.00 0.00 C ATOM 141 C TYR A 12 10.027 -3.976 4.868 1.00 0.00 C ATOM 142 O TYR A 12 9.489 -4.016 3.761 1.00 0.00 O ATOM 143 CB TYR A 12 8.184 -3.295 6.416 1.00 0.00 C ATOM 144 CG TYR A 12 7.920 -2.836 7.832 1.00 0.00 C ATOM 145 CD1 TYR A 12 8.585 -3.414 8.906 1.00 0.00 C ATOM 146 CD2 TYR A 12 7.006 -1.823 8.096 1.00 0.00 C ATOM 147 CE1 TYR A 12 8.346 -2.997 10.202 1.00 0.00 C ATOM 148 CE2 TYR A 12 6.762 -1.400 9.388 1.00 0.00 C ATOM 149 CZ TYR A 12 7.434 -1.990 10.437 1.00 0.00 C ATOM 150 OH TYR A 12 7.194 -1.571 11.726 1.00 0.00 O ATOM 0 H TYR A 12 9.372 -1.542 4.383 1.00 0.00 H new ATOM 0 HA TYR A 12 10.287 -3.001 6.750 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.450 -2.838 5.752 1.00 0.00 H new ATOM 0 HB3 TYR A 12 8.037 -4.374 6.359 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.301 -4.202 8.725 1.00 0.00 H new ATOM 0 HD2 TYR A 12 6.477 -1.358 7.277 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.871 -3.457 11.026 1.00 0.00 H new ATOM 0 HE2 TYR A 12 6.049 -0.611 9.575 1.00 0.00 H new ATOM 0 HH TYR A 12 6.721 -0.713 11.708 1.00 0.00 H new ATOM 160 N THR A 13 11.007 -4.800 5.226 1.00 0.00 N ATOM 161 CA THR A 13 11.518 -5.821 4.317 1.00 0.00 C ATOM 162 C THR A 13 10.570 -7.013 4.249 1.00 0.00 C ATOM 163 O THR A 13 9.702 -7.179 5.106 1.00 0.00 O ATOM 164 CB THR A 13 12.905 -6.284 4.766 1.00 0.00 C ATOM 165 OG1 THR A 13 12.863 -6.790 6.088 1.00 0.00 O ATOM 166 CG2 THR A 13 13.945 -5.184 4.728 1.00 0.00 C ATOM 0 H THR A 13 11.463 -4.781 6.138 1.00 0.00 H new ATOM 0 HA THR A 13 11.592 -5.382 3.322 1.00 0.00 H new ATOM 0 HB THR A 13 13.193 -7.059 4.056 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.759 -7.082 6.355 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.905 -5.580 5.058 1.00 0.00 H new ATOM 0 HG22 THR A 13 14.039 -4.807 3.710 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.640 -4.372 5.389 1.00 0.00 H new ATOM 174 N ALA A 14 10.742 -7.841 3.224 1.00 0.00 N ATOM 175 CA ALA A 14 9.902 -9.018 3.043 1.00 0.00 C ATOM 176 C ALA A 14 10.005 -9.955 4.244 1.00 0.00 C ATOM 177 O ALA A 14 9.037 -10.622 4.607 1.00 0.00 O ATOM 178 CB ALA A 14 10.288 -9.748 1.766 1.00 0.00 C ATOM 0 H ALA A 14 11.456 -7.718 2.506 1.00 0.00 H new ATOM 0 HA ALA A 14 8.866 -8.688 2.961 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.653 -10.625 1.642 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.157 -9.082 0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.331 -10.060 1.826 1.00 0.00 H new ATOM 184 N ALA A 15 11.185 -9.998 4.853 1.00 0.00 N ATOM 185 CA ALA A 15 11.415 -10.852 6.013 1.00 0.00 C ATOM 186 C ALA A 15 10.568 -10.405 7.199 1.00 0.00 C ATOM 187 O ALA A 15 10.084 -11.229 7.975 1.00 0.00 O ATOM 188 CB ALA A 15 12.890 -10.850 6.383 1.00 0.00 C ATOM 0 H ALA A 15 11.996 -9.452 4.563 1.00 0.00 H new ATOM 0 HA ALA A 15 11.119 -11.868 5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 15 13.048 -11.491 7.250 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.476 -11.224 5.543 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.204 -9.834 6.621 1.00 0.00 H new ATOM 194 N ARG A 16 10.394 -9.095 7.335 1.00 0.00 N ATOM 195 CA ARG A 16 9.605 -8.537 8.427 1.00 0.00 C ATOM 196 C ARG A 16 8.120 -8.831 8.233 1.00 0.00 C ATOM 197 O ARG A 16 7.407 -9.134 9.188 1.00 0.00 O ATOM 198 CB ARG A 16 9.834 -7.026 8.530 1.00 0.00 C ATOM 199 CG ARG A 16 10.300 -6.573 9.903 1.00 0.00 C ATOM 200 CD ARG A 16 9.212 -6.757 10.949 1.00 0.00 C ATOM 201 NE ARG A 16 9.439 -5.925 12.128 1.00 0.00 N ATOM 202 CZ ARG A 16 8.745 -6.036 13.258 1.00 0.00 C ATOM 203 NH1 ARG A 16 7.781 -6.942 13.366 1.00 0.00 N ATOM 204 NH2 ARG A 16 9.016 -5.240 14.283 1.00 0.00 N ATOM 0 H ARG A 16 10.789 -8.399 6.702 1.00 0.00 H new ATOM 0 HA ARG A 16 9.929 -9.009 9.355 1.00 0.00 H new ATOM 0 HB2 ARG A 16 10.574 -6.728 7.788 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.907 -6.509 8.281 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.185 -7.139 10.193 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.593 -5.524 9.861 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.244 -6.510 10.512 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.170 -7.805 11.247 1.00 0.00 H new ATOM 0 HE ARG A 16 10.172 -5.218 12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 16 7.569 -7.557 12.581 1.00 0.00 H new ATOM 0 HH12 ARG A 16 7.252 -7.023 14.234 1.00 0.00 H new ATOM 0 HH21 ARG A 16 9.756 -4.543 14.205 1.00 0.00 H new ATOM 0 HH22 ARG A 16 8.484 -5.325 15.149 1.00 0.00 H new ATOM 218 N LEU A 17 7.663 -8.740 6.989 1.00 0.00 N ATOM 219 CA LEU A 17 6.265 -8.997 6.668 1.00 0.00 C ATOM 220 C LEU A 17 5.953 -10.488 6.741 1.00 0.00 C ATOM 221 O LEU A 17 4.860 -10.886 7.142 1.00 0.00 O ATOM 222 CB LEU A 17 5.932 -8.462 5.272 1.00 0.00 C ATOM 223 CG LEU A 17 6.285 -6.992 5.042 1.00 0.00 C ATOM 224 CD1 LEU A 17 6.719 -6.766 3.602 1.00 0.00 C ATOM 225 CD2 LEU A 17 5.103 -6.100 5.389 1.00 0.00 C ATOM 0 H LEU A 17 8.241 -8.490 6.187 1.00 0.00 H new ATOM 0 HA LEU A 17 5.650 -8.480 7.404 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.458 -9.066 4.533 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.865 -8.596 5.093 1.00 0.00 H new ATOM 0 HG LEU A 17 7.117 -6.732 5.696 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.966 -5.714 3.457 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.595 -7.378 3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.907 -7.044 2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.372 -5.057 5.219 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.252 -6.362 4.760 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.837 -6.240 6.437 1.00 0.00 H new ATOM 237 N HIS A 18 6.922 -11.309 6.348 1.00 0.00 N ATOM 238 CA HIS A 18 6.751 -12.757 6.370 1.00 0.00 C ATOM 239 C HIS A 18 6.634 -13.270 7.801 1.00 0.00 C ATOM 240 O HIS A 18 5.809 -14.136 8.095 1.00 0.00 O ATOM 241 CB HIS A 18 7.926 -13.440 5.666 1.00 0.00 C ATOM 242 CG HIS A 18 7.777 -14.926 5.559 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.068 -15.789 6.595 1.00 0.00 N ATOM 244 CD2 HIS A 18 7.364 -15.703 4.529 1.00 0.00 C ATOM 245 CE1 HIS A 18 7.842 -17.032 6.206 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.414 -17.006 4.958 1.00 0.00 N ATOM 0 H HIS A 18 7.833 -10.996 6.011 1.00 0.00 H new ATOM 0 HA HIS A 18 5.829 -12.997 5.841 1.00 0.00 H new ATOM 0 HB2 HIS A 18 8.033 -13.021 4.666 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.845 -13.213 6.207 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.053 -15.361 3.553 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.984 -17.918 6.807 1.00 0.00 H new ATOM 0 HE2 HIS A 18 7.161 -17.823 4.402 1.00 0.00 H new ATOM 255 N GLU A 19 7.463 -12.730 8.688 1.00 0.00 N ATOM 256 CA GLU A 19 7.452 -13.133 10.090 1.00 0.00 C ATOM 257 C GLU A 19 6.098 -12.843 10.730 1.00 0.00 C ATOM 258 O GLU A 19 5.565 -13.661 11.478 1.00 0.00 O ATOM 259 CB GLU A 19 8.558 -12.409 10.859 1.00 0.00 C ATOM 260 CG GLU A 19 9.957 -12.738 10.366 1.00 0.00 C ATOM 261 CD GLU A 19 10.719 -13.633 11.324 1.00 0.00 C ATOM 262 OE1 GLU A 19 10.285 -14.786 11.530 1.00 0.00 O ATOM 263 OE2 GLU A 19 11.747 -13.181 11.869 1.00 0.00 O ATOM 0 H GLU A 19 8.151 -12.012 8.461 1.00 0.00 H new ATOM 0 HA GLU A 19 7.631 -14.207 10.134 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.398 -11.334 10.782 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.484 -12.668 11.915 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.890 -13.227 9.394 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.513 -11.812 10.220 1.00 0.00 H new ATOM 270 N LYS A 20 5.547 -11.671 10.429 1.00 0.00 N ATOM 271 CA LYS A 20 4.255 -11.271 10.975 1.00 0.00 C ATOM 272 C LYS A 20 3.137 -12.157 10.436 1.00 0.00 C ATOM 273 O LYS A 20 2.142 -12.401 11.118 1.00 0.00 O ATOM 274 CB LYS A 20 3.968 -9.807 10.639 1.00 0.00 C ATOM 275 CG LYS A 20 5.062 -8.852 11.088 1.00 0.00 C ATOM 276 CD LYS A 20 5.029 -7.555 10.298 1.00 0.00 C ATOM 277 CE LYS A 20 5.409 -6.366 11.165 1.00 0.00 C ATOM 278 NZ LYS A 20 5.117 -5.069 10.492 1.00 0.00 N ATOM 0 H LYS A 20 5.975 -10.982 9.810 1.00 0.00 H new ATOM 0 HA LYS A 20 4.295 -11.388 12.058 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.833 -9.710 9.562 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.028 -9.514 11.106 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.944 -8.635 12.150 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.035 -9.329 10.966 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.714 -7.625 9.453 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.031 -7.403 9.887 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.864 -6.416 12.108 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.471 -6.418 11.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 6.009 -4.572 10.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.615 -5.247 9.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.523 -4.482 11.112 1.00 0.00 H new ATOM 292 N GLY A 21 3.308 -12.637 9.208 1.00 0.00 N ATOM 293 CA GLY A 21 2.304 -13.491 8.600 1.00 0.00 C ATOM 294 C GLY A 21 1.701 -12.884 7.347 1.00 0.00 C ATOM 295 O GLY A 21 1.092 -13.588 6.541 1.00 0.00 O ATOM 0 H GLY A 21 4.123 -12.450 8.624 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.752 -14.453 8.353 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.511 -13.685 9.323 1.00 0.00 H new ATOM 299 N VAL A 22 1.868 -11.574 7.180 1.00 0.00 N ATOM 300 CA VAL A 22 1.333 -10.878 6.016 1.00 0.00 C ATOM 301 C VAL A 22 1.835 -11.503 4.719 1.00 0.00 C ATOM 302 O VAL A 22 1.061 -12.083 3.958 1.00 0.00 O ATOM 303 CB VAL A 22 1.712 -9.385 6.032 1.00 0.00 C ATOM 304 CG1 VAL A 22 0.985 -8.636 4.925 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.407 -8.770 7.389 1.00 0.00 C ATOM 0 H VAL A 22 2.369 -10.975 7.836 1.00 0.00 H new ATOM 0 HA VAL A 22 0.248 -10.972 6.064 1.00 0.00 H new ATOM 0 HB VAL A 22 2.784 -9.301 5.853 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.266 -7.583 4.953 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.259 -9.059 3.959 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.091 -8.728 5.069 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.682 -7.715 7.380 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.342 -8.866 7.601 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.978 -9.287 8.160 1.00 0.00 H new ATOM 315 N LEU A 23 3.136 -11.383 4.473 1.00 0.00 N ATOM 316 CA LEU A 23 3.739 -11.938 3.267 1.00 0.00 C ATOM 317 C LEU A 23 3.876 -13.453 3.376 1.00 0.00 C ATOM 318 O LEU A 23 4.558 -13.963 4.264 1.00 0.00 O ATOM 319 CB LEU A 23 5.110 -11.306 3.020 1.00 0.00 C ATOM 320 CG LEU A 23 5.622 -11.412 1.583 1.00 0.00 C ATOM 321 CD1 LEU A 23 4.765 -10.572 0.649 1.00 0.00 C ATOM 322 CD2 LEU A 23 7.079 -10.984 1.504 1.00 0.00 C ATOM 0 H LEU A 23 3.792 -10.907 5.092 1.00 0.00 H new ATOM 0 HA LEU A 23 3.085 -11.710 2.425 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.063 -10.253 3.296 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.835 -11.777 3.684 1.00 0.00 H new ATOM 0 HG LEU A 23 5.553 -12.453 1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.144 -10.659 -0.369 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.734 -10.925 0.684 1.00 0.00 H new ATOM 0 HD13 LEU A 23 4.802 -9.528 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.427 -11.066 0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.173 -9.951 1.838 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.683 -11.628 2.143 1.00 0.00 H new ATOM 334 N LEU A 24 3.220 -14.167 2.467 1.00 0.00 N ATOM 335 CA LEU A 24 3.266 -15.624 2.459 1.00 0.00 C ATOM 336 C LEU A 24 4.559 -16.125 1.824 1.00 0.00 C ATOM 337 O LEU A 24 5.402 -16.723 2.495 1.00 0.00 O ATOM 338 CB LEU A 24 2.061 -16.189 1.705 1.00 0.00 C ATOM 339 CG LEU A 24 0.701 -15.684 2.189 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.386 -16.036 1.186 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.375 -16.264 3.557 1.00 0.00 C ATOM 0 H LEU A 24 2.650 -13.759 1.726 1.00 0.00 H new ATOM 0 HA LEU A 24 3.233 -15.969 3.492 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.167 -15.946 0.648 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.078 -17.276 1.786 1.00 0.00 H new ATOM 0 HG LEU A 24 0.747 -14.599 2.278 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.347 -15.669 1.547 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.158 -15.574 0.226 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.433 -17.118 1.065 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.596 -15.895 3.887 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.347 -17.352 3.494 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.140 -15.962 4.272 1.00 0.00 H new ATOM 353 N GLU A 25 4.710 -15.879 0.527 1.00 0.00 N ATOM 354 CA GLU A 25 5.899 -16.306 -0.199 1.00 0.00 C ATOM 355 C GLU A 25 6.110 -15.454 -1.447 1.00 0.00 C ATOM 356 O GLU A 25 5.232 -14.688 -1.843 1.00 0.00 O ATOM 357 CB GLU A 25 5.785 -17.781 -0.588 1.00 0.00 C ATOM 358 CG GLU A 25 6.012 -18.736 0.574 1.00 0.00 C ATOM 359 CD GLU A 25 6.549 -20.081 0.125 1.00 0.00 C ATOM 360 OE1 GLU A 25 7.782 -20.205 -0.031 1.00 0.00 O ATOM 361 OE2 GLU A 25 5.737 -21.009 -0.072 1.00 0.00 O ATOM 0 H GLU A 25 4.023 -15.386 -0.043 1.00 0.00 H new ATOM 0 HA GLU A 25 6.759 -16.177 0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.796 -17.962 -1.008 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.509 -17.998 -1.373 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.712 -18.286 1.278 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.073 -18.883 1.108 1.00 0.00 H new ATOM 368 N ILE A 26 7.280 -15.594 -2.062 1.00 0.00 N ATOM 369 CA ILE A 26 7.606 -14.839 -3.266 1.00 0.00 C ATOM 370 C ILE A 26 8.161 -15.751 -4.355 1.00 0.00 C ATOM 371 O ILE A 26 9.184 -16.408 -4.166 1.00 0.00 O ATOM 372 CB ILE A 26 8.631 -13.727 -2.970 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.190 -12.905 -1.758 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.808 -12.832 -4.188 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.224 -11.897 -1.305 1.00 0.00 C ATOM 0 H ILE A 26 8.018 -16.223 -1.746 1.00 0.00 H new ATOM 0 HA ILE A 26 6.679 -14.385 -3.616 1.00 0.00 H new ATOM 0 HB ILE A 26 9.591 -14.190 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.265 -12.381 -2.001 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.966 -13.581 -0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.535 -12.051 -3.963 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.163 -13.428 -5.029 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.853 -12.375 -4.445 1.00 0.00 H new ATOM 0 HD11 ILE A 26 8.845 -11.350 -0.442 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.142 -12.416 -1.031 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.430 -11.198 -2.116 1.00 0.00 H new ATOM 387 N GLU A 27 7.477 -15.786 -5.495 1.00 0.00 N ATOM 388 CA GLU A 27 7.901 -16.619 -6.615 1.00 0.00 C ATOM 389 C GLU A 27 9.091 -15.993 -7.340 1.00 0.00 C ATOM 390 O GLU A 27 8.998 -15.634 -8.515 1.00 0.00 O ATOM 391 CB GLU A 27 6.742 -16.823 -7.593 1.00 0.00 C ATOM 392 CG GLU A 27 5.455 -17.279 -6.925 1.00 0.00 C ATOM 393 CD GLU A 27 5.338 -18.789 -6.855 1.00 0.00 C ATOM 394 OE1 GLU A 27 6.219 -19.425 -6.237 1.00 0.00 O ATOM 395 OE2 GLU A 27 4.368 -19.337 -7.418 1.00 0.00 O ATOM 0 H GLU A 27 6.628 -15.248 -5.667 1.00 0.00 H new ATOM 0 HA GLU A 27 8.208 -17.587 -6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 27 6.555 -15.889 -8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 27 7.034 -17.560 -8.341 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.408 -16.867 -5.917 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.603 -16.877 -7.474 1.00 0.00 H new ATOM 402 N ASP A 28 10.208 -15.865 -6.632 1.00 0.00 N ATOM 403 CA ASP A 28 11.415 -15.284 -7.209 1.00 0.00 C ATOM 404 C ASP A 28 12.565 -15.310 -6.207 1.00 0.00 C ATOM 405 O ASP A 28 13.673 -15.738 -6.531 1.00 0.00 O ATOM 406 CB ASP A 28 11.149 -13.846 -7.659 1.00 0.00 C ATOM 407 CG ASP A 28 12.060 -13.416 -8.793 1.00 0.00 C ATOM 408 OD1 ASP A 28 13.182 -12.948 -8.508 1.00 0.00 O ATOM 409 OD2 ASP A 28 11.651 -13.548 -9.966 1.00 0.00 O ATOM 0 H ASP A 28 10.303 -16.155 -5.659 1.00 0.00 H new ATOM 0 HA ASP A 28 11.698 -15.883 -8.075 1.00 0.00 H new ATOM 0 HB2 ASP A 28 10.110 -13.754 -7.976 1.00 0.00 H new ATOM 0 HB3 ASP A 28 11.284 -13.173 -6.813 1.00 0.00 H new ATOM 414 N LEU A 29 12.295 -14.849 -4.991 1.00 0.00 N ATOM 415 CA LEU A 29 13.307 -14.819 -3.942 1.00 0.00 C ATOM 416 C LEU A 29 13.008 -15.857 -2.865 1.00 0.00 C ATOM 417 O LEU A 29 11.853 -16.220 -2.641 1.00 0.00 O ATOM 418 CB LEU A 29 13.381 -13.424 -3.315 1.00 0.00 C ATOM 419 CG LEU A 29 14.241 -12.416 -4.078 1.00 0.00 C ATOM 420 CD1 LEU A 29 15.637 -12.972 -4.310 1.00 0.00 C ATOM 421 CD2 LEU A 29 13.584 -12.048 -5.399 1.00 0.00 C ATOM 0 H LEU A 29 11.383 -14.491 -4.707 1.00 0.00 H new ATOM 0 HA LEU A 29 14.269 -15.059 -4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.370 -13.026 -3.231 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.771 -13.518 -2.302 1.00 0.00 H new ATOM 0 HG LEU A 29 14.329 -11.512 -3.475 1.00 0.00 H new ATOM 0 HD11 LEU A 29 16.234 -12.240 -4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 29 16.109 -13.183 -3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 29 15.570 -13.891 -4.892 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.210 -11.330 -5.929 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.465 -12.944 -6.008 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.606 -11.606 -5.208 1.00 0.00 H new ATOM 433 N GLN A 30 14.057 -16.332 -2.202 1.00 0.00 N ATOM 434 CA GLN A 30 13.907 -17.329 -1.148 1.00 0.00 C ATOM 435 C GLN A 30 13.693 -16.660 0.205 1.00 0.00 C ATOM 436 O GLN A 30 13.930 -15.463 0.361 1.00 0.00 O ATOM 437 CB GLN A 30 15.141 -18.233 -1.093 1.00 0.00 C ATOM 438 CG GLN A 30 15.159 -19.300 -2.175 1.00 0.00 C ATOM 439 CD GLN A 30 16.451 -19.305 -2.971 1.00 0.00 C ATOM 440 OE1 GLN A 30 16.537 -18.701 -4.040 1.00 0.00 O ATOM 441 NE2 GLN A 30 17.463 -19.987 -2.450 1.00 0.00 N ATOM 0 H GLN A 30 15.020 -16.043 -2.376 1.00 0.00 H new ATOM 0 HA GLN A 30 13.031 -17.935 -1.377 1.00 0.00 H new ATOM 0 HB2 GLN A 30 16.036 -17.618 -1.185 1.00 0.00 H new ATOM 0 HB3 GLN A 30 15.185 -18.716 -0.117 1.00 0.00 H new ATOM 0 HG2 GLN A 30 15.015 -20.279 -1.717 1.00 0.00 H new ATOM 0 HG3 GLN A 30 14.320 -19.139 -2.852 1.00 0.00 H new ATOM 0 HE21 GLN A 30 17.346 -20.473 -1.561 1.00 0.00 H new ATOM 0 HE22 GLN A 30 18.357 -20.025 -2.939 1.00 0.00 H new ATOM 450 N VAL A 31 13.241 -17.441 1.182 1.00 0.00 N ATOM 451 CA VAL A 31 12.992 -16.925 2.525 1.00 0.00 C ATOM 452 C VAL A 31 14.205 -16.176 3.067 1.00 0.00 C ATOM 453 O VAL A 31 14.067 -15.228 3.840 1.00 0.00 O ATOM 454 CB VAL A 31 12.625 -18.057 3.502 1.00 0.00 C ATOM 455 CG1 VAL A 31 12.176 -17.486 4.839 1.00 0.00 C ATOM 456 CG2 VAL A 31 11.547 -18.949 2.906 1.00 0.00 C ATOM 0 H VAL A 31 13.039 -18.434 1.069 1.00 0.00 H new ATOM 0 HA VAL A 31 12.152 -16.235 2.444 1.00 0.00 H new ATOM 0 HB VAL A 31 13.513 -18.665 3.673 1.00 0.00 H new ATOM 0 HG11 VAL A 31 11.921 -18.302 5.516 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.983 -16.894 5.271 1.00 0.00 H new ATOM 0 HG13 VAL A 31 11.302 -16.852 4.689 1.00 0.00 H new ATOM 0 HG21 VAL A 31 11.301 -19.743 3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.656 -18.356 2.702 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.911 -19.388 1.977 1.00 0.00 H new ATOM 466 N ASN A 32 15.394 -16.606 2.655 1.00 0.00 N ATOM 467 CA ASN A 32 16.629 -15.973 3.100 1.00 0.00 C ATOM 468 C ASN A 32 16.855 -14.651 2.374 1.00 0.00 C ATOM 469 O ASN A 32 17.458 -13.727 2.919 1.00 0.00 O ATOM 470 CB ASN A 32 17.819 -16.907 2.865 1.00 0.00 C ATOM 471 CG ASN A 32 17.946 -17.329 1.414 1.00 0.00 C ATOM 472 OD1 ASN A 32 17.333 -18.303 0.983 1.00 0.00 O ATOM 473 ND2 ASN A 32 18.748 -16.593 0.653 1.00 0.00 N ATOM 0 H ASN A 32 15.527 -17.389 2.015 1.00 0.00 H new ATOM 0 HA ASN A 32 16.540 -15.770 4.167 1.00 0.00 H new ATOM 0 HB2 ASN A 32 18.736 -16.408 3.177 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.710 -17.793 3.490 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.874 -16.828 -0.331 1.00 0.00 H new ATOM 0 HD22 ASN A 32 19.238 -15.793 1.053 1.00 0.00 H new ATOM 480 N GLN A 33 16.362 -14.566 1.142 1.00 0.00 N ATOM 481 CA GLN A 33 16.507 -13.355 0.342 1.00 0.00 C ATOM 482 C GLN A 33 15.464 -12.306 0.725 1.00 0.00 C ATOM 483 O GLN A 33 15.553 -11.152 0.308 1.00 0.00 O ATOM 484 CB GLN A 33 16.388 -13.688 -1.147 1.00 0.00 C ATOM 485 CG GLN A 33 17.429 -14.682 -1.634 1.00 0.00 C ATOM 486 CD GLN A 33 18.187 -14.187 -2.851 1.00 0.00 C ATOM 487 OE1 GLN A 33 18.592 -13.027 -2.915 1.00 0.00 O ATOM 488 NE2 GLN A 33 18.382 -15.068 -3.825 1.00 0.00 N ATOM 0 H GLN A 33 15.859 -15.321 0.676 1.00 0.00 H new ATOM 0 HA GLN A 33 17.495 -12.940 0.542 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.394 -14.091 -1.342 1.00 0.00 H new ATOM 0 HB3 GLN A 33 16.478 -12.768 -1.725 1.00 0.00 H new ATOM 0 HG2 GLN A 33 18.135 -14.886 -0.829 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.940 -15.626 -1.875 1.00 0.00 H new ATOM 0 HE21 GLN A 33 18.029 -16.020 -3.730 1.00 0.00 H new ATOM 0 HE22 GLN A 33 18.885 -14.793 -4.668 1.00 0.00 H new ATOM 497 N PHE A 34 14.475 -12.710 1.520 1.00 0.00 N ATOM 498 CA PHE A 34 13.419 -11.800 1.953 1.00 0.00 C ATOM 499 C PHE A 34 14.005 -10.543 2.590 1.00 0.00 C ATOM 500 O PHE A 34 13.415 -9.465 2.517 1.00 0.00 O ATOM 501 CB PHE A 34 12.489 -12.500 2.946 1.00 0.00 C ATOM 502 CG PHE A 34 11.312 -13.178 2.300 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.451 -13.835 1.088 1.00 0.00 C ATOM 504 CD2 PHE A 34 10.066 -13.159 2.908 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.371 -14.460 0.494 1.00 0.00 C ATOM 506 CE2 PHE A 34 8.983 -13.782 2.319 1.00 0.00 C ATOM 507 CZ PHE A 34 9.135 -14.433 1.110 1.00 0.00 C ATOM 0 H PHE A 34 14.384 -13.661 1.877 1.00 0.00 H new ATOM 0 HA PHE A 34 12.848 -11.506 1.073 1.00 0.00 H new ATOM 0 HB2 PHE A 34 13.061 -13.240 3.505 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.124 -11.768 3.666 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.415 -13.859 0.602 1.00 0.00 H new ATOM 0 HD2 PHE A 34 9.941 -12.651 3.853 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.493 -14.969 -0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 34 8.018 -13.760 2.803 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.289 -14.920 0.647 1.00 0.00 H new ATOM 517 N LYS A 35 15.170 -10.690 3.214 1.00 0.00 N ATOM 518 CA LYS A 35 15.836 -9.566 3.863 1.00 0.00 C ATOM 519 C LYS A 35 16.327 -8.557 2.830 1.00 0.00 C ATOM 520 O LYS A 35 16.371 -7.355 3.094 1.00 0.00 O ATOM 521 CB LYS A 35 17.008 -10.065 4.712 1.00 0.00 C ATOM 522 CG LYS A 35 16.935 -9.625 6.165 1.00 0.00 C ATOM 523 CD LYS A 35 17.549 -8.249 6.364 1.00 0.00 C ATOM 524 CE LYS A 35 16.984 -7.559 7.595 1.00 0.00 C ATOM 525 NZ LYS A 35 18.032 -6.810 8.343 1.00 0.00 N ATOM 0 H LYS A 35 15.672 -11.575 3.284 1.00 0.00 H new ATOM 0 HA LYS A 35 15.115 -9.069 4.512 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.038 -11.154 4.671 1.00 0.00 H new ATOM 0 HB3 LYS A 35 17.940 -9.704 4.278 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.895 -9.610 6.490 1.00 0.00 H new ATOM 0 HG3 LYS A 35 17.454 -10.350 6.792 1.00 0.00 H new ATOM 0 HD2 LYS A 35 18.630 -8.343 6.463 1.00 0.00 H new ATOM 0 HD3 LYS A 35 17.361 -7.635 5.483 1.00 0.00 H new ATOM 0 HE2 LYS A 35 16.192 -6.873 7.295 1.00 0.00 H new ATOM 0 HE3 LYS A 35 16.531 -8.302 8.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 17.606 -6.354 9.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 18.776 -7.468 8.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 18.447 -6.084 7.725 1.00 0.00 H new ATOM 539 N ASN A 36 16.698 -9.053 1.654 1.00 0.00 N ATOM 540 CA ASN A 36 17.187 -8.194 0.582 1.00 0.00 C ATOM 541 C ASN A 36 16.073 -7.298 0.049 1.00 0.00 C ATOM 542 O ASN A 36 16.222 -6.079 -0.018 1.00 0.00 O ATOM 543 CB ASN A 36 17.763 -9.039 -0.556 1.00 0.00 C ATOM 544 CG ASN A 36 18.713 -10.111 -0.057 1.00 0.00 C ATOM 545 OD1 ASN A 36 19.499 -9.881 0.861 1.00 0.00 O ATOM 546 ND2 ASN A 36 18.642 -11.291 -0.662 1.00 0.00 N ATOM 0 H ASN A 36 16.669 -10.045 1.419 1.00 0.00 H new ATOM 0 HA ASN A 36 17.974 -7.561 0.991 1.00 0.00 H new ATOM 0 HB2 ASN A 36 16.947 -9.508 -1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 36 18.288 -8.390 -1.257 1.00 0.00 H new ATOM 0 HD21 ASN A 36 19.255 -12.052 -0.369 1.00 0.00 H new ATOM 0 HD22 ASN A 36 17.974 -11.436 -1.419 1.00 0.00 H new ATOM 553 N VAL A 37 14.956 -7.913 -0.328 1.00 0.00 N ATOM 554 CA VAL A 37 13.817 -7.172 -0.854 1.00 0.00 C ATOM 555 C VAL A 37 13.243 -6.228 0.197 1.00 0.00 C ATOM 556 O VAL A 37 13.132 -6.583 1.370 1.00 0.00 O ATOM 557 CB VAL A 37 12.704 -8.120 -1.340 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.621 -7.343 -2.070 1.00 0.00 C ATOM 559 CG2 VAL A 37 13.283 -9.209 -2.230 1.00 0.00 C ATOM 0 H VAL A 37 14.816 -8.922 -0.279 1.00 0.00 H new ATOM 0 HA VAL A 37 14.182 -6.590 -1.700 1.00 0.00 H new ATOM 0 HB VAL A 37 12.251 -8.596 -0.470 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.844 -8.030 -2.406 1.00 0.00 H new ATOM 0 HG12 VAL A 37 11.186 -6.604 -1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.055 -6.837 -2.932 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.483 -9.869 -2.564 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.763 -8.754 -3.096 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.018 -9.785 -1.668 1.00 0.00 H new ATOM 569 N ILE A 38 12.877 -5.025 -0.233 1.00 0.00 N ATOM 570 CA ILE A 38 12.314 -4.029 0.671 1.00 0.00 C ATOM 571 C ILE A 38 10.988 -3.493 0.137 1.00 0.00 C ATOM 572 O ILE A 38 10.887 -3.105 -1.026 1.00 0.00 O ATOM 573 CB ILE A 38 13.288 -2.853 0.887 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.722 -1.872 1.917 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.568 -2.143 -0.430 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.768 -1.310 2.854 1.00 0.00 C ATOM 0 H ILE A 38 12.960 -4.716 -1.202 1.00 0.00 H new ATOM 0 HA ILE A 38 12.142 -4.525 1.626 1.00 0.00 H new ATOM 0 HB ILE A 38 14.228 -3.250 1.270 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.235 -1.049 1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.954 -2.376 2.503 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.257 -1.316 -0.258 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.013 -2.846 -1.135 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.635 -1.758 -0.841 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.296 -0.623 3.556 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.239 -2.125 3.404 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.524 -0.777 2.278 1.00 0.00 H new ATOM 588 N PHE A 39 9.975 -3.474 0.998 1.00 0.00 N ATOM 589 CA PHE A 39 8.655 -2.986 0.614 1.00 0.00 C ATOM 590 C PHE A 39 8.448 -1.551 1.088 1.00 0.00 C ATOM 591 O PHE A 39 8.435 -1.280 2.289 1.00 0.00 O ATOM 592 CB PHE A 39 7.566 -3.890 1.192 1.00 0.00 C ATOM 593 CG PHE A 39 7.341 -5.144 0.397 1.00 0.00 C ATOM 594 CD1 PHE A 39 6.592 -5.117 -0.768 1.00 0.00 C ATOM 595 CD2 PHE A 39 7.880 -6.350 0.815 1.00 0.00 C ATOM 596 CE1 PHE A 39 6.384 -6.269 -1.502 1.00 0.00 C ATOM 597 CE2 PHE A 39 7.676 -7.506 0.086 1.00 0.00 C ATOM 598 CZ PHE A 39 6.927 -7.466 -1.074 1.00 0.00 C ATOM 0 H PHE A 39 10.043 -3.791 1.965 1.00 0.00 H new ATOM 0 HA PHE A 39 8.590 -3.003 -0.474 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.834 -4.160 2.213 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.632 -3.331 1.245 1.00 0.00 H new ATOM 0 HD1 PHE A 39 6.166 -4.184 -1.107 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.466 -6.387 1.721 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.798 -6.234 -2.409 1.00 0.00 H new ATOM 0 HE2 PHE A 39 8.102 -8.440 0.423 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.766 -8.368 -1.645 1.00 0.00 H new ATOM 608 N GLU A 40 8.287 -0.636 0.138 1.00 0.00 N ATOM 609 CA GLU A 40 8.081 0.771 0.459 1.00 0.00 C ATOM 610 C GLU A 40 6.645 1.193 0.163 1.00 0.00 C ATOM 611 O GLU A 40 6.257 1.335 -0.997 1.00 0.00 O ATOM 612 CB GLU A 40 9.055 1.645 -0.334 1.00 0.00 C ATOM 613 CG GLU A 40 9.284 3.015 0.282 1.00 0.00 C ATOM 614 CD GLU A 40 9.813 4.024 -0.718 1.00 0.00 C ATOM 615 OE1 GLU A 40 10.555 3.615 -1.637 1.00 0.00 O ATOM 616 OE2 GLU A 40 9.484 5.221 -0.585 1.00 0.00 O ATOM 0 H GLU A 40 8.295 -0.844 -0.861 1.00 0.00 H new ATOM 0 HA GLU A 40 8.268 0.905 1.524 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.011 1.128 -0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.674 1.771 -1.348 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.347 3.382 0.701 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.989 2.924 1.108 1.00 0.00 H new ATOM 623 N ILE A 41 5.863 1.393 1.218 1.00 0.00 N ATOM 624 CA ILE A 41 4.473 1.799 1.073 1.00 0.00 C ATOM 625 C ILE A 41 4.294 3.276 1.408 1.00 0.00 C ATOM 626 O ILE A 41 4.409 3.677 2.565 1.00 0.00 O ATOM 627 CB ILE A 41 3.544 0.963 1.974 1.00 0.00 C ATOM 628 CG1 ILE A 41 3.828 -0.532 1.797 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.086 1.272 1.665 1.00 0.00 C ATOM 630 CD1 ILE A 41 3.966 -1.279 3.104 1.00 0.00 C ATOM 0 H ILE A 41 6.170 1.280 2.184 1.00 0.00 H new ATOM 0 HA ILE A 41 4.202 1.630 0.031 1.00 0.00 H new ATOM 0 HB ILE A 41 3.739 1.228 3.013 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.023 -0.980 1.215 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.745 -0.654 1.220 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.443 0.673 2.310 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.893 2.330 1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.877 1.034 0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.166 -2.331 2.902 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.790 -0.857 3.679 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.042 -1.188 3.674 1.00 0.00 H new ATOM 642 N SER A 42 4.013 4.080 0.388 1.00 0.00 N ATOM 643 CA SER A 42 3.818 5.513 0.577 1.00 0.00 C ATOM 644 C SER A 42 2.343 5.835 0.820 1.00 0.00 C ATOM 645 O SER A 42 1.469 5.351 0.101 1.00 0.00 O ATOM 646 CB SER A 42 4.322 6.282 -0.647 1.00 0.00 C ATOM 647 OG SER A 42 5.422 5.621 -1.247 1.00 0.00 O ATOM 0 H SER A 42 3.915 3.764 -0.577 1.00 0.00 H new ATOM 0 HA SER A 42 4.389 5.820 1.453 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.516 6.385 -1.373 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.616 7.289 -0.352 1.00 0.00 H new ATOM 0 HG SER A 42 5.724 6.131 -2.027 1.00 0.00 H new ATOM 653 N PRO A 43 2.045 6.658 1.843 1.00 0.00 N ATOM 654 CA PRO A 43 0.667 7.036 2.172 1.00 0.00 C ATOM 655 C PRO A 43 0.095 8.053 1.190 1.00 0.00 C ATOM 656 O PRO A 43 0.837 8.744 0.492 1.00 0.00 O ATOM 657 CB PRO A 43 0.799 7.653 3.564 1.00 0.00 C ATOM 658 CG PRO A 43 2.182 8.205 3.599 1.00 0.00 C ATOM 659 CD PRO A 43 3.021 7.283 2.756 1.00 0.00 C ATOM 0 HA PRO A 43 -0.014 6.186 2.128 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.056 8.434 3.724 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.650 6.907 4.344 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.206 9.222 3.206 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.558 8.249 4.621 1.00 0.00 H new ATOM 0 HD2 PRO A 43 3.789 7.829 2.208 1.00 0.00 H new ATOM 0 HD3 PRO A 43 3.533 6.538 3.365 1.00 0.00 H new ATOM 667 N THR A 44 -1.231 8.140 1.143 1.00 0.00 N ATOM 668 CA THR A 44 -1.903 9.075 0.248 1.00 0.00 C ATOM 669 C THR A 44 -2.566 10.201 1.035 1.00 0.00 C ATOM 670 O THR A 44 -2.606 10.171 2.264 1.00 0.00 O ATOM 671 CB THR A 44 -2.949 8.342 -0.595 1.00 0.00 C ATOM 672 OG1 THR A 44 -3.973 7.811 0.227 1.00 0.00 O ATOM 673 CG2 THR A 44 -2.373 7.202 -1.406 1.00 0.00 C ATOM 0 H THR A 44 -1.860 7.575 1.713 1.00 0.00 H new ATOM 0 HA THR A 44 -1.153 9.511 -0.412 1.00 0.00 H new ATOM 0 HB THR A 44 -3.343 9.091 -1.282 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.695 6.937 0.572 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.168 6.726 -1.980 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.614 7.587 -2.087 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.921 6.471 -0.736 1.00 0.00 H new ATOM 681 N GLU A 45 -3.084 11.192 0.318 1.00 0.00 N ATOM 682 CA GLU A 45 -3.745 12.328 0.950 1.00 0.00 C ATOM 683 C GLU A 45 -5.131 11.938 1.454 1.00 0.00 C ATOM 684 O GLU A 45 -5.610 12.468 2.456 1.00 0.00 O ATOM 685 CB GLU A 45 -3.855 13.494 -0.034 1.00 0.00 C ATOM 686 CG GLU A 45 -2.710 14.487 0.070 1.00 0.00 C ATOM 687 CD GLU A 45 -3.072 15.855 -0.477 1.00 0.00 C ATOM 688 OE1 GLU A 45 -3.550 15.926 -1.628 1.00 0.00 O ATOM 689 OE2 GLU A 45 -2.878 16.854 0.247 1.00 0.00 O ATOM 0 H GLU A 45 -3.059 11.232 -0.701 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.142 12.639 1.803 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.892 13.099 -1.049 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -4.796 14.017 0.139 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.412 14.584 1.114 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.848 14.100 -0.472 1.00 0.00 H new ATOM 696 N GLU A 46 -5.771 11.008 0.752 1.00 0.00 N ATOM 697 CA GLU A 46 -7.102 10.547 1.128 1.00 0.00 C ATOM 698 C GLU A 46 -7.030 9.201 1.842 1.00 0.00 C ATOM 699 O GLU A 46 -6.070 8.448 1.674 1.00 0.00 O ATOM 700 CB GLU A 46 -7.996 10.437 -0.110 1.00 0.00 C ATOM 701 CG GLU A 46 -8.951 11.608 -0.277 1.00 0.00 C ATOM 702 CD GLU A 46 -10.161 11.505 0.630 1.00 0.00 C ATOM 703 OE1 GLU A 46 -10.083 11.983 1.781 1.00 0.00 O ATOM 704 OE2 GLU A 46 -11.188 10.948 0.189 1.00 0.00 O ATOM 0 H GLU A 46 -5.389 10.559 -0.080 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.533 11.277 1.813 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.367 10.363 -0.997 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.573 9.514 -0.050 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.421 12.537 -0.067 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.282 11.658 -1.314 1.00 0.00 H new ATOM 711 N VAL A 47 -8.051 8.903 2.639 1.00 0.00 N ATOM 712 CA VAL A 47 -8.104 7.649 3.377 1.00 0.00 C ATOM 713 C VAL A 47 -8.624 6.515 2.498 1.00 0.00 C ATOM 714 O VAL A 47 -9.467 6.729 1.626 1.00 0.00 O ATOM 715 CB VAL A 47 -8.997 7.770 4.628 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.427 8.111 4.238 1.00 0.00 C ATOM 717 CG2 VAL A 47 -8.950 6.488 5.448 1.00 0.00 C ATOM 0 H VAL A 47 -8.853 9.515 2.790 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.085 7.422 3.690 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.612 8.582 5.245 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.040 8.192 5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.442 9.060 3.702 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.826 7.326 3.596 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.587 6.594 6.326 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.305 5.655 4.841 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.925 6.296 5.764 1.00 0.00 H new ATOM 727 N GLY A 48 -8.115 5.310 2.730 1.00 0.00 N ATOM 728 CA GLY A 48 -8.540 4.162 1.951 1.00 0.00 C ATOM 729 C GLY A 48 -7.593 3.857 0.807 1.00 0.00 C ATOM 730 O GLY A 48 -7.437 2.701 0.412 1.00 0.00 O ATOM 0 H GLY A 48 -7.415 5.108 3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.611 3.291 2.602 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.538 4.345 1.554 1.00 0.00 H new ATOM 734 N ASP A 49 -6.960 4.896 0.272 1.00 0.00 N ATOM 735 CA ASP A 49 -6.024 4.735 -0.835 1.00 0.00 C ATOM 736 C ASP A 49 -4.592 4.616 -0.323 1.00 0.00 C ATOM 737 O ASP A 49 -4.179 5.353 0.572 1.00 0.00 O ATOM 738 CB ASP A 49 -6.135 5.915 -1.801 1.00 0.00 C ATOM 739 CG ASP A 49 -7.554 6.126 -2.294 1.00 0.00 C ATOM 740 OD1 ASP A 49 -8.337 5.154 -2.284 1.00 0.00 O ATOM 741 OD2 ASP A 49 -7.881 7.265 -2.691 1.00 0.00 O ATOM 0 H ASP A 49 -7.078 5.859 0.587 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.280 3.817 -1.363 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.787 6.821 -1.305 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.478 5.746 -2.654 1.00 0.00 H new ATOM 746 N PHE A 50 -3.840 3.683 -0.896 1.00 0.00 N ATOM 747 CA PHE A 50 -2.453 3.467 -0.499 1.00 0.00 C ATOM 748 C PHE A 50 -1.533 3.466 -1.716 1.00 0.00 C ATOM 749 O PHE A 50 -1.996 3.509 -2.855 1.00 0.00 O ATOM 750 CB PHE A 50 -2.318 2.145 0.260 1.00 0.00 C ATOM 751 CG PHE A 50 -3.229 2.041 1.449 1.00 0.00 C ATOM 752 CD1 PHE A 50 -2.988 2.786 2.591 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.328 1.196 1.423 1.00 0.00 C ATOM 754 CE1 PHE A 50 -3.826 2.692 3.687 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.168 1.097 2.516 1.00 0.00 C ATOM 756 CZ PHE A 50 -4.917 1.846 3.649 1.00 0.00 C ATOM 0 H PHE A 50 -4.167 3.064 -1.637 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.156 4.286 0.157 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.528 1.321 -0.422 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.286 2.029 0.592 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.136 3.448 2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.530 0.609 0.539 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.628 3.279 4.571 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.020 0.434 2.484 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.573 1.770 4.504 1.00 0.00 H new ATOM 766 N GLU A 51 -0.229 3.417 -1.466 1.00 0.00 N ATOM 767 CA GLU A 51 0.756 3.410 -2.542 1.00 0.00 C ATOM 768 C GLU A 51 1.848 2.379 -2.276 1.00 0.00 C ATOM 769 O GLU A 51 2.730 2.595 -1.444 1.00 0.00 O ATOM 770 CB GLU A 51 1.377 4.799 -2.699 1.00 0.00 C ATOM 771 CG GLU A 51 1.680 5.170 -4.142 1.00 0.00 C ATOM 772 CD GLU A 51 1.315 6.606 -4.463 1.00 0.00 C ATOM 773 OE1 GLU A 51 1.251 7.427 -3.524 1.00 0.00 O ATOM 774 OE2 GLU A 51 1.093 6.910 -5.654 1.00 0.00 O ATOM 0 H GLU A 51 0.171 3.382 -0.528 1.00 0.00 H new ATOM 0 HA GLU A 51 0.246 3.139 -3.466 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.699 5.541 -2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.299 4.843 -2.120 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.741 5.016 -4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.133 4.502 -4.808 1.00 0.00 H new ATOM 781 N VAL A 52 1.784 1.258 -2.988 1.00 0.00 N ATOM 782 CA VAL A 52 2.768 0.195 -2.829 1.00 0.00 C ATOM 783 C VAL A 52 3.905 0.346 -3.833 1.00 0.00 C ATOM 784 O VAL A 52 3.675 0.607 -5.013 1.00 0.00 O ATOM 785 CB VAL A 52 2.126 -1.197 -3.001 1.00 0.00 C ATOM 786 CG1 VAL A 52 3.129 -2.293 -2.673 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.882 -1.324 -2.133 1.00 0.00 C ATOM 0 H VAL A 52 1.061 1.063 -3.680 1.00 0.00 H new ATOM 0 HA VAL A 52 3.165 0.280 -1.818 1.00 0.00 H new ATOM 0 HB VAL A 52 1.826 -1.311 -4.043 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.658 -3.268 -2.800 1.00 0.00 H new ATOM 0 HG12 VAL A 52 3.986 -2.214 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.463 -2.183 -1.641 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.443 -2.313 -2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.153 -1.187 -1.086 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.157 -0.563 -2.422 1.00 0.00 H new ATOM 797 N LYS A 53 5.135 0.181 -3.355 1.00 0.00 N ATOM 798 CA LYS A 53 6.310 0.299 -4.210 1.00 0.00 C ATOM 799 C LYS A 53 7.304 -0.824 -3.930 1.00 0.00 C ATOM 800 O LYS A 53 8.008 -0.806 -2.920 1.00 0.00 O ATOM 801 CB LYS A 53 6.983 1.657 -4.000 1.00 0.00 C ATOM 802 CG LYS A 53 8.231 1.857 -4.846 1.00 0.00 C ATOM 803 CD LYS A 53 8.945 3.150 -4.487 1.00 0.00 C ATOM 804 CE LYS A 53 8.129 4.368 -4.888 1.00 0.00 C ATOM 805 NZ LYS A 53 8.674 5.622 -4.298 1.00 0.00 N ATOM 0 H LYS A 53 5.343 -0.035 -2.380 1.00 0.00 H new ATOM 0 HA LYS A 53 5.984 0.218 -5.247 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.268 2.447 -4.231 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.247 1.763 -2.948 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.908 1.015 -4.703 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.958 1.871 -5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.135 3.176 -3.414 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.915 3.181 -4.984 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.116 4.454 -5.975 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.096 4.235 -4.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 8.089 6.429 -4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.663 5.551 -3.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.651 5.764 -4.625 1.00 0.00 H new ATOM 819 N ALA A 54 7.356 -1.800 -4.831 1.00 0.00 N ATOM 820 CA ALA A 54 8.264 -2.931 -4.681 1.00 0.00 C ATOM 821 C ALA A 54 9.197 -3.047 -5.881 1.00 0.00 C ATOM 822 O ALA A 54 8.815 -3.565 -6.930 1.00 0.00 O ATOM 823 CB ALA A 54 7.475 -4.219 -4.496 1.00 0.00 C ATOM 0 H ALA A 54 6.780 -1.830 -5.672 1.00 0.00 H new ATOM 0 HA ALA A 54 8.875 -2.762 -3.794 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.165 -5.056 -4.385 1.00 0.00 H new ATOM 0 HB2 ALA A 54 6.854 -4.140 -3.604 1.00 0.00 H new ATOM 0 HB3 ALA A 54 6.840 -4.385 -5.366 1.00 0.00 H new ATOM 829 N LYS A 55 10.424 -2.561 -5.718 1.00 0.00 N ATOM 830 CA LYS A 55 11.414 -2.609 -6.788 1.00 0.00 C ATOM 831 C LYS A 55 12.827 -2.655 -6.219 1.00 0.00 C ATOM 832 O LYS A 55 13.079 -2.169 -5.117 1.00 0.00 O ATOM 833 CB LYS A 55 11.261 -1.396 -7.708 1.00 0.00 C ATOM 834 CG LYS A 55 11.172 -0.075 -6.962 1.00 0.00 C ATOM 835 CD LYS A 55 10.334 0.940 -7.722 1.00 0.00 C ATOM 836 CE LYS A 55 8.877 0.512 -7.802 1.00 0.00 C ATOM 837 NZ LYS A 55 7.992 1.632 -8.223 1.00 0.00 N ATOM 0 H LYS A 55 10.756 -2.130 -4.855 1.00 0.00 H new ATOM 0 HA LYS A 55 11.244 -3.518 -7.366 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.108 -1.361 -8.393 1.00 0.00 H new ATOM 0 HB3 LYS A 55 10.365 -1.522 -8.316 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.738 -0.241 -5.976 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.174 0.324 -6.806 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.403 1.911 -7.231 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.734 1.063 -8.728 1.00 0.00 H new ATOM 0 HE2 LYS A 55 8.779 -0.313 -8.508 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.554 0.140 -6.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.014 1.430 -7.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 8.311 2.514 -7.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.032 1.736 -9.257 1.00 0.00 H new ATOM 851 N PHE A 56 13.747 -3.242 -6.978 1.00 0.00 N ATOM 852 CA PHE A 56 15.136 -3.350 -6.548 1.00 0.00 C ATOM 853 C PHE A 56 15.853 -2.011 -6.688 1.00 0.00 C ATOM 854 O PHE A 56 16.411 -1.490 -5.723 1.00 0.00 O ATOM 855 CB PHE A 56 15.863 -4.420 -7.364 1.00 0.00 C ATOM 856 CG PHE A 56 16.854 -5.217 -6.563 1.00 0.00 C ATOM 857 CD1 PHE A 56 16.429 -6.035 -5.528 1.00 0.00 C ATOM 858 CD2 PHE A 56 18.209 -5.147 -6.846 1.00 0.00 C ATOM 859 CE1 PHE A 56 17.338 -6.769 -4.790 1.00 0.00 C ATOM 860 CE2 PHE A 56 19.122 -5.879 -6.110 1.00 0.00 C ATOM 861 CZ PHE A 56 18.686 -6.691 -5.082 1.00 0.00 C ATOM 0 H PHE A 56 13.556 -3.650 -7.893 1.00 0.00 H new ATOM 0 HA PHE A 56 15.144 -3.638 -5.497 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.127 -5.099 -7.795 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.381 -3.942 -8.195 1.00 0.00 H new ATOM 0 HD1 PHE A 56 15.376 -6.099 -5.296 1.00 0.00 H new ATOM 0 HD2 PHE A 56 18.555 -4.514 -7.650 1.00 0.00 H new ATOM 0 HE1 PHE A 56 16.995 -7.403 -3.986 1.00 0.00 H new ATOM 0 HE2 PHE A 56 20.176 -5.816 -6.339 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.398 -7.264 -4.507 1.00 0.00 H new ATOM 871 N MET A 57 15.834 -1.460 -7.898 1.00 0.00 N ATOM 872 CA MET A 57 16.483 -0.181 -8.166 1.00 0.00 C ATOM 873 C MET A 57 15.456 0.885 -8.534 1.00 0.00 C ATOM 874 O MET A 57 15.628 2.061 -8.215 1.00 0.00 O ATOM 875 CB MET A 57 17.505 -0.331 -9.294 1.00 0.00 C ATOM 876 CG MET A 57 16.952 -1.025 -10.528 1.00 0.00 C ATOM 877 SD MET A 57 17.185 -2.812 -10.483 1.00 0.00 S ATOM 878 CE MET A 57 15.531 -3.379 -10.870 1.00 0.00 C ATOM 0 H MET A 57 15.377 -1.879 -8.708 1.00 0.00 H new ATOM 0 HA MET A 57 16.997 0.134 -7.258 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.870 0.657 -9.576 1.00 0.00 H new ATOM 0 HB3 MET A 57 18.362 -0.894 -8.924 1.00 0.00 H new ATOM 0 HG2 MET A 57 15.889 -0.803 -10.619 1.00 0.00 H new ATOM 0 HG3 MET A 57 17.439 -0.621 -11.416 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.586 -4.344 -11.374 1.00 0.00 H new ATOM 0 HE2 MET A 57 14.957 -3.482 -9.949 1.00 0.00 H new ATOM 0 HE3 MET A 57 15.042 -2.656 -11.523 1.00 0.00 H new ATOM 888 N GLY A 58 14.389 0.467 -9.206 1.00 0.00 N ATOM 889 CA GLY A 58 13.352 1.401 -9.606 1.00 0.00 C ATOM 890 C GLY A 58 13.692 2.126 -10.893 1.00 0.00 C ATOM 891 O GLY A 58 14.441 3.103 -10.883 1.00 0.00 O ATOM 0 H GLY A 58 14.223 -0.501 -9.481 1.00 0.00 H new ATOM 0 HA2 GLY A 58 12.412 0.864 -9.732 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.198 2.131 -8.811 1.00 0.00 H new ATOM 895 N VAL A 59 13.140 1.648 -12.003 1.00 0.00 N ATOM 896 CA VAL A 59 13.390 2.256 -13.304 1.00 0.00 C ATOM 897 C VAL A 59 12.118 2.875 -13.875 1.00 0.00 C ATOM 898 O VAL A 59 12.142 3.981 -14.415 1.00 0.00 O ATOM 899 CB VAL A 59 13.946 1.225 -14.307 1.00 0.00 C ATOM 900 CG1 VAL A 59 12.947 0.100 -14.531 1.00 0.00 C ATOM 901 CG2 VAL A 59 14.309 1.898 -15.622 1.00 0.00 C ATOM 0 H VAL A 59 12.516 0.841 -12.027 1.00 0.00 H new ATOM 0 HA VAL A 59 14.133 3.039 -13.152 1.00 0.00 H new ATOM 0 HB VAL A 59 14.853 0.792 -13.886 1.00 0.00 H new ATOM 0 HG11 VAL A 59 13.359 -0.616 -15.242 1.00 0.00 H new ATOM 0 HG12 VAL A 59 12.746 -0.402 -13.585 1.00 0.00 H new ATOM 0 HG13 VAL A 59 12.019 0.511 -14.927 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.699 1.154 -16.316 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.421 2.363 -16.050 1.00 0.00 H new ATOM 0 HG23 VAL A 59 15.067 2.660 -15.443 1.00 0.00 H new ATOM 911 N GLN A 60 11.007 2.156 -13.752 1.00 0.00 N ATOM 912 CA GLN A 60 9.726 2.635 -14.256 1.00 0.00 C ATOM 913 C GLN A 60 9.149 3.714 -13.345 1.00 0.00 C ATOM 914 O GLN A 60 9.488 3.789 -12.164 1.00 0.00 O ATOM 915 CB GLN A 60 8.737 1.475 -14.382 1.00 0.00 C ATOM 916 CG GLN A 60 7.840 1.569 -15.605 1.00 0.00 C ATOM 917 CD GLN A 60 6.560 0.772 -15.454 1.00 0.00 C ATOM 918 OE1 GLN A 60 6.040 0.614 -14.349 1.00 0.00 O ATOM 919 NE2 GLN A 60 6.044 0.263 -16.566 1.00 0.00 N ATOM 0 H GLN A 60 10.969 1.239 -13.307 1.00 0.00 H new ATOM 0 HA GLN A 60 9.893 3.070 -15.241 1.00 0.00 H new ATOM 0 HB2 GLN A 60 9.292 0.538 -14.421 1.00 0.00 H new ATOM 0 HB3 GLN A 60 8.115 1.440 -13.488 1.00 0.00 H new ATOM 0 HG2 GLN A 60 7.593 2.614 -15.790 1.00 0.00 H new ATOM 0 HG3 GLN A 60 8.385 1.211 -16.479 1.00 0.00 H new ATOM 0 HE21 GLN A 60 6.508 0.418 -17.461 1.00 0.00 H new ATOM 0 HE22 GLN A 60 5.184 -0.283 -16.525 1.00 0.00 H new ATOM 928 N MET A 61 8.277 4.548 -13.902 1.00 0.00 N ATOM 929 CA MET A 61 7.652 5.623 -13.140 1.00 0.00 C ATOM 930 C MET A 61 6.228 5.248 -12.741 1.00 0.00 C ATOM 931 O MET A 61 5.780 4.126 -12.980 1.00 0.00 O ATOM 932 CB MET A 61 7.641 6.916 -13.960 1.00 0.00 C ATOM 933 CG MET A 61 8.833 7.819 -13.684 1.00 0.00 C ATOM 934 SD MET A 61 8.701 8.682 -12.107 1.00 0.00 S ATOM 935 CE MET A 61 9.861 10.024 -12.357 1.00 0.00 C ATOM 0 H MET A 61 7.987 4.500 -14.879 1.00 0.00 H new ATOM 0 HA MET A 61 8.235 5.781 -12.233 1.00 0.00 H new ATOM 0 HB2 MET A 61 7.624 6.664 -15.020 1.00 0.00 H new ATOM 0 HB3 MET A 61 6.723 7.464 -13.747 1.00 0.00 H new ATOM 0 HG2 MET A 61 9.745 7.222 -13.692 1.00 0.00 H new ATOM 0 HG3 MET A 61 8.923 8.550 -14.487 1.00 0.00 H new ATOM 0 HE1 MET A 61 9.892 10.649 -11.465 1.00 0.00 H new ATOM 0 HE2 MET A 61 10.853 9.616 -12.549 1.00 0.00 H new ATOM 0 HE3 MET A 61 9.545 10.624 -13.210 1.00 0.00 H new ATOM 945 N GLU A 62 5.521 6.193 -12.129 1.00 0.00 N ATOM 946 CA GLU A 62 4.146 5.962 -11.696 1.00 0.00 C ATOM 947 C GLU A 62 4.091 4.882 -10.619 1.00 0.00 C ATOM 948 O GLU A 62 4.259 3.696 -10.904 1.00 0.00 O ATOM 949 CB GLU A 62 3.272 5.562 -12.888 1.00 0.00 C ATOM 950 CG GLU A 62 2.065 6.463 -13.086 1.00 0.00 C ATOM 951 CD GLU A 62 2.329 7.579 -14.079 1.00 0.00 C ATOM 952 OE1 GLU A 62 2.328 7.303 -15.297 1.00 0.00 O ATOM 953 OE2 GLU A 62 2.536 8.729 -13.638 1.00 0.00 O ATOM 0 H GLU A 62 5.877 7.126 -11.921 1.00 0.00 H new ATOM 0 HA GLU A 62 3.762 6.890 -11.273 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.878 5.577 -13.794 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.930 4.536 -12.750 1.00 0.00 H new ATOM 0 HG2 GLU A 62 1.222 5.865 -13.432 1.00 0.00 H new ATOM 0 HG3 GLU A 62 1.777 6.895 -12.127 1.00 0.00 H new ATOM 960 N THR A 63 3.853 5.301 -9.380 1.00 0.00 N ATOM 961 CA THR A 63 3.774 4.371 -8.260 1.00 0.00 C ATOM 962 C THR A 63 2.461 3.596 -8.287 1.00 0.00 C ATOM 963 O THR A 63 1.458 4.072 -8.819 1.00 0.00 O ATOM 964 CB THR A 63 3.907 5.122 -6.935 1.00 0.00 C ATOM 965 OG1 THR A 63 4.585 6.352 -7.121 1.00 0.00 O ATOM 966 CG2 THR A 63 4.657 4.342 -5.877 1.00 0.00 C ATOM 0 H THR A 63 3.712 6.279 -9.127 1.00 0.00 H new ATOM 0 HA THR A 63 4.596 3.662 -8.352 1.00 0.00 H new ATOM 0 HB THR A 63 2.885 5.281 -6.591 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.658 6.818 -6.262 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.715 4.932 -4.963 1.00 0.00 H new ATOM 0 HG22 THR A 63 4.133 3.408 -5.673 1.00 0.00 H new ATOM 0 HG23 THR A 63 5.664 4.123 -6.232 1.00 0.00 H new ATOM 974 N PHE A 64 2.474 2.398 -7.711 1.00 0.00 N ATOM 975 CA PHE A 64 1.284 1.557 -7.668 1.00 0.00 C ATOM 976 C PHE A 64 0.397 1.931 -6.485 1.00 0.00 C ATOM 977 O PHE A 64 0.888 2.197 -5.387 1.00 0.00 O ATOM 978 CB PHE A 64 1.679 0.082 -7.579 1.00 0.00 C ATOM 979 CG PHE A 64 0.507 -0.857 -7.644 1.00 0.00 C ATOM 980 CD1 PHE A 64 -0.416 -0.763 -8.672 1.00 0.00 C ATOM 981 CD2 PHE A 64 0.333 -1.834 -6.677 1.00 0.00 C ATOM 982 CE1 PHE A 64 -1.494 -1.626 -8.734 1.00 0.00 C ATOM 983 CE2 PHE A 64 -0.743 -2.700 -6.734 1.00 0.00 C ATOM 984 CZ PHE A 64 -1.658 -2.595 -7.763 1.00 0.00 C ATOM 0 H PHE A 64 3.296 1.988 -7.268 1.00 0.00 H new ATOM 0 HA PHE A 64 0.721 1.719 -8.587 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.367 -0.151 -8.392 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.218 -0.086 -6.647 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.292 -0.007 -9.434 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.046 -1.920 -5.870 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.207 -1.543 -9.541 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.868 -3.458 -5.975 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.500 -3.269 -7.809 1.00 0.00 H new ATOM 994 N MET A 65 -0.911 1.949 -6.715 1.00 0.00 N ATOM 995 CA MET A 65 -1.867 2.291 -5.669 1.00 0.00 C ATOM 996 C MET A 65 -2.769 1.103 -5.345 1.00 0.00 C ATOM 997 O MET A 65 -3.268 0.427 -6.246 1.00 0.00 O ATOM 998 CB MET A 65 -2.718 3.488 -6.097 1.00 0.00 C ATOM 999 CG MET A 65 -2.073 4.831 -5.792 1.00 0.00 C ATOM 1000 SD MET A 65 -3.270 6.073 -5.266 1.00 0.00 S ATOM 1001 CE MET A 65 -2.670 7.514 -6.144 1.00 0.00 C ATOM 0 H MET A 65 -1.334 1.731 -7.617 1.00 0.00 H new ATOM 0 HA MET A 65 -1.306 2.554 -4.772 1.00 0.00 H new ATOM 0 HB2 MET A 65 -2.912 3.422 -7.168 1.00 0.00 H new ATOM 0 HB3 MET A 65 -3.684 3.435 -5.594 1.00 0.00 H new ATOM 0 HG2 MET A 65 -1.324 4.701 -5.011 1.00 0.00 H new ATOM 0 HG3 MET A 65 -1.550 5.189 -6.679 1.00 0.00 H new ATOM 0 HE1 MET A 65 -3.309 8.368 -5.920 1.00 0.00 H new ATOM 0 HE2 MET A 65 -1.649 7.732 -5.830 1.00 0.00 H new ATOM 0 HE3 MET A 65 -2.686 7.320 -7.216 1.00 0.00 H new ATOM 1011 N LEU A 66 -2.971 0.854 -4.056 1.00 0.00 N ATOM 1012 CA LEU A 66 -3.811 -0.252 -3.613 1.00 0.00 C ATOM 1013 C LEU A 66 -5.149 0.258 -3.087 1.00 0.00 C ATOM 1014 O LEU A 66 -5.193 1.099 -2.189 1.00 0.00 O ATOM 1015 CB LEU A 66 -3.097 -1.060 -2.529 1.00 0.00 C ATOM 1016 CG LEU A 66 -3.749 -2.401 -2.186 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -3.617 -3.372 -3.348 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -3.128 -2.987 -0.926 1.00 0.00 C ATOM 0 H LEU A 66 -2.564 1.404 -3.299 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.001 -0.898 -4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.072 -1.243 -2.850 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.044 -0.457 -1.623 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.810 -2.231 -2.001 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.087 -4.320 -3.085 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.108 -2.956 -4.228 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.562 -3.538 -3.566 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.603 -3.941 -0.696 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.061 -3.142 -1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.275 -2.298 -0.094 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.237 -0.257 -3.651 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.575 0.147 -3.238 1.00 0.00 C ATOM 1032 C HIS A 67 -8.000 -0.590 -1.971 1.00 0.00 C ATOM 1033 O HIS A 67 -7.501 -1.676 -1.677 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.580 -0.124 -4.360 1.00 0.00 C ATOM 1035 CG HIS A 67 -8.424 0.789 -5.536 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -7.311 0.784 -6.350 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -9.248 1.741 -6.035 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -7.457 1.693 -7.298 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -8.624 2.287 -7.129 1.00 0.00 N ATOM 0 H HIS A 67 -6.218 -0.955 -4.395 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.556 1.216 -3.026 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.470 -1.156 -4.694 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.590 -0.023 -3.964 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -10.216 2.019 -5.645 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -6.743 1.913 -8.078 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -9.001 3.031 -7.716 1.00 0.00 H new ATOM 1048 N TYR A 68 -8.923 0.009 -1.227 1.00 0.00 N ATOM 1049 CA TYR A 68 -9.414 -0.590 0.009 1.00 0.00 C ATOM 1050 C TYR A 68 -10.599 -1.510 -0.267 1.00 0.00 C ATOM 1051 O TYR A 68 -10.741 -2.560 0.360 1.00 0.00 O ATOM 1052 CB TYR A 68 -9.820 0.499 1.003 1.00 0.00 C ATOM 1053 CG TYR A 68 -9.971 -0.002 2.422 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -8.863 -0.402 3.159 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -11.221 -0.074 3.024 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -8.997 -0.860 4.456 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -11.363 -0.530 4.320 1.00 0.00 C ATOM 1058 CZ TYR A 68 -10.249 -0.922 5.033 1.00 0.00 C ATOM 1059 OH TYR A 68 -10.386 -1.377 6.323 1.00 0.00 O ATOM 0 H TYR A 68 -9.346 0.908 -1.458 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.608 -1.183 0.441 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.073 1.293 0.984 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.763 0.941 0.680 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.881 -0.354 2.711 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -12.096 0.232 2.470 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -8.126 -1.168 5.015 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -12.342 -0.579 4.773 1.00 0.00 H new ATOM 0 HH TYR A 68 -11.332 -1.357 6.578 1.00 0.00 H new ATOM 1069 N GLN A 69 -11.447 -1.109 -1.208 1.00 0.00 N ATOM 1070 CA GLN A 69 -12.620 -1.898 -1.566 1.00 0.00 C ATOM 1071 C GLN A 69 -12.212 -3.249 -2.143 1.00 0.00 C ATOM 1072 O GLN A 69 -12.864 -4.264 -1.896 1.00 0.00 O ATOM 1073 CB GLN A 69 -13.481 -1.139 -2.577 1.00 0.00 C ATOM 1074 CG GLN A 69 -14.489 -0.199 -1.935 1.00 0.00 C ATOM 1075 CD GLN A 69 -13.862 1.102 -1.476 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -14.066 2.152 -2.084 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -13.092 1.039 -0.394 1.00 0.00 N ATOM 0 H GLN A 69 -11.344 -0.243 -1.736 1.00 0.00 H new ATOM 0 HA GLN A 69 -13.201 -2.071 -0.660 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -12.831 -0.565 -3.237 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -14.013 -1.858 -3.200 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -15.284 0.017 -2.648 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -14.952 -0.696 -1.082 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -12.950 0.147 0.080 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -12.643 1.883 -0.037 1.00 0.00 H new ATOM 1086 N ASP A 70 -11.128 -3.256 -2.913 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.632 -4.484 -3.524 1.00 0.00 C ATOM 1088 C ASP A 70 -10.227 -5.498 -2.460 1.00 0.00 C ATOM 1089 O ASP A 70 -10.469 -6.696 -2.605 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.442 -4.180 -4.435 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.870 -3.805 -5.841 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -10.222 -2.627 -6.060 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -9.851 -4.690 -6.723 1.00 0.00 O ATOM 0 H ASP A 70 -10.577 -2.425 -3.128 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.437 -4.914 -4.120 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.859 -3.365 -4.006 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.789 -5.051 -4.477 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.609 -5.009 -1.389 1.00 0.00 N ATOM 1099 CA LEU A 71 -9.170 -5.873 -0.300 1.00 0.00 C ATOM 1100 C LEU A 71 -10.363 -6.516 0.399 1.00 0.00 C ATOM 1101 O LEU A 71 -10.418 -7.735 0.560 1.00 0.00 O ATOM 1102 CB LEU A 71 -8.342 -5.075 0.710 1.00 0.00 C ATOM 1103 CG LEU A 71 -7.025 -4.516 0.170 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -6.370 -3.606 1.197 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -6.086 -5.649 -0.217 1.00 0.00 C ATOM 0 H LEU A 71 -9.401 -4.020 -1.253 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.551 -6.663 -0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.947 -4.246 1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.124 -5.715 1.565 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.240 -3.927 -0.721 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.434 -3.218 0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.038 -2.776 1.427 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.167 -4.171 2.107 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.153 -5.234 -0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.878 -6.264 0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.553 -6.262 -0.988 1.00 0.00 H new ATOM 1117 N LEU A 72 -11.316 -5.689 0.814 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.509 -6.177 1.496 1.00 0.00 C ATOM 1119 C LEU A 72 -13.296 -7.130 0.602 1.00 0.00 C ATOM 1120 O LEU A 72 -13.915 -8.078 1.082 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.397 -5.004 1.917 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.770 -4.050 2.935 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.679 -2.854 3.175 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.486 -4.776 4.241 1.00 0.00 C ATOM 0 H LEU A 72 -11.286 -4.677 0.690 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.191 -6.721 2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.667 -4.435 1.027 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.322 -5.400 2.335 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.825 -3.687 2.531 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -13.217 -2.186 3.902 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.833 -2.320 2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.640 -3.198 3.558 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.040 -4.082 4.954 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -13.418 -5.167 4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.796 -5.600 4.057 1.00 0.00 H new ATOM 1136 N GLN A 73 -13.265 -6.870 -0.701 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.975 -7.705 -1.664 1.00 0.00 C ATOM 1138 C GLN A 73 -13.468 -9.142 -1.615 1.00 0.00 C ATOM 1139 O GLN A 73 -14.218 -10.086 -1.864 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.814 -7.141 -3.077 1.00 0.00 C ATOM 1141 CG GLN A 73 -15.091 -7.189 -3.900 1.00 0.00 C ATOM 1142 CD GLN A 73 -15.408 -8.583 -4.402 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -14.561 -9.250 -4.996 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -16.636 -9.032 -4.165 1.00 0.00 N ATOM 0 H GLN A 73 -12.756 -6.088 -1.114 1.00 0.00 H new ATOM 0 HA GLN A 73 -15.032 -7.703 -1.399 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.473 -6.108 -3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -13.036 -7.700 -3.596 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -15.922 -6.827 -3.295 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -14.997 -6.513 -4.750 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -17.307 -8.445 -3.669 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -16.908 -9.963 -4.479 1.00 0.00 H new ATOM 1153 N LEU A 74 -12.188 -9.302 -1.294 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.580 -10.624 -1.214 1.00 0.00 C ATOM 1155 C LEU A 74 -12.108 -11.393 -0.007 1.00 0.00 C ATOM 1156 O LEU A 74 -12.421 -12.580 -0.103 1.00 0.00 O ATOM 1157 CB LEU A 74 -10.056 -10.504 -1.128 1.00 0.00 C ATOM 1158 CG LEU A 74 -9.398 -9.765 -2.295 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.999 -9.306 -1.914 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -9.352 -10.652 -3.530 1.00 0.00 C ATOM 0 H LEU A 74 -11.552 -8.532 -1.085 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.845 -11.173 -2.118 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.799 -9.991 -0.201 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.631 -11.506 -1.066 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.997 -8.884 -2.527 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.546 -8.782 -2.756 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -8.057 -8.634 -1.058 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.390 -10.172 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.881 -10.110 -4.350 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.776 -11.551 -3.311 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.366 -10.931 -3.815 1.00 0.00 H new ATOM 1172 N GLN A 75 -12.204 -10.709 1.129 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.694 -11.328 2.355 1.00 0.00 C ATOM 1174 C GLN A 75 -14.118 -11.843 2.173 1.00 0.00 C ATOM 1175 O GLN A 75 -14.511 -12.837 2.784 1.00 0.00 O ATOM 1176 CB GLN A 75 -12.645 -10.326 3.511 1.00 0.00 C ATOM 1177 CG GLN A 75 -12.292 -10.957 4.847 1.00 0.00 C ATOM 1178 CD GLN A 75 -11.981 -9.926 5.915 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -12.582 -9.925 6.989 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -11.036 -9.039 5.622 1.00 0.00 N ATOM 0 H GLN A 75 -11.949 -9.726 1.226 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.048 -12.174 2.589 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.913 -9.552 3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -13.614 -9.834 3.596 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -13.121 -11.581 5.180 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.431 -11.613 4.719 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.563 -9.077 4.719 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -10.783 -8.320 6.300 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.886 -11.161 1.330 1.00 0.00 N ATOM 1190 CA TYR A 76 -16.267 -11.551 1.068 1.00 0.00 C ATOM 1191 C TYR A 76 -16.323 -12.854 0.278 1.00 0.00 C ATOM 1192 O TYR A 76 -17.120 -13.742 0.581 1.00 0.00 O ATOM 1193 CB TYR A 76 -16.994 -10.444 0.303 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.480 -10.684 0.158 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -19.304 -10.751 1.274 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -19.058 -10.845 -1.096 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -20.663 -10.971 1.145 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.415 -11.065 -1.232 1.00 0.00 C ATOM 1199 CZ TYR A 76 -21.213 -11.127 -0.110 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.565 -11.346 -0.242 1.00 0.00 O ATOM 0 H TYR A 76 -14.576 -10.336 0.817 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.763 -11.707 2.026 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.836 -9.495 0.816 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.551 -10.348 -0.688 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -18.876 -10.629 2.258 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.436 -10.797 -1.978 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -21.291 -11.020 2.023 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -20.849 -11.188 -2.213 1.00 0.00 H new ATOM 0 HH TYR A 76 -22.791 -11.433 -1.192 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.475 -12.961 -0.740 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.429 -14.155 -1.575 1.00 0.00 C ATOM 1212 C GLU A 77 -14.769 -15.312 -0.833 1.00 0.00 C ATOM 1213 O GLU A 77 -15.338 -16.399 -0.725 1.00 0.00 O ATOM 1214 CB GLU A 77 -14.670 -13.867 -2.872 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.347 -12.833 -3.756 1.00 0.00 C ATOM 1216 CD GLU A 77 -15.047 -13.038 -5.228 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -15.710 -13.891 -5.856 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -14.149 -12.347 -5.753 1.00 0.00 O ATOM 0 H GLU A 77 -14.810 -12.235 -1.006 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.453 -14.439 -1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -13.666 -13.521 -2.626 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.559 -14.795 -3.432 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.425 -12.876 -3.599 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -15.021 -11.836 -3.458 1.00 0.00 H new ATOM 1225 N GLY A 78 -13.565 -15.073 -0.323 1.00 0.00 N ATOM 1226 CA GLY A 78 -12.847 -16.105 0.403 1.00 0.00 C ATOM 1227 C GLY A 78 -11.439 -16.307 -0.120 1.00 0.00 C ATOM 1228 O GLY A 78 -10.978 -17.440 -0.261 1.00 0.00 O ATOM 0 H GLY A 78 -13.073 -14.183 -0.400 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -12.805 -15.839 1.459 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.396 -17.044 0.332 1.00 0.00 H new ATOM 1232 N VAL A 79 -10.753 -15.207 -0.408 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.388 -15.268 -0.918 1.00 0.00 C ATOM 1234 C VAL A 79 -8.382 -14.869 0.156 1.00 0.00 C ATOM 1235 O VAL A 79 -8.246 -13.691 0.487 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.205 -14.352 -2.142 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -7.840 -14.571 -2.776 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.316 -14.585 -3.155 1.00 0.00 C ATOM 0 H VAL A 79 -11.120 -14.262 -0.297 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.207 -16.301 -1.216 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.261 -13.316 -1.808 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.730 -13.915 -3.639 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.060 -14.347 -2.048 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.750 -15.609 -3.096 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.170 -13.929 -4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.296 -15.624 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.280 -14.370 -2.694 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.678 -15.859 0.696 1.00 0.00 N ATOM 1249 CA ALA A 80 -6.684 -15.612 1.733 1.00 0.00 C ATOM 1250 C ALA A 80 -5.381 -15.093 1.132 1.00 0.00 C ATOM 1251 O ALA A 80 -4.748 -14.192 1.682 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.430 -16.880 2.533 1.00 0.00 C ATOM 0 H ALA A 80 -7.778 -16.839 0.432 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.076 -14.846 2.402 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.686 -16.681 3.304 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.358 -17.207 3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.064 -17.662 1.868 1.00 0.00 H new ATOM 1258 N VAL A 81 -4.987 -15.668 0.001 1.00 0.00 N ATOM 1259 CA VAL A 81 -3.760 -15.263 -0.674 1.00 0.00 C ATOM 1260 C VAL A 81 -4.041 -14.211 -1.741 1.00 0.00 C ATOM 1261 O VAL A 81 -4.975 -14.348 -2.530 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.055 -16.466 -1.330 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -1.684 -16.063 -1.849 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -2.943 -17.621 -0.346 1.00 0.00 C ATOM 0 H VAL A 81 -5.499 -16.415 -0.467 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.106 -14.839 0.088 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.655 -16.798 -2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.201 -16.925 -2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.794 -15.271 -2.590 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.073 -15.704 -1.021 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.443 -18.461 -0.827 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.366 -17.304 0.523 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -3.940 -17.926 -0.028 1.00 0.00 H new ATOM 1274 N MET A 82 -3.226 -13.161 -1.759 1.00 0.00 N ATOM 1275 CA MET A 82 -3.387 -12.085 -2.729 1.00 0.00 C ATOM 1276 C MET A 82 -2.240 -12.083 -3.735 1.00 0.00 C ATOM 1277 O MET A 82 -1.093 -12.356 -3.384 1.00 0.00 O ATOM 1278 CB MET A 82 -3.456 -10.734 -2.016 1.00 0.00 C ATOM 1279 CG MET A 82 -3.670 -9.559 -2.955 1.00 0.00 C ATOM 1280 SD MET A 82 -3.016 -8.014 -2.295 1.00 0.00 S ATOM 1281 CE MET A 82 -4.021 -6.819 -3.173 1.00 0.00 C ATOM 0 H MET A 82 -2.447 -13.033 -1.113 1.00 0.00 H new ATOM 0 HA MET A 82 -4.319 -12.252 -3.268 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.267 -10.758 -1.288 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.532 -10.579 -1.459 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.193 -9.772 -3.912 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.736 -9.444 -3.149 1.00 0.00 H new ATOM 0 HE1 MET A 82 -3.391 -6.239 -3.847 1.00 0.00 H new ATOM 0 HE2 MET A 82 -4.786 -7.340 -3.749 1.00 0.00 H new ATOM 0 HE3 MET A 82 -4.499 -6.150 -2.458 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.560 -11.774 -4.988 1.00 0.00 N ATOM 1292 CA LYS A 83 -1.556 -11.736 -6.045 1.00 0.00 C ATOM 1293 C LYS A 83 -1.068 -10.311 -6.280 1.00 0.00 C ATOM 1294 O LYS A 83 -1.808 -9.466 -6.785 1.00 0.00 O ATOM 1295 CB LYS A 83 -2.129 -12.313 -7.341 1.00 0.00 C ATOM 1296 CG LYS A 83 -1.123 -12.361 -8.480 1.00 0.00 C ATOM 1297 CD LYS A 83 -1.258 -13.640 -9.290 1.00 0.00 C ATOM 1298 CE LYS A 83 -0.448 -14.774 -8.681 1.00 0.00 C ATOM 1299 NZ LYS A 83 -0.794 -14.997 -7.251 1.00 0.00 N ATOM 0 H LYS A 83 -3.506 -11.547 -5.296 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.708 -12.343 -5.729 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.497 -13.321 -7.149 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.986 -11.714 -7.649 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -1.269 -11.499 -9.132 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.113 -12.289 -8.077 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -2.308 -13.929 -9.343 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.924 -13.461 -10.312 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.625 -15.690 -9.245 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.615 -14.548 -8.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.351 -15.878 -6.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.447 -14.199 -6.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.827 -15.070 -7.151 1.00 0.00 H new ATOM 1313 N LEU A 84 0.181 -10.050 -5.910 1.00 0.00 N ATOM 1314 CA LEU A 84 0.768 -8.726 -6.081 1.00 0.00 C ATOM 1315 C LEU A 84 2.028 -8.795 -6.939 1.00 0.00 C ATOM 1316 O LEU A 84 2.915 -9.613 -6.694 1.00 0.00 O ATOM 1317 CB LEU A 84 1.098 -8.111 -4.719 1.00 0.00 C ATOM 1318 CG LEU A 84 -0.096 -7.509 -3.976 1.00 0.00 C ATOM 1319 CD1 LEU A 84 0.278 -7.189 -2.536 1.00 0.00 C ATOM 1320 CD2 LEU A 84 -0.592 -6.261 -4.689 1.00 0.00 C ATOM 0 H LEU A 84 0.806 -10.738 -5.490 1.00 0.00 H new ATOM 0 HA LEU A 84 0.038 -8.096 -6.589 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.549 -8.879 -4.090 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.849 -7.333 -4.860 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.902 -8.243 -3.966 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.583 -6.762 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.586 -8.103 -2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.100 -6.473 -2.524 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.442 -5.846 -4.147 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.209 -5.523 -4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.899 -6.519 -5.703 1.00 0.00 H new ATOM 1332 N PHE A 85 2.099 -7.930 -7.945 1.00 0.00 N ATOM 1333 CA PHE A 85 3.250 -7.891 -8.842 1.00 0.00 C ATOM 1334 C PHE A 85 3.424 -9.218 -9.576 1.00 0.00 C ATOM 1335 O PHE A 85 4.503 -9.515 -10.088 1.00 0.00 O ATOM 1336 CB PHE A 85 4.521 -7.558 -8.058 1.00 0.00 C ATOM 1337 CG PHE A 85 4.521 -6.176 -7.469 1.00 0.00 C ATOM 1338 CD1 PHE A 85 4.955 -5.091 -8.215 1.00 0.00 C ATOM 1339 CD2 PHE A 85 4.086 -5.961 -6.172 1.00 0.00 C ATOM 1340 CE1 PHE A 85 4.957 -3.818 -7.677 1.00 0.00 C ATOM 1341 CE2 PHE A 85 4.085 -4.691 -5.628 1.00 0.00 C ATOM 1342 CZ PHE A 85 4.520 -3.619 -6.382 1.00 0.00 C ATOM 0 H PHE A 85 1.373 -7.246 -8.160 1.00 0.00 H new ATOM 0 HA PHE A 85 3.071 -7.112 -9.583 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.644 -8.286 -7.256 1.00 0.00 H new ATOM 0 HB3 PHE A 85 5.382 -7.663 -8.718 1.00 0.00 H new ATOM 0 HD1 PHE A 85 5.296 -5.242 -9.229 1.00 0.00 H new ATOM 0 HD2 PHE A 85 3.743 -6.796 -5.579 1.00 0.00 H new ATOM 0 HE1 PHE A 85 5.299 -2.981 -8.268 1.00 0.00 H new ATOM 0 HE2 PHE A 85 3.745 -4.537 -4.615 1.00 0.00 H new ATOM 0 HZ PHE A 85 4.518 -2.625 -5.959 1.00 0.00 H new ATOM 1352 N ASP A 86 2.356 -10.012 -9.628 1.00 0.00 N ATOM 1353 CA ASP A 86 2.395 -11.306 -10.305 1.00 0.00 C ATOM 1354 C ASP A 86 3.558 -12.158 -9.801 1.00 0.00 C ATOM 1355 O ASP A 86 4.236 -12.824 -10.583 1.00 0.00 O ATOM 1356 CB ASP A 86 2.509 -11.109 -11.817 1.00 0.00 C ATOM 1357 CG ASP A 86 2.169 -12.367 -12.591 1.00 0.00 C ATOM 1358 OD1 ASP A 86 1.284 -13.122 -12.136 1.00 0.00 O ATOM 1359 OD2 ASP A 86 2.788 -12.598 -13.651 1.00 0.00 O ATOM 0 H ASP A 86 1.454 -9.782 -9.210 1.00 0.00 H new ATOM 0 HA ASP A 86 1.466 -11.830 -10.081 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.843 -10.304 -12.127 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.523 -10.796 -12.064 1.00 0.00 H new ATOM 1364 N ARG A 87 3.782 -12.132 -8.492 1.00 0.00 N ATOM 1365 CA ARG A 87 4.863 -12.904 -7.888 1.00 0.00 C ATOM 1366 C ARG A 87 4.672 -13.021 -6.378 1.00 0.00 C ATOM 1367 O ARG A 87 4.250 -14.062 -5.875 1.00 0.00 O ATOM 1368 CB ARG A 87 6.215 -12.257 -8.201 1.00 0.00 C ATOM 1369 CG ARG A 87 7.113 -13.117 -9.074 1.00 0.00 C ATOM 1370 CD ARG A 87 8.105 -12.272 -9.856 1.00 0.00 C ATOM 1371 NE ARG A 87 8.945 -13.084 -10.733 1.00 0.00 N ATOM 1372 CZ ARG A 87 8.507 -13.667 -11.847 1.00 0.00 C ATOM 1373 NH1 ARG A 87 7.242 -13.530 -12.224 1.00 0.00 N ATOM 1374 NH2 ARG A 87 9.339 -14.389 -12.588 1.00 0.00 N ATOM 0 H ARG A 87 3.231 -11.586 -7.829 1.00 0.00 H new ATOM 0 HA ARG A 87 4.843 -13.907 -8.313 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.045 -11.302 -8.699 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.731 -12.041 -7.265 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.653 -13.830 -8.451 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.502 -13.697 -9.766 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.564 -11.536 -10.451 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.736 -11.718 -9.161 1.00 0.00 H new ATOM 0 HE ARG A 87 9.924 -13.212 -10.477 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.599 -12.975 -11.659 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.913 -13.979 -13.079 1.00 0.00 H new ATOM 0 HH21 ARG A 87 10.313 -14.497 -12.304 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.005 -14.836 -13.442 1.00 0.00 H new ATOM 1388 N ALA A 88 4.989 -11.948 -5.662 1.00 0.00 N ATOM 1389 CA ALA A 88 4.855 -11.931 -4.210 1.00 0.00 C ATOM 1390 C ALA A 88 3.411 -12.183 -3.787 1.00 0.00 C ATOM 1391 O ALA A 88 2.482 -11.585 -4.330 1.00 0.00 O ATOM 1392 CB ALA A 88 5.346 -10.605 -3.650 1.00 0.00 C ATOM 0 H ALA A 88 5.341 -11.079 -6.063 1.00 0.00 H new ATOM 0 HA ALA A 88 5.470 -12.735 -3.805 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.240 -10.607 -2.565 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.395 -10.465 -3.912 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.756 -9.791 -4.071 1.00 0.00 H new ATOM 1398 N LYS A 89 3.232 -13.071 -2.814 1.00 0.00 N ATOM 1399 CA LYS A 89 1.902 -13.402 -2.317 1.00 0.00 C ATOM 1400 C LYS A 89 1.720 -12.902 -0.887 1.00 0.00 C ATOM 1401 O LYS A 89 2.529 -13.199 -0.008 1.00 0.00 O ATOM 1402 CB LYS A 89 1.674 -14.913 -2.376 1.00 0.00 C ATOM 1403 CG LYS A 89 1.263 -15.412 -3.752 1.00 0.00 C ATOM 1404 CD LYS A 89 1.073 -16.920 -3.764 1.00 0.00 C ATOM 1405 CE LYS A 89 1.095 -17.475 -5.180 1.00 0.00 C ATOM 1406 NZ LYS A 89 -0.177 -18.169 -5.523 1.00 0.00 N ATOM 0 H LYS A 89 3.991 -13.574 -2.355 1.00 0.00 H new ATOM 0 HA LYS A 89 1.168 -12.908 -2.953 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.588 -15.422 -2.072 1.00 0.00 H new ATOM 0 HB3 LYS A 89 0.903 -15.184 -1.655 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.336 -14.925 -4.055 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.023 -15.134 -4.483 1.00 0.00 H new ATOM 0 HD2 LYS A 89 1.860 -17.391 -3.175 1.00 0.00 H new ATOM 0 HD3 LYS A 89 0.125 -17.172 -3.288 1.00 0.00 H new ATOM 0 HE2 LYS A 89 1.267 -16.663 -5.886 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.928 -18.170 -5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -0.123 -18.533 -6.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.329 -18.960 -4.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -0.969 -17.499 -5.448 1.00 0.00 H new ATOM 1420 N VAL A 90 0.653 -12.142 -0.662 1.00 0.00 N ATOM 1421 CA VAL A 90 0.367 -11.600 0.661 1.00 0.00 C ATOM 1422 C VAL A 90 -0.980 -12.094 1.178 1.00 0.00 C ATOM 1423 O VAL A 90 -1.883 -12.399 0.398 1.00 0.00 O ATOM 1424 CB VAL A 90 0.365 -10.061 0.650 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.283 -9.515 2.066 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.601 -9.530 -0.063 1.00 0.00 C ATOM 0 H VAL A 90 -0.027 -11.888 -1.378 1.00 0.00 H new ATOM 0 HA VAL A 90 1.159 -11.950 1.323 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.516 -9.722 0.104 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.283 -8.425 2.036 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.635 -9.865 2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.142 -9.862 2.640 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.582 -8.440 -0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.496 -9.879 0.452 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.611 -9.891 -1.092 1.00 0.00 H new ATOM 1436 N ASN A 91 -1.110 -12.169 2.498 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.347 -12.624 3.122 1.00 0.00 C ATOM 1438 C ASN A 91 -3.288 -11.452 3.378 1.00 0.00 C ATOM 1439 O ASN A 91 -2.969 -10.543 4.143 1.00 0.00 O ATOM 1440 CB ASN A 91 -2.042 -13.345 4.436 1.00 0.00 C ATOM 1441 CG ASN A 91 -3.202 -14.198 4.910 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -3.948 -14.755 4.104 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.360 -14.306 6.224 1.00 0.00 N ATOM 0 H ASN A 91 -0.373 -11.920 3.157 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.837 -13.318 2.440 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.161 -13.974 4.306 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.798 -12.610 5.203 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.123 -14.868 6.601 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.718 -13.827 6.856 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.450 -11.480 2.733 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.438 -10.419 2.890 1.00 0.00 C ATOM 1452 C VAL A 92 -5.966 -10.367 4.321 1.00 0.00 C ATOM 1453 O VAL A 92 -6.348 -9.305 4.814 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.624 -10.605 1.924 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.547 -9.397 1.972 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -6.128 -10.853 0.507 1.00 0.00 C ATOM 0 H VAL A 92 -4.730 -12.226 2.097 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.934 -9.481 2.656 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.192 -11.479 2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.378 -9.547 1.283 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.932 -9.273 2.984 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.993 -8.504 1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.981 -10.982 -0.160 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.533 -10.002 0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.514 -11.753 0.489 1.00 0.00 H new ATOM 1466 N ASN A 93 -5.988 -11.520 4.982 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.471 -11.606 6.355 1.00 0.00 C ATOM 1468 C ASN A 93 -5.574 -10.816 7.303 1.00 0.00 C ATOM 1469 O ASN A 93 -6.044 -10.253 8.293 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.543 -13.068 6.800 1.00 0.00 C ATOM 1471 CG ASN A 93 -7.926 -13.662 6.619 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.377 -13.879 5.495 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -8.606 -13.926 7.728 1.00 0.00 N ATOM 0 H ASN A 93 -5.677 -12.408 4.588 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.470 -11.172 6.389 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.822 -13.654 6.230 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.254 -13.140 7.849 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.543 -14.325 7.669 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -8.192 -13.729 8.639 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.281 -10.780 6.998 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.319 -10.062 7.828 1.00 0.00 C ATOM 1482 C LEU A 94 -2.937 -8.725 7.196 1.00 0.00 C ATOM 1483 O LEU A 94 -2.557 -7.786 7.895 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.066 -10.913 8.043 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.235 -12.075 9.025 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.185 -13.146 8.768 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.149 -11.575 10.459 1.00 0.00 C ATOM 0 H LEU A 94 -3.875 -11.239 6.183 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.788 -9.864 8.792 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.747 -11.314 7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.264 -10.268 8.401 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.220 -12.516 8.873 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.320 -13.965 9.475 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.292 -13.523 7.751 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.190 -12.718 8.894 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.271 -12.414 11.145 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.177 -11.110 10.624 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.937 -10.843 10.637 1.00 0.00 H new ATOM 1499 N LEU A 95 -3.038 -8.646 5.873 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.701 -7.424 5.151 1.00 0.00 C ATOM 1501 C LEU A 95 -3.509 -6.238 5.670 1.00 0.00 C ATOM 1502 O LEU A 95 -2.951 -5.196 6.014 1.00 0.00 O ATOM 1503 CB LEU A 95 -2.947 -7.607 3.653 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.452 -6.461 2.769 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -0.932 -6.412 2.760 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -2.993 -6.607 1.355 1.00 0.00 C ATOM 0 H LEU A 95 -3.351 -9.414 5.279 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.644 -7.217 5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.463 -8.529 3.331 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.017 -7.735 3.489 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.822 -5.522 3.182 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.598 -5.591 2.126 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.567 -6.258 3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.540 -7.352 2.372 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.631 -5.783 0.740 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.654 -7.552 0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.083 -6.590 1.379 1.00 0.00 H new ATOM 1518 N ILE A 96 -4.827 -6.404 5.723 1.00 0.00 N ATOM 1519 CA ILE A 96 -5.711 -5.348 6.199 1.00 0.00 C ATOM 1520 C ILE A 96 -5.559 -5.141 7.703 1.00 0.00 C ATOM 1521 O ILE A 96 -5.735 -4.032 8.207 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.187 -5.664 5.881 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.349 -6.022 4.403 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.073 -4.481 6.245 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.529 -6.926 4.127 1.00 0.00 C ATOM 0 H ILE A 96 -5.305 -7.260 5.442 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.423 -4.435 5.678 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.495 -6.522 6.479 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.461 -5.104 3.825 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.439 -6.509 4.053 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.111 -4.720 6.015 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -7.977 -4.269 7.310 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -7.766 -3.606 5.672 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.583 -7.138 3.059 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.409 -7.859 4.677 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.447 -6.433 4.445 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.231 -6.215 8.412 1.00 0.00 N ATOM 1538 CA PHE A 97 -5.056 -6.152 9.859 1.00 0.00 C ATOM 1539 C PHE A 97 -3.892 -5.236 10.228 1.00 0.00 C ATOM 1540 O PHE A 97 -3.909 -4.586 11.273 1.00 0.00 O ATOM 1541 CB PHE A 97 -4.817 -7.552 10.426 1.00 0.00 C ATOM 1542 CG PHE A 97 -5.312 -7.721 11.834 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -6.659 -7.924 12.090 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -4.430 -7.679 12.903 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -7.117 -8.079 13.385 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -4.882 -7.833 14.199 1.00 0.00 C ATOM 1547 CZ PHE A 97 -6.227 -8.034 14.440 1.00 0.00 C ATOM 0 H PHE A 97 -5.081 -7.140 8.009 1.00 0.00 H new ATOM 0 HA PHE A 97 -5.968 -5.742 10.292 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.310 -8.284 9.786 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -3.749 -7.770 10.396 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -7.359 -7.962 11.268 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -3.377 -7.524 12.720 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -8.169 -8.235 13.571 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -4.185 -7.796 15.023 1.00 0.00 H new ATOM 0 HZ PHE A 97 -6.582 -8.156 15.453 1.00 0.00 H new ATOM 1557 N LEU A 98 -2.883 -5.193 9.366 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.711 -4.357 9.603 1.00 0.00 C ATOM 1559 C LEU A 98 -2.008 -2.895 9.286 1.00 0.00 C ATOM 1560 O LEU A 98 -1.756 -2.009 10.101 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.533 -4.845 8.758 1.00 0.00 C ATOM 1562 CG LEU A 98 0.833 -4.289 9.168 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.529 -5.243 10.127 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.697 -4.039 7.941 1.00 0.00 C ATOM 0 H LEU A 98 -2.852 -5.727 8.497 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.450 -4.433 10.659 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.495 -5.933 8.809 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.718 -4.581 7.717 1.00 0.00 H new ATOM 0 HG LEU A 98 0.680 -3.338 9.679 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.499 -4.833 10.409 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.917 -5.373 11.020 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.671 -6.208 9.641 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.664 -3.644 8.251 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.843 -4.975 7.402 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.203 -3.319 7.289 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.545 -2.650 8.095 1.00 0.00 N ATOM 1577 CA LEU A 99 -2.876 -1.295 7.668 1.00 0.00 C ATOM 1578 C LEU A 99 -3.873 -0.649 8.625 1.00 0.00 C ATOM 1579 O LEU A 99 -3.845 0.563 8.841 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.452 -1.311 6.251 1.00 0.00 C ATOM 1581 CG LEU A 99 -2.572 -1.993 5.202 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -3.430 -2.685 4.154 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -1.643 -0.981 4.549 1.00 0.00 C ATOM 0 H LEU A 99 -2.760 -3.373 7.408 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.959 -0.706 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.419 -1.813 6.274 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.634 -0.283 5.938 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.964 -2.748 5.700 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.787 -3.165 3.416 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.055 -3.438 4.635 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.064 -1.949 3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.024 -1.482 3.805 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.234 -0.204 4.065 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.004 -0.530 5.309 1.00 0.00 H new ATOM 1595 N ASN A 100 -4.754 -1.465 9.194 1.00 0.00 N ATOM 1596 CA ASN A 100 -5.764 -0.976 10.127 1.00 0.00 C ATOM 1597 C ASN A 100 -5.123 -0.232 11.296 1.00 0.00 C ATOM 1598 O ASN A 100 -5.740 0.650 11.894 1.00 0.00 O ATOM 1599 CB ASN A 100 -6.611 -2.141 10.648 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.094 -1.925 10.422 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.826 -1.554 11.340 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -8.545 -2.157 9.195 1.00 0.00 N ATOM 0 H ASN A 100 -4.789 -2.470 9.025 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.406 -0.277 9.591 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.301 -3.061 10.153 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.424 -2.274 11.714 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -9.534 -2.029 8.983 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -7.902 -2.463 8.465 1.00 0.00 H new ATOM 1609 N LYS A 101 -3.885 -0.593 11.619 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.167 0.043 12.719 1.00 0.00 C ATOM 1611 C LYS A 101 -2.011 0.895 12.202 1.00 0.00 C ATOM 1612 O LYS A 101 -1.630 1.883 12.829 1.00 0.00 O ATOM 1613 CB LYS A 101 -2.642 -1.018 13.689 1.00 0.00 C ATOM 1614 CG LYS A 101 -3.593 -1.315 14.838 1.00 0.00 C ATOM 1615 CD LYS A 101 -3.201 -2.588 15.571 1.00 0.00 C ATOM 1616 CE LYS A 101 -3.748 -3.823 14.874 1.00 0.00 C ATOM 1617 NZ LYS A 101 -3.256 -5.080 15.502 1.00 0.00 N ATOM 0 H LYS A 101 -3.359 -1.321 11.136 1.00 0.00 H new ATOM 0 HA LYS A 101 -3.864 0.697 13.244 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.451 -1.939 13.139 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -1.687 -0.686 14.095 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.595 -0.478 15.536 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.609 -1.413 14.455 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.115 -2.654 15.632 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.576 -2.550 16.594 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -4.837 -3.804 14.905 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.458 -3.805 13.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -3.755 -5.893 15.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.235 -5.177 15.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -3.435 -5.049 16.526 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.456 0.505 11.060 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.342 1.235 10.465 1.00 0.00 C ATOM 1633 C LYS A 102 -0.807 2.564 9.879 1.00 0.00 C ATOM 1634 O LYS A 102 -0.564 3.626 10.454 1.00 0.00 O ATOM 1635 CB LYS A 102 0.325 0.391 9.377 1.00 0.00 C ATOM 1636 CG LYS A 102 1.093 -0.803 9.919 1.00 0.00 C ATOM 1637 CD LYS A 102 2.161 -0.374 10.912 1.00 0.00 C ATOM 1638 CE LYS A 102 3.367 -1.298 10.868 1.00 0.00 C ATOM 1639 NZ LYS A 102 3.923 -1.552 12.226 1.00 0.00 N ATOM 0 H LYS A 102 -1.758 -0.311 10.528 1.00 0.00 H new ATOM 0 HA LYS A 102 0.383 1.442 11.252 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.438 0.037 8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.006 1.022 8.806 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.401 -1.493 10.402 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.558 -1.343 9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.475 0.646 10.692 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.742 -0.368 11.918 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.082 -2.245 10.410 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.139 -0.858 10.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 4.961 -1.587 12.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 3.633 -0.787 12.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 3.564 -2.460 12.584 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.473 2.501 8.730 1.00 0.00 N ATOM 1654 CA PHE A 103 -1.967 3.702 8.065 1.00 0.00 C ATOM 1655 C PHE A 103 -3.316 4.128 8.633 1.00 0.00 C ATOM 1656 O PHE A 103 -3.508 5.289 8.997 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.089 3.461 6.559 1.00 0.00 C ATOM 1658 CG PHE A 103 -0.765 3.317 5.865 1.00 0.00 C ATOM 1659 CD1 PHE A 103 -0.061 4.434 5.447 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -0.223 2.063 5.633 1.00 0.00 C ATOM 1661 CE1 PHE A 103 1.158 4.305 4.808 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.995 1.926 4.994 1.00 0.00 C ATOM 1663 CZ PHE A 103 1.686 3.049 4.582 1.00 0.00 C ATOM 0 H PHE A 103 -1.683 1.631 8.240 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.251 4.504 8.243 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.678 2.560 6.390 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.637 4.289 6.110 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.470 5.418 5.622 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -0.759 1.182 5.955 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.696 5.184 4.486 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.406 0.943 4.817 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.638 2.945 4.084 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.250 3.185 8.704 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.584 3.467 9.226 1.00 0.00 C ATOM 1675 C TYR A 104 -5.508 4.039 10.639 1.00 0.00 C ATOM 1676 O TYR A 104 -5.491 3.296 11.621 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.436 2.196 9.220 1.00 0.00 C ATOM 1678 CG TYR A 104 -7.778 2.370 8.544 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -8.870 2.865 9.245 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -7.951 2.039 7.206 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -10.097 3.026 8.631 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -9.174 2.197 6.585 1.00 0.00 C ATOM 1683 CZ TYR A 104 -10.245 2.691 7.301 1.00 0.00 C ATOM 1684 OH TYR A 104 -11.465 2.850 6.686 1.00 0.00 O ATOM 0 H TYR A 104 -4.109 2.219 8.407 1.00 0.00 H new ATOM 0 HA TYR A 104 -6.050 4.211 8.579 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -5.885 1.402 8.716 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -6.596 1.871 10.248 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -8.758 3.128 10.286 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -7.115 1.652 6.642 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -10.937 3.412 9.190 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -9.292 1.935 5.544 1.00 0.00 H new ATOM 0 HH TYR A 104 -11.398 2.569 5.750 1.00 0.00 H new ATOM 1694 N GLY A 105 -5.464 5.364 10.732 1.00 0.00 N ATOM 1695 CA GLY A 105 -5.391 6.015 12.028 1.00 0.00 C ATOM 1696 C GLY A 105 -5.408 7.527 11.918 1.00 0.00 C ATOM 1697 O GLY A 105 -4.519 8.203 12.436 1.00 0.00 O ATOM 0 H GLY A 105 -5.478 5.999 9.934 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.230 5.689 12.643 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.481 5.701 12.538 1.00 0.00 H new ATOM 1701 N LYS A 106 -6.421 8.058 11.243 1.00 0.00 N ATOM 1702 CA LYS A 106 -6.550 9.501 11.067 1.00 0.00 C ATOM 1703 C LYS A 106 -6.748 10.197 12.410 1.00 0.00 C ATOM 1704 O LYS A 106 -6.021 11.132 12.749 1.00 0.00 O ATOM 1705 CB LYS A 106 -7.720 9.819 10.133 1.00 0.00 C ATOM 1706 CG LYS A 106 -7.292 10.119 8.706 1.00 0.00 C ATOM 1707 CD LYS A 106 -8.332 9.648 7.701 1.00 0.00 C ATOM 1708 CE LYS A 106 -9.612 10.464 7.796 1.00 0.00 C ATOM 1709 NZ LYS A 106 -10.034 10.993 6.471 1.00 0.00 N ATOM 0 H LYS A 106 -7.165 7.512 10.809 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.628 9.873 10.620 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -8.410 8.975 10.127 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -8.267 10.675 10.527 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.133 11.191 8.591 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.339 9.631 8.501 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.925 9.724 6.693 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.557 8.596 7.875 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.408 9.844 8.209 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.463 11.294 8.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.051 11.208 6.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -9.501 11.860 6.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -9.845 10.281 5.737 1.00 0.00 H new ATOM 1723 N SER A 107 -7.735 9.735 13.171 1.00 0.00 N ATOM 1724 CA SER A 107 -8.028 10.313 14.477 1.00 0.00 C ATOM 1725 C SER A 107 -7.333 9.530 15.586 1.00 0.00 C ATOM 1726 O SER A 107 -6.761 10.113 16.508 1.00 0.00 O ATOM 1727 CB SER A 107 -9.538 10.334 14.721 1.00 0.00 C ATOM 1728 OG SER A 107 -10.176 9.256 14.059 1.00 0.00 O ATOM 0 H SER A 107 -8.345 8.962 12.905 1.00 0.00 H new ATOM 0 HA SER A 107 -7.651 11.336 14.487 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.738 10.277 15.791 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.953 11.278 14.369 1.00 0.00 H new ATOM 0 HG SER A 107 -11.140 9.291 14.232 1.00 0.00 H new ATOM 1734 N GLY A 108 -7.386 8.206 15.490 1.00 0.00 N ATOM 1735 CA GLY A 108 -6.758 7.362 16.490 1.00 0.00 C ATOM 1736 C GLY A 108 -7.476 7.417 17.828 1.00 0.00 C ATOM 1737 O GLY A 108 -7.793 8.500 18.317 1.00 0.00 O ATOM 0 H GLY A 108 -7.853 7.702 14.737 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.739 6.332 16.133 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -5.722 7.672 16.624 1.00 0.00 H new ATOM 1741 N PRO A 109 -7.749 6.256 18.451 1.00 0.00 N ATOM 1742 CA PRO A 109 -8.437 6.199 19.744 1.00 0.00 C ATOM 1743 C PRO A 109 -7.542 6.639 20.898 1.00 0.00 C ATOM 1744 O PRO A 109 -6.346 6.865 20.717 1.00 0.00 O ATOM 1745 CB PRO A 109 -8.802 4.722 19.883 1.00 0.00 C ATOM 1746 CG PRO A 109 -7.764 4.003 19.094 1.00 0.00 C ATOM 1747 CD PRO A 109 -7.411 4.910 17.946 1.00 0.00 C ATOM 0 HA PRO A 109 -9.295 6.870 19.780 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -8.795 4.408 20.927 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -9.802 4.523 19.497 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -6.888 3.789 19.706 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -8.142 3.046 18.733 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -6.356 4.833 17.684 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -7.981 4.663 17.050 1.00 0.00 H new ATOM 1755 N SER A 110 -8.129 6.757 22.084 1.00 0.00 N ATOM 1756 CA SER A 110 -7.386 7.169 23.269 1.00 0.00 C ATOM 1757 C SER A 110 -8.120 6.755 24.540 1.00 0.00 C ATOM 1758 O SER A 110 -9.311 6.444 24.508 1.00 0.00 O ATOM 1759 CB SER A 110 -7.166 8.683 23.257 1.00 0.00 C ATOM 1760 OG SER A 110 -5.799 8.998 23.050 1.00 0.00 O ATOM 0 H SER A 110 -9.118 6.573 22.250 1.00 0.00 H new ATOM 0 HA SER A 110 -6.417 6.671 23.254 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.770 9.135 22.470 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.502 9.110 24.202 1.00 0.00 H new ATOM 0 HG SER A 110 -5.685 9.971 23.045 1.00 0.00 H new ATOM 1766 N SER A 111 -7.402 6.753 25.658 1.00 0.00 N ATOM 1767 CA SER A 111 -7.987 6.377 26.941 1.00 0.00 C ATOM 1768 C SER A 111 -8.503 4.943 26.904 1.00 0.00 C ATOM 1769 O SER A 111 -8.524 4.309 25.849 1.00 0.00 O ATOM 1770 CB SER A 111 -9.125 7.332 27.306 1.00 0.00 C ATOM 1771 OG SER A 111 -9.659 7.025 28.582 1.00 0.00 O ATOM 0 H SER A 111 -6.415 7.007 25.702 1.00 0.00 H new ATOM 0 HA SER A 111 -7.208 6.444 27.701 1.00 0.00 H new ATOM 0 HB2 SER A 111 -8.759 8.359 27.299 1.00 0.00 H new ATOM 0 HB3 SER A 111 -9.912 7.269 26.554 1.00 0.00 H new ATOM 0 HG SER A 111 -10.383 7.651 28.793 1.00 0.00 H new ATOM 1777 N GLY A 112 -8.917 4.438 28.061 1.00 0.00 N ATOM 1778 CA GLY A 112 -9.428 3.081 28.137 1.00 0.00 C ATOM 1779 C GLY A 112 -9.842 2.695 29.543 1.00 0.00 C ATOM 1780 O GLY A 112 -8.951 2.545 30.404 1.00 0.00 O ATOM 1781 OXT GLY A 112 -11.058 2.545 29.783 1.00 0.00 O ATOM 0 H GLY A 112 -8.908 4.943 28.947 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -10.284 2.980 27.469 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -8.664 2.388 27.783 1.00 0.00 H new TER 1785 GLY A 112